*HEADER    GENE REGULATING PROTEIN                 18-NOV-91   1PRA    
*COMPND    REPRESSOR PROTEIN FROM BACTERIOPHAGE 434 (DNA-BINDING       
*COMPND   2 DOMAIN, RESIDUES 1-69) (NMR, 20 STRUCTURES)                
*SOURCE    BACTERIOPHAGE 434                                           
*AUTHOR    D.NERI,M.BILLETER,K.WUTHRICH                                
*REVDAT   1   31-OCT-93 1PRA    0                                      

REMARK   1                                                              1REP   8
REMARK   1 THIS FILE CONTAINS DATA THAT WAS USED IN THE DETERMINATION   1REP   9
REMARK   1 OF THE THREE-DIMENSIONAL STRUCTURE OF THE 434 REPRESSOR      1REP  10
REMARK   1 (1-69) BY NUCLEAR MAGNETIC RESONANCE IN SOLUTION.            1REP  11
REMARK   1 THE DIFFERENT KINDS OF DATA TOGETHER WITH THE CORRESPONDING  1REP  12
REMARK   1 RECORD IDENTIFIERS ARE GIVEN IN THE FOLLOWING TABLE. SEE     1REP  13
REMARK   1 REMARK 2 FOR THE DETAILS.                                    1REP  14
REMARK   1                                                              1REP  15
REMARK   1 RECORD CONTENT                                     UNIT      1REP  16
REMARK   1 ------ ------------------------------------------- --------- 1REP  17
REMARK   1 SHIFTS CHEMICAL SHIFTS OF THE ASSIGNED PROTONS     PPM       1REP  18
REMARK   1 JCOUPL VICINAL 1H-1H SCALAR COUPLING CONSTANTS     HERTZ     1REP  19
REMARK   1 NOEUPP UPPER LIMITS FOR INTERATOMIC DISTANCES      ANGSTROMS 1REP  20
REMARK   1        DETERMINED FROM NUCLEAR OVERHAUSER EFFECTS            1REP  21
REMARK   1 HBUPP  UPPER LIMITS FOR INTERATOMIC DISTANCES      ANGSTROMS 1REP  22
REMARK   1        FOR HYDROGEN BONDS                                    1REP  23
REMARK   1 NOELOW LOWER LIMITS FOR INTERATOMIC DISTANCES      ANGSTROMS 1REP  26
REMARK   1        DETERMINED FROM NUCLEAR OVERHAUSER EFFECTS            1REP  27
REMARK   1        (NOT USED HERE)                                       1REP  28
REMARK   1 HBLOW  LOWER LIMITS FOR INTERATOMIC DISTANCES      ANGSTROMS 1REP  29
REMARK   1        FOR HYDROGEN BONDS                                    1REP  30
REMARK   1 ANGLE  TORSION ANGLE CONSTRAINTS IN THE FORM OF    DEGREES   1REP  33
REMARK   1        AN ALLOWED INTERVAL                                   1REP  34
REMARK   1                                                              1REP  35
REMARK   1 ALL EXPERIMENTAL INPUT DATA (EXCEPT THE AMINO ACID SEQUENCE) 1REP  36
REMARK   1 FOR THE DISTANCE GEOMETRY CALCULATIONS WITH THE PROGRAM      1REP  37
REMARK   1 DISMAN AND REFINEMENT WITH AMBER IS GIVEN IN THE RECORDS     1REP  38
REMARK   1 NOEUPP, HBUPP, HBLOW  AND ANGLE.                             1REP  39
REMARK   2                                                              1REP  41
REMARK   2 THE NEXT TABLE CONTAINS A DETAILED DESCRIPTION OF THE        1REP  42
REMARK   2 CONTENTS AND FORMATS OF THE VARIOUS DATA RECORDS AND THE     1REP  43
REMARK   2 MASTER RECORD.                                               1REP  44
REMARK   2                                                              1REP  45
REMARK   2 RECORD CONTENTS (FORTRAN FORMAT)                             1REP  46
REMARK   2 ------ ----------------------------------------------------- 1REP  47
REMARK   2 SHIFTS RESIDUE NAME, RESIDUE NUMBER, ATOM NAME, CHEMICAL     1REP  48
REMARK   2        SHIFT(S), ATOM NAME, CHEMICAL SHIFT(S), ATOM NAME,    1REP  49
REMARK   2        CHEMICAL SHIFT(S)                                     1REP  50
REMARK   2        ('SHIFTS',2X,A4,I4,2X,3(A4,2F6.2,2X))                 1REP  51
REMARK   2 JCOUPL RESIDUE NAME, RESIDUE NUMBER, FIRST AND SECOND ATOM   1REP  52
REMARK   2        NAME, J-COUPLING CONSTANT, FIRST AND SECOND ATOM      1REP  53
REMARK   2        NAME, J-COUPLING CONSTANT, FIRST AND SECOND ATOM      1REP  54
REMARK   2        NAME, J-COUPLING CONSTANT                             1REP  55
REMARK   2        ('JCOUPL',2X,A4,I4,2X,3(A4,1X,A4,F6.2,3X))            1REP  56
REMARK   2 NOEUPP FIRST RESIDUE NAME, FIRST RESIDUE NUMBER, FIRST ATOM  1REP  57
REMARK   2        NAME, SECOND RESIDUE NAME, SECOND RESIDUE NUMBER,     1REP  58
REMARK   2        SECOND ATOM NAME, UPPER DISTANCE LIMIT, FIRST ATOM    1REP  59
REMARK   2        NAME, SECOND RESIDUE NAME, SECOND RESIDUE NUMBER,     1REP  60
REMARK   2        SECOND ATOM NAME, UPPER DISTANCE LIMIT                1REP  61
REMARK   2        ('NOEUPP',2X,A4,I4,1X,2(A4,1X,A4,I4,1X,A4,F6.2,5X))   1REP  62
REMARK   2 HBUPP  SIMILAR TO NOEUPP                                     1REP  63
REMARK   2 NOELOW SIMILAR TO NOEUPP, BUT WITH LOWER DISTANCE LIMITS     1REP  65
REMARK   2 HBLOW  SIMILAR TO NOELOW                                     1REP  66
REMARK   2 ANGLE  RESIDUE NAME, RESIDUE NUMBER, ANGLE NAME, LOWER AND   1REP  68
REMARK   2        UPPER BOUND, ANGLE NAME, LOWER AND UPPER BOUND        1REP  69
REMARK   2        ('ANGLE',3X,A4,I4,1X,2(A5,2F8.2,8X))                  1REP  70
REMARK   2 MASTER NUMBER OF REMARK RECORDS, NUMBER OF FTNOTE RECORDS,   1REP  71
REMARK   2        NUMBER OF SHIFTS RECORDS, NUMBER OF JCOUPL RECORDS,   1REP  72
REMARK   2        NUMBER OF NOEUPP, HBUPP AND SSUPP RECORDS, NUMBER OF  1REP  73
REMARK   2        NOELOW, HBLOW AND SSLOW RECORDS, NUMBER OF ANGLE      1REP  74
REMARK   2        RECORDS                                               1REP  75
REMARK   2        ('MASTER',4X,7I5)                                     1REP  76
REMARK   3                                                              1REP  77
REMARK   3 ATOM NAMES HAVE BEEN ASSIGNED FOLLOWING THE RECOMMENDATIONS  1REP  78
REMARK   3 OF THE IUPAC-IUB COMMISSION AS PUBLISHED IN BIOCHEMISTRY     1REP  79
REMARK   3 (1970) VOL. 9, 3471-3479, EXCEPT THAT BACKBONE AMIDE         1REP  80
REMARK   3 HYDROGENS ARE DENOTED BY HN INSTEAD OF H. THE HYDROGEN ATOM  1REP  81
REMARK   3 NUMBERS OF THOSE HYDROGEN ATOMS WHICH ARE CONNECTED TO THE   1REP  82
REMARK   3 SAME NON-HYDROGEN ATOM ARE WRITTEN AS THE FIRST CHARACTER    1REP  83
REMARK   3 RATHER THAN THE LAST CHARACTER OF THE ATOM NAMES.            1REP  84
REMARK   3 THEY ARE IDENTICAL WITH THE ATOM NAMES USED IN THE CO-       1REP  85
REMARK   3 ORDINATE FILE 1REP.                                          1REP  86
REMARK   4                                                              1REP  87
REMARK   4 PSEUDO-ATOMS DESIGNATED AS Q ARE DIMENSIONLESS REFERENCE     1REP  88
REMARK   4 POINTS REPRESENTING A GROUP OF HYDROGEN ATOMS                1REP  89
REMARK   4 (K.WUTHRICH, M.BILLETER AND W.BRAUN, J. MOL. BIOL. (1983)    1REP  90
REMARK   4 VOL. 169, 949-961). THEY ARE USED TO DESCRIBE ALL METHYL     1REP  91
REMARK   4 GROUPS, AND THOSE GROUPS OF PROCHIRAL HYDROGEN ATOMS FOR     1REP  92
REMARK   4 WHICH NO STEREOSPECIFIC ASSIGNMENTS HAD BEEN OBTAINED.       1REP  93
REMARK   4 FOR ALL METHYLENE GROUPS, EVEN IN CASE OF IDENTICAL SHIFTS,  1REP  94
REMARK   4 TWO CHEMICAL SHIFTS ARE LISTED FOR THE TWO PROTONS.          1REP  95
REMARK   4 TWO CHEMICAL SHIFTS ARE ALSO ALWAYS GIVEN FOR THE TWO        1REP  96
REMARK   4 METHYLS IN THE ISOPROPYL GROUPS.                             1REP  97
REMARK   5                                                              1REP  98
REMARK   5 DETAILS OF THE NOMENCLATURE FOR THE PSEUDO-ATOMS ARE         1REP  99
REMARK   5 AS FOLLOWS: QA REPRESENTS THE TWO METHYLENE HYDROGEN         1REP 100
REMARK   5 ATOMS OF GLY. QB, QG, ... REPRESENT BETA, GAMMA, ...         1REP 101
REMARK   5 METHYLENE OR METHYL GROUPS IN THE SIDE CHAINS. IN CASE OF    1REP 102
REMARK   5 BRANCHES IN THE SIDE CHAINS THE NUMBERS OF THE PSEUDO-ATOMS  1REP 103
REMARK   5 ARE THE SAME AS THE NUMBERS OF THE CARBONS TO WHICH THE      1REP 104
REMARK   5 HYDROGEN  ATOMS ARE ATTACHED.                                1REP 105
REMARK   5 QQG AND QQD DENOTE THE PSEUDO-ATOMS FOR THE 6 HYDROGEN       1REP 106
REMARK   5 ATOMS OF THE ISOPROPYL METHYL GROUPS OF VAL AND LEU, RESPEC- 1REP 107
REMARK   5 TIVELY. QR IS THE PSEUDO-ATOM FOR THE DELTA AND EPSILON      1REP 108
REMARK   5 HYDROGENS OF THE AROMATIC RINGS OF TYR AND PHE. IN THE CASE  1REP 109
REMARK   5 THE DELTA AND EPSILON PROTONS OF THE AROMATIC RINGS          1REP 110
REMARK   5 ARE DEGENERATE, THE CHEMICAL SHIFTS ARE LISTED UNDER CG      1REP 111
REMARK   5 AND CZ, RESPECTIVELY.                                        1REP 112
REMARK   5                                                              1REP 113
SHIFTS  SER    1   HA   4.38        2HB   4.22        3HB   4.44        NOV    7
SHIFTS  ILE    2   HN   9.48         HA   4.05         HB   2.00        NOV    8
SHIFTS  ILE    2   QG2  1.07        2HG1  1.07        3HG1  1.66        NOV    9
SHIFTS  ILE    2   QD1  0.85                                            NOV   10
SHIFTS  SER    3   HN   7.77         HA   3.89        2HB   3.93        NOV   11
SHIFTS  SER    3  3HB   4.12                                            NOV   12
SHIFTS  SER    4   HN   7.78         HA   4.24        2HB   3.95        NOV   13
SHIFTS  SER    4  3HB   4.04                                            NOV   14
SHIFTS  ARG    5   HN   7.99         HA   4.15        2HB   1.81        NOV   15
SHIFTS  ARG    5  3HB   1.45        2HG   1.16        3HG   1.67        NOV   16
SHIFTS  ARG    5   QD   2.29         QE   6.63                          NOV   17
SHIFTS  VAL    6   HN   8.38         HA   3.50         HB   2.13        NOV   18
SHIFTS  VAL    6   QG1  1.13         QG2  1.14         QQG  1.14        NOV   19
SHIFTS  LYS    7   HN   7.74         HA   4.08        2HB   1.75        NOV   20
SHIFTS  LYS    7  3HB   1.87         QG   1.47         QD   1.71        NOV   21
SHIFTS  LYS    7   QE   2.95                                            NOV   22
SHIFTS  SER    8   HN   8.22         HA   4.19         QB   4.13        NOV   23
SHIFTS  LYS    9   HN   8.29         HA   4.35        2HB   2.07        NOV   24
SHIFTS  LYS    9  3HB   2.32        2HG   1.61        3HG   1.68        NOV   25
SHIFTS  LYS    9   QD   1.81        2HE   2.55        3HE   2.81        NOV   26
SHIFTS  ARG   10   HN   9.02         HA   3.77        2HB   1.75        NOV   27
SHIFTS  ARG   10  3HB   2.29        2HG   1.26        3HG   2.07        NOV   28
SHIFTS  ARG   10   QD   2.81         HE  11.82         QH1  6.69        NOV   29
SHIFTS  ARG   10   QH2  9.16                                            NOV   30
SHIFTS  ILE   11   HN   8.34         HA   3.87         HB   1.98        NOV   31
SHIFTS  ILE   11   QG2  0.98        2HG1  1.22        3HG1  1.87        NOV   32
SHIFTS  ILE   11   QD1  0.93                                            NOV   33
SHIFTS  GLN   12   HN   8.27         HA   4.09         QB   2.36        NOV   34
SHIFTS  GLN   12  2HG   2.38        3HG   2.64        1HE2  7.58        NOV   35
SHIFTS  GLN   12  2HE2  7.04                                            NOV   36
SHIFTS  LEU   13   HN   7.91         HA   4.30        2HB   1.93        NOV   37
SHIFTS  LEU   13  3HB   1.66         HG   1.93         QD1  0.98        NOV   38
SHIFTS  LEU   13   QD2  0.93                                            NOV   39
SHIFTS  GLY   14   HN   8.13        1HA   4.05        2HA   3.93        NOV   40
SHIFTS  LEU   15   HN   7.54         HA   4.88        2HB   1.71        NOV   41
SHIFTS  LEU   15  3HB   1.49         HG   1.61         QD1  0.83        NOV   42
SHIFTS  LEU   15   QD2  0.81                                            NOV   43
SHIFTS  ASN   16   HN   9.38         HA   4.79        2HB   3.48        NOV   44
SHIFTS  ASN   16  3HB   2.92        1HD2  7.50        2HD2  7.03        NOV   45
SHIFTS  GLN   17   HN   8.96         HA   3.67        2HB   2.28        NOV   46
SHIFTS  GLN   17  3HB   1.71        2HG   2.09        3HG   2.65        NOV   47
SHIFTS  GLN   17  1HE2  7.81        2HE2  7.33                          NOV   48
SHIFTS  ALA   18   HN   8.46         HA   3.87         QB   1.51        NOV   49
SHIFTS  GLU   19   HN   9.05         HA   4.06        2HB   2.26        NOV   50
SHIFTS  GLU   19  3HB   1.93        2HG   1.93        3HG   2.62        NOV   51
SHIFTS  LEU   20   HN   8.22         HA   4.08        2HB   1.23        NOV   52
SHIFTS  LEU   20  3HB   1.93         HG   1.49         QD1  0.87        NOV   53
SHIFTS  LEU   20   QD2  0.91                                            NOV   54
SHIFTS  ALA   21   HN   8.40         HA   3.42         QB   1.28        NOV   55
SHIFTS  GLN   22   HN   7.94         HA   4.11         QB   2.22        NOV   56
SHIFTS  GLN   22  2HG   2.46        3HG   2.54        1HE2  7.55        NOV   57
SHIFTS  GLN   22  2HE2  6.91                                            NOV   58
SHIFTS  LYS   23   HN   7.67         HA   4.09        2HB   1.94        NOV   59
SHIFTS  LYS   23  3HB   1.98        2HG   1.61        3HG   1.67        NOV   60
SHIFTS  LYS   23   QD   1.72        2HE   3.02        3HE   3.12        NOV   61
SHIFTS  VAL   24   HN   7.83         HA   3.73         HB   1.93        NOV   62
SHIFTS  VAL   24   QG1  0.72         QG2  0.85                          NOV   63
SHIFTS  GLY   25   HN   7.96        1HA   4.14        2HA   3.89        NOV   64
SHIFTS  THR   26   HN   7.73         HA   4.83         HB   3.29        NOV   65
SHIFTS  THR   26   QG2  0.45                                            NOV   66
SHIFTS  THR   27   HN   8.31         HA   4.60         HB   4.72        NOV   67
SHIFTS  THR   27   QG2  1.30                                            NOV   68
SHIFTS  GLN   28   HN   9.44         HA   3.58        2HB   2.03        NOV   69
SHIFTS  GLN   28  3HB   2.12        2HG   2.13        3HG   2.25        NOV   70
SHIFTS  GLN   28  1HE2  7.58        2HE2  7.00                          NOV   71
SHIFTS  GLN   29   HN   8.84         HA   4.03        2HB   2.00        NOV   72
SHIFTS  GLN   29  3HB   2.13         QG   2.47        1HE2  7.68        NOV   73
SHIFTS  GLN   29  2HE2  6.97                                            NOV   74
SHIFTS  SER   30   HN   7.99         HA   4.35        2HB   4.24        NOV   75
SHIFTS  SER   30  3HB   4.03                                            NOV   76
SHIFTS  ILE   31   HN   7.48         HA   4.98         HB   2.33        NOV   77
SHIFTS  ILE   31   QG2  0.91        2HG1  1.19        3HG1  1.71        NOV   78
SHIFTS  ILE   31   QD1  0.50                                            NOV   79
SHIFTS  GLU   32   HN   8.51         HA   4.01        2HB   2.13        NOV   80
SHIFTS  GLU   32  3HB   2.25        2HG   2.25        3HG   2.32        NOV   81
SHIFTS  GLN   33   HN   8.48         HA   4.18        2HB   2.09        NOV   82
SHIFTS  GLN   33  3HB   2.16        2HG   2.46        3HG   2.68        NOV   83
SHIFTS  GLN   33  1HE2  7.52        2HE2  6.95                          NOV   84
SHIFTS  LEU   34   HN   7.55         HA   4.41        2HB   1.81        NOV   85
SHIFTS  LEU   34  3HB   2.31         HG   1.58         QD1  0.91        NOV   86
SHIFTS  LEU   34   QD2  1.04                                            NOV   87
SHIFTS  GLU   35   HN   8.80         HA   3.95        2HB   1.97        NOV   88
SHIFTS  GLU   35  3HB   2.08         QG   2.71                          NOV   89
SHIFTS  ASN   36   HN   8.35         HA   4.88         QB   2.99        NOV   90
SHIFTS  ASN   36  1HD2  7.64        2HD2  6.89                          NOV   91
SHIFTS  GLY   37   HN   7.60        1HA   4.02        2HA   4.25        NOV   92
SHIFTS  LYS   38   HN   8.36         HA   4.28        2HB   1.88        NOV   93
SHIFTS  LYS   38  3HB   1.99        2HG   1.39        3HG   1.54        NOV   94
SHIFTS  LYS   38   QD   1.68         QE   3.02                          NOV   95
SHIFTS  THR   39   HN   7.67         HA   4.42         HB   3.89        NOV   96
SHIFTS  THR   39   QG2  1.07                                            NOV   97
SHIFTS  LYS   40   HN   8.57         HA   4.26        2HB   1.77        NOV   98
SHIFTS  LYS   40  3HB   1.87        2HG   1.42        3HG   1.51        NOV   99
SHIFTS  LYS   40   QE   3.06                                            NOV  100
SHIFTS  ARG   41   HN   8.30         HA   4.51        2HB   1.64        NOV  101
SHIFTS  ARG   41  3HB   1.80        2HG   1.43        3HG   1.48        NOV  102
SHIFTS  ARG   41   QG   1.46         QD   3.16         HE   7.30        NOV  103
SHIFTS  PRO   42   HA   4.32        2HB   1.56        3HB   0.43        NOV  104
SHIFTS  PRO   42  2HG   1.36        3HG   1.60        2HD   3.28        NOV  105
SHIFTS  PRO   42  3HD   3.34                                            NOV  106
SHIFTS  ARG   43   HN   9.13         HA   4.16         QB   1.96        NOV  107
SHIFTS  ARG   43   QG   1.81         QD   3.32         HE   7.37        NOV  108
SHIFTS  PHE   44   HN   6.32         HA   5.28        2HB   3.73        NOV  109
SHIFTS  PHE   44  3HB   2.90         CG   7.35         CZ   7.41        NOV  110
SHIFTS  PHE   44   HZ   7.18                                            NOV  111
SHIFTS  LEU   45   HN   7.29         HA   4.08        2HB   1.88        NOV  112
SHIFTS  LEU   45  3HB   1.71         HG   1.71         QD1  0.95        NOV  113
SHIFTS  LEU   45   QD2  0.88                                            NOV  114
SHIFTS  PRO   46   HA   4.15        2HB   1.94        3HB   2.40        NOV  115
SHIFTS  PRO   46  2HG   1.73        3HG   2.32        2HD   3.80        NOV  116
SHIFTS  PRO   46  3HD   3.87                                            NOV  117
SHIFTS  GLU   47   HN   8.92         HA   4.19        2HB   2.45        NOV  118
SHIFTS  GLU   47  3HB   2.22        2HG   2.39        3HG   2.78        NOV  119
SHIFTS  LEU   48   HN   8.81         HA   4.18        2HB   1.71        NOV  120
SHIFTS  LEU   48  3HB   2.29         HG   1.71         QQD  1.02        NOV  121
SHIFTS  ALA   49   HN   8.62         HA   3.87         QB   1.56        NOV  122
SHIFTS  SER   50   HN   7.90         HA   4.31         QB   4.02        NOV  123
SHIFTS  ALA   51   HN   8.15         HA   4.13         QB   1.39        NOV  124
SHIFTS  LEU   52   HN   7.79         HA   4.31        2HB   1.98        NOV  125
SHIFTS  LEU   52  3HB   1.63         HG   1.61         QD1  1.02        NOV  126
SHIFTS  LEU   52   QD2  0.82                                            NOV  127
SHIFTS  GLY   53   HN   7.91         QA   3.95                          NOV  128
SHIFTS  VAL   54   HN   8.09         HA   4.76         HB   2.29        NOV  129
SHIFTS  VAL   54   QG1  0.43         QG2  1.00                          NOV  130
SHIFTS  SER   55   HN   8.41         HA   4.82        2HB   4.05        NOV  131
SHIFTS  SER   55  3HB   4.45                                            NOV  132
SHIFTS  VAL   56   HN   9.04         HA   3.57         HB   2.09        NOV  133
SHIFTS  VAL   56   QG1  1.00         QG2  1.07                          NOV  134
SHIFTS  ASP   57   HN   8.41         HA   4.35        2HB   2.65        NOV  135
SHIFTS  ASP   57  3HB   2.74                                            NOV  136
SHIFTS  TRP   58   HN   8.51         HA   4.09        2HB   3.34        NOV  137
SHIFTS  TRP   58  3HB   3.44         HD1  7.22         HE3  7.36        NOV  138
SHIFTS  TRP   58   HE1 10.35         HZ3  6.83         HZ2  7.61        NOV  139
SHIFTS  TRP   58   HH2  7.29                                            NOV  140
SHIFTS  LEU   59   HN   8.04         HA   3.53        2HB   2.25        NOV  141
SHIFTS  LEU   59  3HB   1.34         HG   2.08         QD1  0.91        NOV  142
SHIFTS  LEU   59   QD2  0.98                                            NOV  143
SHIFTS  LEU   60   HN   8.41         HA   4.01        2HB   1.80        NOV  144
SHIFTS  LEU   60  3HB   1.42         HG   1.73         QD1  0.86        NOV  145
SHIFTS  LEU   60   QD2  0.85                                            NOV  146
SHIFTS  ASN   61   HN   8.43         HA   4.89         QB   2.73        NOV  147
SHIFTS  ASN   61  1HD2  7.76        2HD2  7.06                          NOV  148
SHIFTS  GLY   62   HN   8.52        1HA   3.05        2HA   3.66        NOV  149
SHIFTS  THR   63   HN   7.91         HA   4.41         HB   4.25        NOV  150
SHIFTS  THR   63   QG2  1.30                                            NOV  151
SHIFTS  SER   64   HN   8.67         HA   4.59        2HB   3.95        NOV  152
SHIFTS  SER   64  3HB   3.98                                            NOV  153
SHIFTS  ASP   65   HN   8.57         HA   4.70         QB   2.71        NOV  154
SHIFTS  SER   66   HN   8.43         HA   4.44        2HB   3.84        NOV  155
SHIFTS  SER   66  3HB   3.91                                            NOV  156
SHIFTS  ASN   67   HN   8.58         HA   4.76         QB   2.80        NOV  157
SHIFTS  ASN   67  1HD2  7.73        2HD2  7.00                          NOV  158
SHIFTS  VAL   68   HN   8.08         HA   4.12         HB   2.12        NOV  159
SHIFTS  VAL   68   QQG  0.95                                            NOV  160
SHIFTS  ARG   69   HN   8.10         HA   4.23        2HB   1.76        NOV  161
SHIFTS  ARG   69  3HB   1.90         QG   1.58         QD   3.23        NOV  162
SHIFTS  ARG   69   HE   7.26                                            NOV  163
JCOUPL  ILE    2   HN   HA   4.30                                       NOV  164
JCOUPL  SER    3   HN   HA   2.50                                       NOV  165
JCOUPL  SER    4   HN   HA   5.20                                       NOV  166
JCOUPL  ARG+   5   HN   HA   5.10                                       NOV  167
JCOUPL  VAL    6   HN   HA   4.30                                       NOV  168
JCOUPL  LYS+   7   HN   HA   3.40                                       NOV  169
JCOUPL  SER    8   HN   HA   3.40                                       NOV  170
JCOUPL  LYS+   9   HN   HA   5.30                                       NOV  171
JCOUPL  ARG+  10   HN   HA   3.30                                       NOV  172
JCOUPL  ILE   11   HN   HA   4.70                                       NOV  173
JCOUPL  GLN   12   HN   HA   3.90                                       NOV  174
JCOUPL  LEU   13   HN   HA   6.50                                       NOV  175
JCOUPL  LEU   15   HN   HA   8.50                                       NOV  176
JCOUPL  ASN   16   HN   HA   8.80                                       NOV  177
JCOUPL  GLN   17   HN   HA   2.90                                       NOV  178
JCOUPL  ALA   18   HN   HA   4.80                                       NOV  179
JCOUPL  GLU-  19   HN   HA   4.50                                       NOV  180
JCOUPL  LEU   20   HN   HA   5.00                                       NOV  181
JCOUPL  ALA   21   HN   HA   2.50                                       NOV  182
JCOUPL  GLN   22   HN   HA   3.50                                       NOV  183
JCOUPL  LYS+  23   HN   HA   5.20                                       NOV  184
JCOUPL  VAL   24   HN   HA   7.40                                       NOV  185
JCOUPL  THR   26   HN   HA   8.60                                       NOV  186
JCOUPL  THR   27   HN   HA   8.80                                       NOV  187
JCOUPL  GLN   28   HN   HA   3.00                                       NOV  188
JCOUPL  GLN   29   HN   HA   2.40                                       NOV  189
JCOUPL  SER   30   HN   HA   4.60                                       NOV  190
JCOUPL  ILE   31   HN   HA   6.50                                       NOV  191
JCOUPL  GLU-  32   HN   HA   3.40                                       NOV  192
JCOUPL  GLN   33   HN   HA   3.80                                       NOV  193
JCOUPL  LEU   34   HN   HA   5.10                                       NOV  194
JCOUPL  GLU-  35   HN   HA   4.70                                       NOV  195
JCOUPL  ASN   36   HN   HA   7.20                                       NOV  196
JCOUPL  LYS+  38   HN   HA   7.40                                       NOV  197
JCOUPL  THR   39   HN   HA   8.40                                       NOV  198
JCOUPL  LYS+  40   HN   HA   8.00                                       NOV  199
JCOUPL  ARG+  41   HN   HA   8.50                                       NOV  200
JCOUPL  ARG+  43   HN   HA   4.40                                       NOV  201
JCOUPL  PHE   44   HN   HA   8.50                                       NOV  202
JCOUPL  LEU   45   HN   HA   2.70                                       NOV  203
JCOUPL  GLU-  47   HN   HA   4.80                                       NOV  204
JCOUPL  LEU   48   HN   HA   4.60                                       NOV  205
JCOUPL  ALA   49   HN   HA   3.30                                       NOV  206
JCOUPL  SER   50   HN   HA   3.90                                       NOV  207
JCOUPL  ALA   51   HN   HA   4.20                                       NOV  208
JCOUPL  LEU   52   HN   HA   7.50                                       NOV  209
JCOUPL  VAL   54   HN   HA   9.90                                       NOV  210
JCOUPL  SER   55   HN   HA   7.40                                       NOV  211
JCOUPL  VAL   56   HN   HA   3.80                                       NOV  212
JCOUPL  ASP-  57   HN   HA   2.90                                       NOV  213
JCOUPL  TRP   58   HN   HA   4.80                                       NOV  214
JCOUPL  LEU   59   HN   HA   4.00                                       NOV  215
JCOUPL  LEU   60   HN   HA   5.90                                       NOV  216
JCOUPL  ASN   61   HN   HA   8.70                                       NOV  217
JCOUPL  THR   63   HN   HA   7.30                                       NOV  218
JCOUPL  VAL    6   HA   HB  11.00                                       NOV  219
JCOUPL  ARG+  10   HA  2HB   2.50    HA  3HB  11.00                     NOV  220
JCOUPL  ILE   11   HA   HB  11.00                                       NOV  221
JCOUPL  LEU   15   HA  2HB   2.50    HA  3HB  11.00                     NOV  222
JCOUPL  ASN   16   HA  2HB   4.00    HA  3HB   4.00                     NOV  223
JCOUPL  GLN   17   HA  2HB   2.50    HA  3HB  11.00                     NOV  224
JCOUPL  GLU-  19   HA  2HB   2.50    HA  3HB  11.00                     NOV  225
JCOUPL  SER   30   HA  2HB   2.50    HA  3HB  11.00                     NOV  226
JCOUPL  LEU   34   HA  2HB   2.50    HA  3HB  11.00                     NOV  227
JCOUPL  GLU-  35   HA  2HB  11.00    HA  3HB   2.50                     NOV  228
JCOUPL  PHE   44   HA  2HB   5.00    HA  3HB   4.00                     NOV  229
JCOUPL  GLU-  47   HA  2HB   2.50    HA  3HB  11.00                     NOV  230
JCOUPL  LEU   48   HA  2HB   2.50    HA  3HB  11.00                     NOV  231
JCOUPL  SER   55   HA  2HB   4.50    HA  3HB   4.50                     NOV  232
JCOUPL  TRP   58   HA  2HB   3.50    HA  3HB  10.00                     NOV  233
JCOUPL  LEU   59   HA  2HB   2.50    HA  3HB  11.00                     NOV  234
JCOUPL  LEU   60   HA  2HB   2.50    HA  3HB  11.00                     NOV  235
JCOUPL  ARG+   5   N   2HB   4.10    N   3HB   1.40                     NOV  236
JCOUPL  VAL    6   N    HB   1.40                                       NOV  237
JCOUPL  LYS+   7   N   2HB   1.40    N   3HB   1.40                     NOV  238
JCOUPL  ARG+  10   N   2HB   1.40    N   3HB   1.40                     NOV  239
JCOUPL  LEU   13   N   2HB   4.10    N   3HB   1.40                     NOV  240
JCOUPL  ASN   16   N   2HB   1.40    N   3HB   4.10                     NOV  241
JCOUPL  GLN   17   N   2HB   4.10    N   3HB   1.40                     NOV  242
JCOUPL  GLU-  19   N   2HB   4.10    N   3HB   1.40                     NOV  243
JCOUPL  LEU   20   N   2HB   1.40    N   3HB   1.40                     NOV  244
JCOUPL  SER   30   N   2HB   4.10    N   3HB   1.40                     NOV  245
JCOUPL  LEU   34   N   2HB   1.40    N   3HB   1.40                     NOV  246
JCOUPL  GLU-  35   N   2HB   1.40    N   3HB   4.10                     NOV  247
JCOUPL  PHE   44   N   2HB   1.40    N   3HB   4.10                     NOV  248
JCOUPL  GLU-  47   N   2HB   4.10    N   3HB   1.40                     NOV  249
JCOUPL  LEU   48   N   2HB   1.40    N   3HB   1.40                     NOV  250
JCOUPL  LEU   52   N   2HB   4.10    N   3HB   1.40                     NOV  251
JCOUPL  VAL   54   N    HB   4.10                                       NOV  252
JCOUPL  SER   55   N   2HB   1.40    N   3HB   4.10                     NOV  253
JCOUPL  TRP   58   N   2HB   1.40    N   3HB   1.40                     NOV  254
JCOUPL  LEU   59   N   2HB   4.10    N   3HB   1.40                     NOV  255
JCOUPL  LEU   60   N   2HB   4.10    N   3HB   1.40                     NOV  256
NOEUPP  SER    1  HA  ILE    2  HN   3.10     2HB  ILE    2  HN   4.30  NOV  257
NOEUPP  SER    1 3HB  ILE    2  HN   4.30      QB  ILE    2  HN   3.82  NOV  258
NOEUPP  SER    1  QB  SER    3  HN   4.88                               NOV  259
NOEUPP  ILE    2  HN  ILE    2  HB   3.00      HN  ILE    2  QG2  4.80  NOV  260
NOEUPP  ILE    2  HN  ILE    2  QG1  5.18      HN  ILE    2  QD1  5.80  NOV  261
NOEUPP  ILE    2  HN  SER    3  HN   3.60      HA  ARG+   5  CZ   6.80  NOV  262
NOEUPP  ILE    2  HB  SER    3  HN   4.00      QG2 SER    3  HN   5.00  NOV  263
NOEUPP  ILE    2  QG1 ARG+   5  CZ   7.68      QG1 GLY   37  QA   5.75  NOV  264
NOEUPP  SER    3  HN  SER    3 2HB   3.50      HN  SER    3 3HB   3.50  NOV  265
NOEUPP  SER    3  HN  SER    4  HN   3.10      HA  VAL    6  HN   4.80  NOV  266
NOEUPP  SER    3  HA  VAL    6  HB   3.20      HA  VAL    6  QQG  7.20  NOV  267
NOEUPP  SER    3  QB  GLY   37  HN   5.48                               NOV  268
NOEUPP  SER    4  HN  ARG+   5  HN   3.30      HN  VAL    6  HN   4.80  NOV  269
NOEUPP  SER    4  HA  LYS+   7  HN   3.80      HA  SER    8  HN   4.20  NOV  270
NOEUPP  ARG+   5  HN  ARG+   5 2HB   3.10      HN  ARG+   5 3HB   4.00  NOV  271
NOEUPP  ARG+   5  HN  ARG+   5 2HG   3.90      HN  ARG+   5 3HG   3.90  NOV  272
NOEUPP  ARG+   5  HN  ARG+   5  QG   3.60      HN  VAL    6  HN   3.40  NOV  273
NOEUPP  ARG+   5  HA  ARG+   5  QG   3.64      HA  TRP   58  HZ3  4.80  NOV  274
NOEUPP  ARG+   5  HA  TRP   58  HZ2  4.80      HA  TRP   58  HH2  4.40  NOV  275
NOEUPP  ARG+   5 2HB  ARG+   5  CZ   6.80     2HB  VAL    6  HN   3.30  NOV  276
NOEUPP  ARG+   5 2HB  TRP   58  HZ3  3.80     2HB  TRP   58  HZ2  4.80  NOV  277
NOEUPP  ARG+   5 2HB  TRP   58  HH2  3.40     3HB  ARG+   5  CZ   6.80  NOV  278
NOEUPP  ARG+   5 3HB  VAL    6  HN   4.40     3HB  TRP   58  HZ3  3.60  NOV  279
NOEUPP  ARG+   5 3HB  TRP   58  HH2  4.10      QG  TRP   58  HZ2  5.18  NOV  280
NOEUPP  ARG+   5  QG  TRP   58  HH2  5.68      QD  TRP   58  HH2  5.80  NOV  281
NOEUPP  ARG+   5  CZ  VAL   54  HB   6.80      CZ  LEU   59  HA   6.70  NOV  282
NOEUPP  ARG+   5  CZ  GLY   62  HN   6.80      CZ  GLY   62 1HA   6.80  NOV  283
NOEUPP  ARG+   5  CZ  GLY   62 2HA   6.80                               NOV  284
NOEUPP  VAL    6  HN  VAL    6  HB   2.70      HN  LYS+   7  HN   3.30  NOV  285
NOEUPP  VAL    6  HN  LEU   59  QD2  5.80      HA  LYS+   9  HN   4.10  NOV  286
NOEUPP  VAL    6  HA  LYS+   9  QB   5.48      HA  LEU   48  QQD  7.20  NOV  287
NOEUPP  VAL    6  HA  LEU   52  QD2  5.80      HB  LYS+   7  HN   2.90  NOV  288
NOEUPP  VAL    6  QQG LYS+   7  HN   7.20      QQG LYS+   7  HA   7.20  NOV  289
NOEUPP  VAL    6  QQG ARG+  10  HE   7.20      QQG ILE   31  QD1  7.20  NOV  290
NOEUPP  VAL    6  QQG GLU-  35  HN   7.20      QQG LEU   59  QD1  7.20  NOV  291
NOEUPP  VAL    6  QQG LEU   59  QD2  7.20                               NOV  292
NOEUPP  LYS+   7  HN  LYS+   7 2HB   3.10      HN  LYS+   7 3HB   3.10  NOV  293
NOEUPP  LYS+   7  HN  LYS+   7  QG   5.80      HN  SER    8  HN   3.20  NOV  294
NOEUPP  LYS+   7  HN  LYS+   9  HN   4.70      HA  LYS+   7  QG   4.00  NOV  295
NOEUPP  LYS+   7  HA  ARG+  10  HN   3.60      HA  ARG+  10  HE   3.40  NOV  296
NOEUPP  LYS+   7  HA  ILE   11  HN   4.80     2HB  SER    8  HN   3.70  NOV  297
NOEUPP  LYS+   7 3HB  SER    8  HN   3.40      QG  ARG+  10  HE   5.80  NOV  298
NOEUPP  LYS+   7  QE  ILE   11  QD1  6.80                               NOV  299
NOEUPP  SER    8  HN  SER    8  QB   3.80      HN  LYS+   9  HN   3.60  NOV  300
NOEUPP  SER    8  HN  ARG+  10  HN   4.30      HA  ILE   11  HN   4.40  NOV  301
NOEUPP  SER    8  HA  ILE   11  QG2  5.80      HA  ILE   11  QD1  5.80  NOV  302
NOEUPP  SER    8  HA  GLN   12  HN   4.80                               NOV  303
NOEUPP  LYS+   9  HN  LYS+   9 2HB   3.20      HN  LYS+   9 3HB   3.20  NOV  304
NOEUPP  LYS+   9  HN  ARG+  10  HN   3.10      HN  LEU   52  QD1  5.80  NOV  305
NOEUPP  LYS+   9  HN  LEU   52  QD2  5.80      HN  TRP   58  HH2  4.80  NOV  306
NOEUPP  LYS+   9  HA  LYS+   9  QG   3.71      HA  LYS+   9  QD   4.00  NOV  307
NOEUPP  LYS+   9  HA  GLN   12  HN   3.40      HA  GLN   12  QB   4.00  NOV  308
NOEUPP  LYS+   9 2HB  LEU   52  QD2  5.80     3HB  LEU   52  QD2  5.80  NOV  309
NOEUPP  LYS+   9  QB  TRP   58  HH2  4.38      QG  TRP   58  HZ3  5.38  NOV  310
NOEUPP  LYS+   9  QD  VAL   54  QG1  6.80     2HE  VAL   54  QG1  5.80  NOV  311
NOEUPP  LYS+   9 3HE  VAL   54  QG1  5.80      QE  LEU   13  QD1  6.68  NOV  312
NOEUPP  LYS+   9  QE  LEU   13  QD2  6.68                               NOV  313
NOEUPP  ARG+  10  HN  ARG+  10 2HB   2.90      HN  ARG+  10 3HB   3.70  NOV  314
NOEUPP  ARG+  10  HN  ARG+  10  QG   5.68      HN  ILE   11  HN   3.50  NOV  315
NOEUPP  ARG+  10  HN  ILE   11  QD1  5.80      HN  LEU   52  QD1  5.80  NOV  316
NOEUPP  ARG+  10  HN  LEU   52  QD2  5.80      HA  ARG+  10 2HB   3.00  NOV  317
NOEUPP  ARG+  10  HA  ARG+  10 2HG   3.90      HA  ARG+  10 3HG   3.90  NOV  318
NOEUPP  ARG+  10  HA  ARG+  10  QG   3.46      HA  LEU   13  HN   3.70  NOV  319
NOEUPP  ARG+  10  HA  LEU   13  QB   5.68      HA  LEU   13  QD1  5.80  NOV  320
NOEUPP  ARG+  10  HA  LEU   13  QD2  5.80      HA  LEU   15  HN   4.80  NOV  321
NOEUPP  ARG+  10  HA  LEU   52  QD2  5.70     2HB  ARG+  10  HE   4.00  NOV  322
NOEUPP  ARG+  10 2HB  ILE   11  HN   4.80     3HB  ILE   11  HN   3.20  NOV  323
NOEUPP  ARG+  10 3HB  LEU   15  HN   4.80      QG  ILE   11  HN   5.68  NOV  324
NOEUPP  ARG+  10  QD  GLN   17  HA   4.40      QD  LEU   20  QD2  6.80  NOV  325
NOEUPP  ARG+  10  HE  GLN   17  HA   4.80      HE  GLN   17 2HB   4.10  NOV  326
NOEUPP  ARG+  10  HE  GLN   17 2HG   3.50      HE  GLN   17 3HG   4.80  NOV  327
NOEUPP  ARG+  10  HE  GLN   17 1HE2  4.80      HE  ILE   31  QG2  5.80  NOV  328
NOEUPP  ARG+  10  CZ  GLN   17 1HE2  6.80                               NOV  329
NOEUPP  ILE   11  HN  ILE   11  HB   2.60      HN  ILE   11 2HG1  4.80  NOV  330
NOEUPP  ILE   11  HN  ILE   11 3HG1  4.80      HN  ILE   11  QG1  4.15  NOV  331
NOEUPP  ILE   11  HN  ILE   11  QD1  5.80      HN  GLN   12  HN   4.80  NOV  332
NOEUPP  ILE   11  HN  LEU   13  HN   4.40      HA  ILE   11 2HG1  3.40  NOV  333
NOEUPP  ILE   11  HA  ILE   11 3HG1  3.40      HA  ILE   11  QD1  4.00  NOV  334
NOEUPP  ILE   11  HA  GLY   14  HN   3.30      HA  LEU   15  HN   4.80  NOV  335
NOEUPP  ILE   11  HB  GLN   12  HN   3.10      QG2 GLN   12  HN   5.80  NOV  336
NOEUPP  ILE   11 2HG1 GLN   12  HN   4.80     3HG1 GLN   12  HN   4.80  NOV  337
NOEUPP  ILE   11  QD1 GLN   12  HN   5.80                               NOV  338
NOEUPP  GLN   12  HN  GLN   12 2HG   4.80      HN  GLN   12 3HG   4.80  NOV  339
NOEUPP  GLN   12  HN  GLN   12  QG   4.19      HN  LEU   13  HN   3.00  NOV  340
NOEUPP  GLN   12  HN  GLY   14  HN   4.30      HA  GLN   12  QG   4.00  NOV  341
NOEUPP  GLN   12  QB  LEU   13  HN   4.40                               NOV  342
NOEUPP  LEU   13  HN  LEU   13 2HB   3.60      HN  LEU   13 3HB   3.60  NOV  343
NOEUPP  LEU   13  HN  LEU   13  QB   2.97      HN  LEU   13  QD1  5.20  NOV  344
NOEUPP  LEU   13  HN  LEU   13  QD2  5.80      HN  GLY   14  HN   3.40  NOV  345
NOEUPP  LEU   13  HN  LEU   15  HN   4.80      HA  LEU   13  QD2  3.60  NOV  346
NOEUPP  LEU   13 2HB  GLY   14  HN   4.80     3HB  GLY   14  HN   4.80  NOV  347
NOEUPP  LEU   13  QB  GLY   14  HN   4.42      QB  LEU   15  HN   4.48  NOV  348
NOEUPP  LEU   13  QD1 GLY   14  HN   5.80      QD1 LEU   52  HA   4.70  NOV  349
NOEUPP  LEU   13  QD2 LEU   15  HG   5.80                               NOV  350
NOEUPP  GLY   14  HN  GLY   14 1HA   2.70      HN  LEU   15  HN   2.90  NOV  351
NOEUPP  GLY   14 1HA  LEU   15  HN   3.60                               NOV  352
NOEUPP  LEU   15  HN  LEU   15 2HB   2.90      HN  LEU   15  HG   3.20  NOV  353
NOEUPP  LEU   15  HN  LEU   15  QQD  8.20      HA  LEU   15 3HB   3.00  NOV  354
NOEUPP  LEU   15  HA  LEU   15  HG   3.60      HA  LEU   15  QD1  5.80  NOV  355
NOEUPP  LEU   15  HA  LEU   15  QD2  3.80      HA  ASN   16  HN   2.60  NOV  356
NOEUPP  LEU   15  HA  GLU-  19 2HB   4.10      HA  GLU-  19 3HB   4.80  NOV  357
NOEUPP  LEU   15 2HB  ASN   16  HN   4.80     2HB  LEU   20  HN   4.80  NOV  358
NOEUPP  LEU   15 3HB  ASN   16  HN   3.50     3HB  LEU   20  HN   3.80  NOV  359
NOEUPP  LEU   15  HG  ASN   16  HN   4.80      QD1 GLU-  19  QG   6.68  NOV  360
NOEUPP  LEU   15  QD1 LEU   20  HA   5.80      QD1 LEU   20 2HB   5.80  NOV  361
NOEUPP  LEU   15  QD1 LYS+  23 2HE   5.80      QD1 LYS+  23 3HE   5.80  NOV  362
NOEUPP  LEU   15  QD2 ASN   16  HN   5.80      QD2 GLU-  19 2HB   5.80  NOV  363
NOEUPP  LEU   15  QD2 GLU-  19  QG   6.68      QD2 LYS+  23 2HE   5.80  NOV  364
NOEUPP  LEU   15  QD2 LYS+  23 3HE   5.80      QQD LEU   20  HN   7.20  NOV  365
NOEUPP  ASN   16  HN  ASN   16 2HB   4.10      HN  ASN   16 3HB   3.40  NOV  366
NOEUPP  ASN   16  HN  ASN   16 1HD2  4.80      HN  GLN   17  HN   4.80  NOV  367
NOEUPP  ASN   16  HN  GLU-  19  HN   3.90      HN  GLU-  19 2HB   2.70  NOV  368
NOEUPP  ASN   16  HN  GLU-  19 3HB   3.80      HN  GLU-  19  QG   5.68  NOV  369
NOEUPP  ASN   16  HN  LEU   20  HN   4.80      HA  ASN   16 2HB   2.80  NOV  370
NOEUPP  ASN   16  HA  ASN   16 3HB   2.80      HA  GLN   17  HN   2.90  NOV  371
NOEUPP  ASN   16 2HB  GLN   17  HN   2.70     2HB  ALA   18  HN   3.80  NOV  372
NOEUPP  ASN   16 3HB  ASN   16 1HD2  3.00     3HB  ASN   16 2HD2  3.70  NOV  373
NOEUPP  ASN   16 3HB  GLN   17  HN   3.60      OD1 GLU-  19  N    3.00  NOV  374
NOEUPP  ASN   16  OD1 GLU-  19  HN   2.00     1HD2 GLN   17  HN   4.80  NOV  375
NOEUPP  ASN   16 1HD2 ALA   18  QB   5.80     2HD2 ALA   18  QB   5.80  NOV  376
NOEUPP  GLN   17  HN  GLN   17 2HB   2.90      HN  GLN   17 3HB   3.80  NOV  377
NOEUPP  GLN   17  HN  GLN   17 2HG   3.80      HN  GLN   17 3HG   3.00  NOV  378
NOEUPP  GLN   17  HN  ALA   18  HN   3.10      HN  ALA   18  QB   5.80  NOV  379
NOEUPP  GLN   17  HN  GLU-  19  HN   4.80      HA  GLN   17 2HG   3.20  NOV  380
NOEUPP  GLN   17  HA  GLN   17 3HG   3.70      HA  GLU-  19  HN   4.80  NOV  381
NOEUPP  GLN   17  HA  LEU   20  HN   3.60      HA  LEU   20 2HB   3.80  NOV  382
NOEUPP  GLN   17  HA  LEU   20 3HB   3.80      HA  ALA   21  HN   4.30  NOV  383
NOEUPP  GLN   17  HA  ILE   31  QG2  5.80     2HB  GLN   17 1HE2  4.50  NOV  384
NOEUPP  GLN   17 2HB  GLN   17 2HE2  4.30     2HB  ALA   18  HN   3.30  NOV  385
NOEUPP  GLN   17 2HB  ILE   31  QG2  5.80     3HB  GLN   17 1HE2  4.80  NOV  386
NOEUPP  GLN   17 3HB  ALA   18  HN   3.90     1HE2 ILE   31  QG2  5.80  NOV  387
NOEUPP  GLN   17 1HE2 GLU-  32  HA   4.00     1HE2 GLU-  35 3HB   4.80  NOV  388
NOEUPP  GLN   17 2HE2 GLU-  32  HA   3.70                               NOV  389
NOEUPP  ALA   18  HN  GLU-  19  HN   3.00      HN  LEU   20  HN   4.40  NOV  390
NOEUPP  ALA   18  HA  ALA   21  HN   3.40      HA  ALA   21  QB   4.40  NOV  391
NOEUPP  ALA   18  HA  GLN   22  HN   4.80      HA  GLN   28  HN   4.80  NOV  392
NOEUPP  ALA   18  HA  GLN   28  HA   4.10      QB  GLU-  19  HN   4.20  NOV  393
NOEUPP  ALA   18  QB  GLN   28  HN   5.80      QB  GLN   28  QG   6.68  NOV  394
NOEUPP  ALA   18  QB  GLN   28 1HE2  5.80                               NOV  395
NOEUPP  GLU-  19  HN  GLU-  19 2HB   2.90      HN  GLU-  19 3HB   3.50  NOV  396
NOEUPP  GLU-  19  HN  GLU-  19  QG   3.78      HN  LEU   20  HN   3.00  NOV  397
NOEUPP  GLU-  19  HA  GLU-  19  QG   3.95      HA  GLN   22  HN   4.80  NOV  398
NOEUPP  GLU-  19 2HB  LEU   20  HN   3.00      QG  LEU   20  HN   5.68  NOV  399
NOEUPP  LEU   20  HN  LEU   20 2HB   2.80      HN  LEU   20 3HB   2.90  NOV  400
NOEUPP  LEU   20  HN  LEU   20  QD1  5.80      HN  LEU   20  QD2  5.80  NOV  401
NOEUPP  LEU   20  HN  ALA   21  HN   3.10      HN  GLN   22  HN   4.20  NOV  402
NOEUPP  LEU   20 3HB  ALA   21  HN   3.10      QD2 ALA   21  HA   5.80  NOV  403
NOEUPP  ALA   21  HN  GLN   22  HN   3.20      HN  GLN   28  HA   4.80  NOV  404
NOEUPP  ALA   21  HN  ILE   31  QD1  5.80      HA  VAL   24  HN   3.70  NOV  405
NOEUPP  ALA   21  HA  VAL   24  HB   3.40      HA  VAL   24  QG1  5.80  NOV  406
NOEUPP  ALA   21  HA  VAL   24  QG2  5.80      HA  GLY   25  HN   4.70  NOV  407
NOEUPP  ALA   21  HA  THR   26  HN   4.50      HA  THR   26  QG2  3.90  NOV  408
NOEUPP  ALA   21  HA  ILE   31 2HG1  4.80      HA  ILE   31 3HG1  4.80  NOV  409
NOEUPP  ALA   21  HA  ILE   31  QG1  4.02      HA  ILE   31  QD1  5.80  NOV  410
NOEUPP  ALA   21  QB  GLN   22  HA   5.80      QB  LYS+  23  HN   5.80  NOV  411
NOEUPP  ALA   21  QB  THR   26  HN   5.80      QB  THR   26  QG2  5.80  NOV  412
NOEUPP  ALA   21  QB  GLN   28  HN   5.80      QB  GLN   28  HA   4.10  NOV  413
NOEUPP  ALA   21  QB  GLN   28  QG   6.68      QB  ILE   31  HN   5.80  NOV  414
NOEUPP  ALA   21  QB  ILE   31  HB   5.80      QB  ILE   31  QG1  6.68  NOV  415
NOEUPP  ALA   21  QB  ILE   31  QD1  5.80                               NOV  416
NOEUPP  GLN   22  HN  GLN   22  QB   3.40      HN  GLN   22 2HG   4.30  NOV  417
NOEUPP  GLN   22  HN  GLN   22 3HG   4.30      HN  GLN   22  QG   3.91  NOV  418
NOEUPP  GLN   22  HN  LYS+  23  HN   3.10      QB  LYS+  23  HN   4.30  NOV  419
NOEUPP  GLN   22  QG  LYS+  23  HN   5.68                               NOV  420
NOEUPP  LYS+  23  HN  LYS+  23  QB   3.50      HN  LYS+  23 2HG   4.80  NOV  421
NOEUPP  LYS+  23  HN  LYS+  23 3HG   4.80      HN  LYS+  23  QG   4.42  NOV  422
NOEUPP  LYS+  23  HN  LYS+  23  QD   4.80      HN  VAL   24  HN   3.00  NOV  423
NOEUPP  LYS+  23  HN  VAL   24  QG2  5.80      HN  GLY   25  HN   4.80  NOV  424
NOEUPP  VAL   24  HN  VAL   24  HB   2.70      HN  VAL   24  QG2  4.10  NOV  425
NOEUPP  VAL   24  HN  GLY   25  HN   2.80      HN  THR   26  QG2  5.80  NOV  426
NOEUPP  VAL   24  HA  THR   26  QG2  5.80      HA  GLU-  47 2HB   4.10  NOV  427
NOEUPP  VAL   24  HA  GLU-  47 3HB   3.10      HA  GLU-  47  QG   5.68  NOV  428
NOEUPP  VAL   24  HA  ALA   51  QB   5.80      HB  GLY   25  HN   3.30  NOV  429
NOEUPP  VAL   24  HB  THR   26  HN   3.90      HB  THR   26  QG2  5.80  NOV  430
NOEUPP  VAL   24  HB  ILE   31  QD1  5.80      QG1 GLY   25  HN   5.80  NOV  431
NOEUPP  VAL   24  QG1 THR   26  HN   5.80      QG1 THR   26  HA   5.80  NOV  432
NOEUPP  VAL   24  QG1 THR   26  HB   5.80      QG1 THR   26  QG2  5.40  NOV  433
NOEUPP  VAL   24  QG1 ILE   31  QD1  5.80      QG1 PHE   44  HA   5.80  NOV  434
NOEUPP  VAL   24  QG1 PHE   44 3HB   5.80      QG1 PHE   44  CG   7.80  NOV  435
NOEUPP  VAL   24  QG1 GLU-  47  HN   5.80      QG1 GLU-  47 2HB   5.80  NOV  436
NOEUPP  VAL   24  QG1 GLU-  47 3HB   5.80      QG1 LEU   48  HN   5.80  NOV  437
NOEUPP  VAL   24  QG1 LEU   48  HA   5.80      QG1 LEU   48  QQD  7.20  NOV  438
NOEUPP  VAL   24  QG1 ALA   51  QB   5.80      QG2 GLY   25  HN   5.80  NOV  439
NOEUPP  VAL   24  QG2 THR   26  HN   5.80      QG2 THR   26  QG2  5.60  NOV  440
NOEUPP  VAL   24  QG2 ILE   31  QD1  5.80      QG2 PHE   44  CG   7.80  NOV  441
NOEUPP  VAL   24  QG2 LEU   48  HN   5.80      QG2 LEU   48  HA   3.60  NOV  442
NOEUPP  VAL   24  QG2 LEU   48  QQD  7.20      QG2 ALA   51  HN   5.80  NOV  443
NOEUPP  GLY   25  HN  GLY   25 1HA   2.70      HN  THR   26  HN   2.90  NOV  444
NOEUPP  GLY   25  HN  THR   26  QG2  5.80     1HA  THR   26  HN   3.60  NOV  445
NOEUPP  THR   26  HN  THR   26  HB   3.90      HN  THR   26  QG2  4.70  NOV  446
NOEUPP  THR   26  HA  THR   26  HB   2.50      HA  THR   27  HN   3.40  NOV  447
NOEUPP  THR   26  HA  THR   27  QG2  5.80      HB  THR   27  HN   3.30  NOV  448
NOEUPP  THR   26  HB  PHE   44  CG   6.80      HB  PHE   44  CZ   6.80  NOV  449
NOEUPP  THR   26  QG2 THR   27  HN   5.80      QG2 SER   30  HN   5.80  NOV  450
NOEUPP  THR   26  QG2 SER   30 2HB   5.80      QG2 SER   30 3HB   5.80  NOV  451
NOEUPP  THR   26  QG2 ILE   31  HN   5.80      QG2 ILE   31  QG1  6.68  NOV  452
NOEUPP  THR   26  QG2 PHE   44  CG   7.80      QG2 PHE   44  CZ   7.80  NOV  453
NOEUPP  THR   26  QG2 PHE   44  HZ   5.80                               NOV  454
NOEUPP  THR   27  HN  THR   27  QG2  4.50      HN  GLN   28  HN   4.80  NOV  455
NOEUPP  THR   27  HN  SER   30  HN   4.30      HN  SER   30 2HB   4.00  NOV  456
NOEUPP  THR   27  HA  THR   27  HB   2.80      HA  THR   27  QG2  3.70  NOV  457
NOEUPP  THR   27  HA  GLN   28  HN   2.60      HA  GLN   28  HA   4.80  NOV  458
NOEUPP  THR   27  HA  GLN   29  HN   4.20      HB  GLN   28  HN   3.10  NOV  459
NOEUPP  THR   27  HB  GLN   29  HN   3.00      HB  GLN   29 2HB   4.80  NOV  460
NOEUPP  THR   27  HB  GLN   29 3HB   4.80      HB  SER   30  HN   3.80  NOV  461
NOEUPP  THR   27  QG2 GLN   28  HN   5.80      QG2 GLN   29  HN   5.80  NOV  462
NOEUPP  THR   27  QG2 SER   30  HN   5.80                               NOV  463
NOEUPP  GLN   28  HN  GLN   28 2HB   3.00      HN  GLN   28 3HB   3.00  NOV  464
NOEUPP  GLN   28  HN  GLN   28  QG   4.68      HN  GLN   29  HN   3.30  NOV  465
NOEUPP  GLN   28  HN  SER   30  HN   4.80      HA  ILE   31  HN   3.40  NOV  466
NOEUPP  GLN   28  HA  ILE   31  HB   3.10      HA  ILE   31  QG2  5.80  NOV  467
NOEUPP  GLN   28  HA  ILE   31  QG1  5.68      HA  GLU-  32  HN   4.80  NOV  468
NOEUPP  GLN   28  QG  GLN   28 1HE2  3.13      QG  GLN   29  HN   5.28  NOV  469
NOEUPP  GLN   29  HN  GLN   29 2HB   3.40      HN  GLN   29 3HB   3.40  NOV  470
NOEUPP  GLN   29  HN  GLN   29  QB   3.04      HN  GLN   29  QG   5.10  NOV  471
NOEUPP  GLN   29  HN  SER   30  HN   3.40      HN  ILE   31  HN   4.80  NOV  472
NOEUPP  GLN   29 2HB  SER   30  HN   3.60     3HB  SER   30  HN   3.60  NOV  473
NOEUPP  GLN   29  QG  SER   30  HN   5.80      QG  GLN   33  HN   5.80  NOV  474
NOEUPP  GLN   29 1HE2 GLN   33  QB   5.68                               NOV  475
NOEUPP  SER   30  HN  SER   30 2HB   3.10      HN  ILE   31  HN   3.10  NOV  476
NOEUPP  SER   30  HN  GLU-  32  HN   4.30      HA  GLN   33  HN   3.70  NOV  477
NOEUPP  SER   30  HA  GLN   33  QB   4.18      HA  PHE   44  CZ   6.80  NOV  478
NOEUPP  SER   30  HA  PHE   44  HZ   4.80     2HB  ILE   31  HN   4.00  NOV  479
NOEUPP  SER   30 2HB  PHE   44  CZ   6.60     2HB  PHE   44  HZ   4.40  NOV  480
NOEUPP  SER   30 3HB  ILE   31  HN   4.20     3HB  PHE   44  CZ   5.80  NOV  481
NOEUPP  SER   30 3HB  PHE   44  HZ   3.50                               NOV  482
NOEUPP  ILE   31  HN  ILE   31  HB   2.70      HN  ILE   31 2HG1  3.80  NOV  483
NOEUPP  ILE   31  HN  ILE   31 3HG1  3.80      HN  ILE   31  QG1  3.31  NOV  484
NOEUPP  ILE   31  HN  ILE   31  QD1  5.80      HN  GLU-  32  HN   3.00  NOV  485
NOEUPP  ILE   31  HN  LEU   34  HN   4.80      HA  ILE   31  QD1  3.60  NOV  486
NOEUPP  ILE   31  HA  LEU   34  HN   3.80      HA  LEU   34  QD2  5.80  NOV  487
NOEUPP  ILE   31  HA  PHE   44  CZ   6.80      HA  PHE   44  HZ   4.80  NOV  488
NOEUPP  ILE   31  HB  GLU-  32  HN   3.30      QG2 GLU-  32  HN   5.80  NOV  489
NOEUPP  ILE   31 2HG1 GLU-  32  HN   4.80     3HG1 GLU-  32  HN   4.80  NOV  490
NOEUPP  ILE   31  QD1 PHE   44  CG   7.80      QD1 PHE   44  CZ   7.80  NOV  491
NOEUPP  ILE   31  QD1 PHE   44  HZ   5.80      QD1 LEU   48  QQD  7.20  NOV  492
NOEUPP  GLU-  32  HN  GLU-  32 2HB   3.10      HN  GLU-  32 3HB   3.10  NOV  493
NOEUPP  GLU-  32  HN  GLU-  32  QB   2.87      HN  GLN   33  HN   3.10  NOV  494
NOEUPP  GLU-  32  HN  LEU   34  HN   4.80      HA  GLU-  35  HN   3.80  NOV  495
NOEUPP  GLU-  32  HA  GLU-  35 2HB   4.80      HA  GLU-  35 3HB   4.80  NOV  496
NOEUPP  GLU-  32 2HG  GLN   33  HN   4.80     3HG  GLN   33  HN   4.80  NOV  497
NOEUPP  GLU-  32  QG  ASN   36 1HD2  5.08      QG  ASN   36 2HD2  5.48  NOV  498
NOEUPP  GLN   33  HN  GLN   33  QG   4.08      HN  LEU   34  HN   3.20  NOV  499
NOEUPP  GLN   33  HA  ASN   36  HN   4.00      HA  ASN   36  QB   5.30  NOV  500
NOEUPP  GLN   33  HA  ASN   36 1HD2  4.80      HA  ASN   36 2HD2  4.80  NOV  501
NOEUPP  GLN   33 2HB  LEU   34  HN   3.90     3HB  LEU   34  HN   3.90  NOV  502
NOEUPP  GLN   33  QB  LEU   34  HN   3.55                               NOV  503
NOEUPP  LEU   34  HN  LEU   34 2HB   2.80      HN  LEU   34 3HB   2.70  NOV  504
NOEUPP  LEU   34  HN  LEU   34  QD1  5.80      HN  LEU   34  QD2  5.80  NOV  505
NOEUPP  LEU   34  HN  GLU-  35  HN   3.10      HA  LEU   34 2HB   2.80  NOV  506
NOEUPP  LEU   34  HA  LEU   34  HG   3.60      HA  LEU   34  QD1  4.30  NOV  507
NOEUPP  LEU   34  HA  LEU   34  QD2  5.80      HA  GLY   37  HN   4.00  NOV  508
NOEUPP  LEU   34  HA  LYS+  38  HN   3.80     2HB  GLU-  35  HN   4.00  NOV  509
NOEUPP  LEU   34 2HB  PHE   44  HZ   4.60     3HB  GLU-  35  HN   3.50  NOV  510
NOEUPP  LEU   34  HG  GLU-  35  HN   4.80      QD1 GLU-  35  HN   5.80  NOV  511
NOEUPP  LEU   34  QD1 LYS+  38  HN   5.80      QD1 THR   39  HN   5.80  NOV  512
NOEUPP  LEU   34  QD1 PHE   44  CZ   7.80      QD1 PHE   44  HZ   5.80  NOV  513
NOEUPP  LEU   34  QD2 GLU-  35  HN   5.80      QD2 PRO   42 3HB   5.80  NOV  514
NOEUPP  LEU   34  QD2 PHE   44  CZ   7.80      QD2 PHE   44  HZ   5.80  NOV  515
NOEUPP  GLU-  35  HN  GLU-  35 2HB   3.20      HN  GLU-  35 3HB   3.50  NOV  516
NOEUPP  GLU-  35  HN  GLU-  35  QG   4.40      HN  ASN   36  HN   3.10  NOV  517
NOEUPP  GLU-  35  HA  GLY   37  HN   3.70     2HB  ASN   36  HN   4.50  NOV  518
NOEUPP  GLU-  35 3HB  ASN   36  HN   4.00      QG  ASN   36  HN   5.80  NOV  519
NOEUPP  ASN   36  HN  ASN   36  QB   3.70      HN  GLY   37  HN   2.70  NOV  520
NOEUPP  ASN   36  QB  LYS+  38  HN   5.80     2HD2 LYS+  38  QD   5.80  NOV  521
NOEUPP  GLY   37  HN  LYS+  38  HN   3.00                               NOV  522
NOEUPP  LYS+  38  HN  LYS+  38  QB   3.68      HN  LYS+  38 2HG   3.90  NOV  523
NOEUPP  LYS+  38  HN  LYS+  38 3HG   3.90      HN  LYS+  38  QG   3.70  NOV  524
NOEUPP  LYS+  38  HN  LYS+  38  QD   5.80      HN  THR   39  HN   2.90  NOV  525
NOEUPP  LYS+  38  HA  THR   39  HN   3.40     2HB  THR   39  HN   4.50  NOV  526
NOEUPP  LYS+  38 3HB  THR   39  HN   4.50                               NOV  527
NOEUPP  THR   39  HN  THR   39  HB   3.30      HN  LYS+  40  HN   4.80  NOV  528
NOEUPP  THR   39  HA  LYS+  40  HN   2.70      HA  ARG+  41  HN   4.50  NOV  529
NOEUPP  THR   39  HB  LYS+  40  HN   4.10      QG2 LYS+  40  HN   5.80  NOV  530
NOEUPP  THR   39  QG2 ARG+  41  HN   5.80      QG2 PRO   42  HA   5.80  NOV  531
NOEUPP  THR   39  QG2 PRO   42 2HD   5.80      QG2 PRO   42 3HD   5.80  NOV  532
NOEUPP  THR   39  QG2 ARG+  43  HN   5.80                               NOV  533
NOEUPP  LYS+  40  HN  LYS+  40 2HB   3.60      HN  LYS+  40 3HB   3.60  NOV  534
NOEUPP  LYS+  40  HN  LYS+  40  QB   3.15      HN  LYS+  40 2HG   4.10  NOV  535
NOEUPP  LYS+  40  HN  LYS+  40 3HG   4.10      HN  LYS+  40  QG   3.81  NOV  536
NOEUPP  LYS+  40  HN  ARG+  41  HN   2.90      QB  ARG+  41  HN   4.48  NOV  537
NOEUPP  ARG+  41  HN  ARG+  41 2HB   3.20      HN  ARG+  41 3HB   3.20  NOV  538
NOEUPP  ARG+  41  HN  ARG+  41  QB   2.88      HN  ARG+  41  QG   5.80  NOV  539
NOEUPP  ARG+  41  HN  ARG+  41  QD   5.80      HA  ARG+  41  QD   4.60  NOV  540
NOEUPP  ARG+  41  HA  PRO   42 2HG   4.80      HA  PRO   42 3HG   4.80  NOV  541
NOEUPP  ARG+  41  HA  PRO   42 2HD   2.50      HA  PRO   42 3HD   2.50  NOV  542
NOEUPP  ARG+  41  HA  LEU   45  QD1  5.80      HA  LEU   45  QD2  5.80  NOV  543
NOEUPP  ARG+  41  HA  LEU   60  QD2  5.80      QD  LEU   45  QD1  6.80  NOV  544
NOEUPP  ARG+  41  QD  LEU   45  QD2  6.80      QD  LEU   60  QD2  6.80  NOV  545
NOEUPP  PRO   42  HA  ARG+  43  HN   2.60     2HB  ARG+  43  HN   4.30  NOV  546
NOEUPP  PRO   42 2HB  PHE   44  CZ   6.60     2HB  PHE   44  HZ   4.40  NOV  547
NOEUPP  PRO   42 3HB  ARG+  43  HN   4.20     3HB  PHE   44  HN   3.90  NOV  548
NOEUPP  PRO   42 3HB  PHE   44  HZ   4.80     2HD  LEU   45  QD1  5.80  NOV  549
NOEUPP  PRO   42 2HD  LEU   45  QD2  5.80     2HD  LEU   60  QD2  5.80  NOV  550
NOEUPP  PRO   42 3HD  LEU   45  QD1  5.80     3HD  LEU   45  QD2  5.80  NOV  551
NOEUPP  PRO   42 3HD  LEU   60  QD2  5.80                               NOV  552
NOEUPP  ARG+  43  HN  ARG+  43  QB   3.80      HN  ARG+  43  QG   4.90  NOV  553
NOEUPP  ARG+  43  HN  ARG+  43  QD   5.80      HN  PHE   44  HN   3.40  NOV  554
NOEUPP  ARG+  43  HN  PHE   44  CG   6.80      HA  LEU   45  HN   3.50  NOV  555
NOEUPP  PHE   44  HN  PHE   44 3HB   4.10      HN  LEU   45  HN   3.90  NOV  556
NOEUPP  PHE   44  HA  PRO   46 2HD   4.30      HA  PRO   46 3HD   4.40  NOV  557
NOEUPP  PHE   44  HA  GLU-  47  HN   3.90      HA  LEU   48  HN   4.80  NOV  558
NOEUPP  PHE   44 2HB  GLU-  47  HN   4.20     2HB  GLU-  47  QG   5.68  NOV  559
NOEUPP  PHE   44 2HB  LEU   48  HN   4.20      CG  LEU   45  HA   6.80  NOV  560
NOEUPP  PHE   44  CG  LEU   48  HN   6.80      CG  LEU   48 2HB   6.00  NOV  561
NOEUPP  PHE   44  CZ  LEU   45  HA   6.80                               NOV  562
NOEUPP  LEU   45  HN  LEU   45  QB   3.45      HN  LEU   45  QD1  5.80  NOV  563
NOEUPP  LEU   45  HN  LEU   45  QD2  5.80      HN  PRO   46 2HD   4.60  NOV  564
NOEUPP  LEU   45  HN  PRO   46 3HD   3.80      HN  LEU   48  HN   4.80  NOV  565
NOEUPP  LEU   45  HA  LEU   48  HN   3.50      HA  LEU   48  QQD  7.20  NOV  566
NOEUPP  LEU   45  HA  ALA   49  HN   4.00      QB  VAL   56  HA   5.68  NOV  567
NOEUPP  LEU   45  QB  VAL   56  QG1  6.68      QD1 LEU   60  HG   5.80  NOV  568
NOEUPP  LEU   45  QD2 LEU   59  HG   5.80      QD2 LEU   60  HG   4.90  NOV  569
NOEUPP  PRO   46  HA  ALA   49  QB   5.00      HA  VAL   56  QG1  5.80  NOV  570
NOEUPP  PRO   46  HA  VAL   56  QG2  4.20      QB  GLU-  47  HN   3.88  NOV  571
NOEUPP  PRO   46  QB  ALA   49  HN   5.68      QG  GLU-  47  HN   5.28  NOV  572
NOEUPP  PRO   46 2HD  GLU-  47  HN   3.30     3HD  GLU-  47  HN   4.60  NOV  573
NOEUPP  GLU-  47  HN  GLU-  47 2HB   2.90      HN  GLU-  47 3HB   3.60  NOV  574
NOEUPP  GLU-  47  HN  GLU-  47 2HG   4.40      HN  GLU-  47 3HG   4.40  NOV  575
NOEUPP  GLU-  47  HN  GLU-  47  QG   3.88      HN  LEU   48  HN   3.00  NOV  576
NOEUPP  GLU-  47  HN  ALA   49  HN   4.40      HA  SER   50  HN   3.70  NOV  577
NOEUPP  GLU-  47 2HB  LEU   48  HN   3.30     3HB  LEU   48  HN   4.80  NOV  578
NOEUPP  LEU   48  HN  LEU   48 2HB   2.80      HN  LEU   48 3HB   2.70  NOV  579
NOEUPP  LEU   48  HN  LEU   48  QQD  8.20      HN  ALA   49  HN   3.00  NOV  580
NOEUPP  LEU   48  HN  SER   50  HN   4.70      HA  ALA   51  HN   3.80  NOV  581
NOEUPP  LEU   48  HA  ALA   51  QB   5.80     3HB  ALA   49  HN   3.00  NOV  582
NOEUPP  LEU   48  HG  ALA   49  HN   4.60      QQD ALA   49  HN   7.20  NOV  583
NOEUPP  ALA   49  HN  SER   50  HN   3.10      HN  ALA   51  HN   4.70  NOV  584
NOEUPP  ALA   49  HN  VAL   56  QG2  5.80      HN  LEU   59  QD1  5.80  NOV  585
NOEUPP  ALA   49  HA  VAL   54  HN   4.60      HA  VAL   54  QG2  5.80  NOV  586
NOEUPP  ALA   49  QB  SER   50  HN   4.20      QB  VAL   54  HN   4.80  NOV  587
NOEUPP  ALA   49  QB  SER   55  HA   5.80      QB  VAL   56  HN   5.80  NOV  588
NOEUPP  ALA   49  QB  VAL   56  HA   5.40      QB  VAL   56  QG1  5.80  NOV  589
NOEUPP  ALA   49  QB  VAL   56  QG2  5.10      QB  LEU   59  QD1  5.70  NOV  590
NOEUPP  SER   50  HN  ALA   51  HN   3.10      HN  ALA   51  QB   5.80  NOV  591
NOEUPP  SER   50  HN  LEU   59  QD1  6.00      HA  VAL   54  HN   4.80  NOV  592
NOEUPP  ALA   51  HN  LEU   52  HN   3.00      HA  GLY   53  HN   4.80  NOV  593
NOEUPP  LEU   52  HN  LEU   52 2HB   3.60      HN  LEU   52 3HB   3.60  NOV  594
NOEUPP  LEU   52  HN  LEU   52  QB   3.15      HN  LEU   52  QD1  5.30  NOV  595
NOEUPP  LEU   52  HN  LEU   52  QD2  5.80      HN  GLY   53  HN   2.90  NOV  596
NOEUPP  LEU   52  HN  VAL   54  HN   4.30      HA  LEU   52  QD1  5.80  NOV  597
NOEUPP  LEU   52  HA  LEU   52  QD2  3.60     2HB  VAL   54  HN   4.80  NOV  598
NOEUPP  LEU   52 3HB  VAL   54  HN   4.80      QB  GLY   53  HN   5.18  NOV  599
NOEUPP  LEU   52  QD2 GLY   53  HN   5.80                               NOV  600
NOEUPP  GLY   53  HN  VAL   54  HN   3.00      HN  VAL   54  QG1  5.80  NOV  601
NOEUPP  VAL   54  HN  VAL   54  QG2  3.90      HA  VAL   54  HB   2.60  NOV  602
NOEUPP  VAL   54  HA  SER   55  HN   2.90      HB  SER   55  HN   2.50  NOV  603
NOEUPP  VAL   54  HB  TRP   58 2HB   4.80      HB  TRP   58 3HB   4.40  NOV  604
NOEUPP  VAL   54  HB  TRP   58  HE3  2.90      QG1 SER   55  HN   5.80  NOV  605
NOEUPP  VAL   54  QG1 TRP   58  HE3  5.80      QG1 TRP   58  HZ3  5.80  NOV  606
NOEUPP  VAL   54  QG2 SER   55  HN   5.70      QG2 TRP   58  HE3  4.50  NOV  607
NOEUPP  VAL   54  QG2 TRP   58  HZ3  5.80                               NOV  608
NOEUPP  SER   55  HN  SER   55 2HB   3.60      HN  SER   55 3HB   3.00  NOV  609
NOEUPP  SER   55  HN  TRP   58 2HB   3.90      HN  TRP   58  HE3  4.80  NOV  610
NOEUPP  SER   55  HA  SER   55 2HB   3.00      HA  SER   55 3HB   3.00  NOV  611
NOEUPP  SER   55  HA  VAL   56  HN   2.80     2HB  VAL   56  HN   3.20  NOV  612
NOEUPP  SER   55 2HB  ASP-  57  HN   3.80     2HB  TRP   58  HN   4.60  NOV  613
NOEUPP  SER   55 3HB  VAL   56  HN   4.80     3HB  ASP-  57  HN   4.80  NOV  614
NOEUPP  VAL   56  HN  VAL   56  HB   2.70      HN  VAL   56  QG2  4.10  NOV  615
NOEUPP  VAL   56  HN  ASP-  57  HN   3.10      HA  TRP   58  HN   4.00  NOV  616
NOEUPP  VAL   56  HA  LEU   59  HN   3.50      HA  LEU   59 3HB   3.50  NOV  617
NOEUPP  VAL   56  HB  ASP-  57  HN   3.20      QG1 ASP-  57  HA   5.80  NOV  618
NOEUPP  VAL   56  QG1 TRP   58  HN   5.80      QG2 ASP-  57  HN   5.80  NOV  619
NOEUPP  ASP-  57  HN  TRP   58  HN   3.10      HA  ASP-  57 2HB   3.00  NOV  620
NOEUPP  ASP-  57  HA  ASP-  57 3HB   3.00      HA  TRP   58  HN   3.60  NOV  621
NOEUPP  ASP-  57  HA  LEU   60  HN   4.80      HA  LEU   60 3HB   4.50  NOV  622
NOEUPP  ASP-  57  HA  LEU   60  QD1  5.80      HA  ASN   61  HN   4.00  NOV  623
NOEUPP  ASP-  57  HA  ASN   61 1HD2  4.30      QB  TRP   58  HN   4.38  NOV  624
NOEUPP  TRP   58  HN  TRP   58 2HB   3.10      HN  TRP   58 3HB   3.00  NOV  625
NOEUPP  TRP   58  HN  LEU   59  HN   3.00      HA  TRP   58  HD1  3.60  NOV  626
NOEUPP  TRP   58  HA  GLY   62  HN   4.00     2HB  TRP   58  HD1  3.50  NOV  627
NOEUPP  TRP   58 2HB  LEU   59  HN   4.10     3HB  TRP   58  HE3  3.20  NOV  628
NOEUPP  TRP   58 3HB  LEU   59  HN   3.40      HD1 GLY   62  HN   4.80  NOV  629
NOEUPP  TRP   58  HD1 GLY   62 1HA   4.80      HD1 GLY   62 2HA   4.80  NOV  630
NOEUPP  TRP   58  HD1 THR   63  HN   4.80      HD1 THR   63  HA   4.70  NOV  631
NOEUPP  TRP   58  HD1 THR   63  QG2  5.80      HD1 SER   64  HN   4.80  NOV  632
NOEUPP  TRP   58  HD1 SER   64  QB   5.80      HE3 LEU   59  HN   3.70  NOV  633
NOEUPP  TRP   58  HE3 LEU   59  HA   3.30      HE3 LEU   59  HG   3.20  NOV  634
NOEUPP  TRP   58  HE1 GLY   62 1HA   4.80      HE1 GLY   62 2HA   4.80  NOV  635
NOEUPP  TRP   58  HE1 THR   63  HN   4.80      HE1 THR   63  HA   4.80  NOV  636
NOEUPP  TRP   58  HE1 THR   63  HB   4.80      HE1 THR   63  QG2  5.80  NOV  637
NOEUPP  TRP   58  HZ3 LEU   59  HA   4.30      HZ3 LEU   59  HG   4.80  NOV  638
NOEUPP  LEU   59  HN  LEU   59 2HB   2.90      HN  LEU   59 3HB   3.50  NOV  639
NOEUPP  LEU   59  HN  LEU   59  HG   3.10      HN  LEU   59  QD1  5.80  NOV  640
NOEUPP  LEU   59  HN  LEU   59  QD2  5.80      HN  LEU   60  HN   3.00  NOV  641
NOEUPP  LEU   59  HA  LEU   59  QD1  5.80      HA  LEU   59  QD2  3.90  NOV  642
NOEUPP  LEU   59  HA  GLY   62  HN   4.60     2HB  LEU   60  HN   3.40  NOV  643
NOEUPP  LEU   59 3HB  LEU   60  HN   3.70      QD2 LEU   60  HN   5.80  NOV  644
NOEUPP  LEU   60  HN  LEU   60 2HB   3.10      HN  LEU   60 3HB   3.80  NOV  645
NOEUPP  LEU   60  HN  LEU   60  QQD  8.20      HN  ASN   61  HN   3.20  NOV  646
NOEUPP  LEU   60  HA  LEU   60 3HB   2.90      HA  LEU   60  QD1  5.80  NOV  647
NOEUPP  LEU   60  HA  LEU   60  QD2  3.60     2HB  ASN   61  HN   3.60  NOV  648
NOEUPP  LEU   60 3HB  ASN   61  HN   4.20      QQD ASN   61  HN   7.20  NOV  649
NOEUPP  ASN   61  HN  ASN   61 1HD2  4.30      HN  GLY   62  HN   3.00  NOV  650
NOEUPP  ASN   61  QB  THR   63  HN   5.80                               NOV  651
NOEUPP  GLY   62  HN  THR   63  HN   3.60     1HA  THR   63  HN   3.60  NOV  652
NOEUPP  GLY   62 2HA  THR   63  HN   3.60                               NOV  653
NOEUPP  THR   63  HN  SER   64  HN   3.90      HA  SER   64  HN   2.70  NOV  654
NOEUPP  THR   63  HB  SER   64  HN   3.80      QG2 SER   64  HN   5.80  NOV  655
NOEUPP  SER   64  HN  SER   64 2HB   4.10      HN  SER   64 3HB   4.10  NOV  656
NOEUPP  SER   64  HN  SER   64  QB   3.81      HN  ASP-  65  HN   4.80  NOV  657
NOEUPP  SER   64  HA  ASP-  65  HN   2.90     2HB  ASP-  65  HN   4.80  NOV  658
NOEUPP  SER   64 3HB  ASP-  65  HN   4.80      QB  ASP-  65  HN   4.38  NOV  659
NOEUPP  ASP-  65  HA  SER   66  HN   3.20                               NOV  660
NOEUPP  SER   66  HN  SER   66 2HB   4.10      HN  SER   66 3HB   4.10  NOV  661
NOEUPP  SER   66  HN  SER   66  QB   3.90      HN  ASN   67  HN   4.30  NOV  662
NOEUPP  SER   66  HA  ASN   67  HN   2.70                               NOV  663
NOEUPP  ASN   67  HN  ASN   67 1HD2  4.80      HN  VAL   68  HN   3.80  NOV  664
NOEUPP  ASN   67  HA  VAL   68  HN   3.50                               NOV  665
NOEUPP  VAL   68  HN  VAL   68  HB   3.80                               NOV  666
HBUPP   ARG+   5  HN  SER    1  O    2.00      N   SER    1  O    3.00  NOV  667
HBUPP   VAL    6  HN  ILE    2  O    2.00      N   ILE    2  O    3.00  NOV  668
HBUPP   LYS+   7  HN  SER    3  O    2.00      N   SER    3  O    3.00  NOV  669
HBUPP   SER    8  HN  SER    4  O    2.00      N   SER    4  O    3.00  NOV  670
HBUPP   LYS+   9  HN  ARG+   5  O    2.00      N   ARG+   5  O    3.00  NOV  671
HBUPP   ARG+  10  HN  VAL    6  O    2.00      N   VAL    6  O    3.00  NOV  672
HBUPP   ILE   11  HN  LYS+   7  O    2.00      N   LYS+   7  O    3.00  NOV  673
HBUPP   GLN   12  HN  SER    8  O    2.00      N   SER    8  O    3.00  NOV  674
HBUPP   LEU   13  HN  LYS+   9  O    2.00      N   LYS+   9  O    3.00  NOV  675
HBUPP   LEU   15  HN  ARG+  10  O    2.00      N   ARG+  10  O    3.00  NOV  676
HBUPP   GLU-  19  HN  ASN   16  OD1  2.00      N   ASN   16  OD1  3.00  NOV  677
HBUPP   LEU   20  HN  ASN   16  O    2.00      N   ASN   16  O    3.00  NOV  678
HBUPP   ALA   21  HN  GLN   17  O    2.00      N   GLN   17  O    3.00  NOV  679
HBUPP   GLN   22  HN  ALA   18  O    2.00      N   ALA   18  O    3.00  NOV  680
HBUPP   LYS+  23  HN  GLU-  19  O    2.00      N   GLU-  19  O    3.00  NOV  681
HBUPP   VAL   24  HN  LEU   20  O    2.00      N   LEU   20  O    3.00  NOV  682
HBUPP   GLY   25  HN  ALA   21  O    2.00      N   ALA   21  O    3.00  NOV  683
HBUPP   THR   26  HN  ALA   21  O    2.00      N   ALA   21  O    3.00  NOV  684
HBUPP   GLU-  32  HN  GLN   28  O    2.00      N   GLN   28  O    3.00  NOV  685
HBUPP   GLN   33  HN  GLN   29  O    2.00      N   GLN   29  O    3.00  NOV  686
HBUPP   LEU   34  HN  SER   30  O    2.00      N   SER   30  O    3.00  NOV  687
HBUPP   GLU-  35  HN  ILE   31  O    2.00      N   ILE   31  O    3.00  NOV  688
HBUPP   ASN   36  HN  GLU-  32  O    2.00      N   GLU-  32  O    3.00  NOV  689
HBUPP   GLY   37  HN  LEU   34  O    2.00      N   LEU   34  O    3.00  NOV  690
HBUPP   LEU   48  HN  PHE   44  O    2.00      N   PHE   44  O    3.00  NOV  691
HBUPP   ALA   49  HN  LEU   45  O    2.00      N   LEU   45  O    3.00  NOV  692
HBUPP   SER   50  HN  PRO   46  O    2.00      N   PRO   46  O    3.00  NOV  693
HBUPP   ALA   51  HN  GLU-  47  O    2.00      N   GLU-  47  O    3.00  NOV  694
HBUPP   LEU   52  HN  LEU   48  O    2.00      N   LEU   48  O    3.00  NOV  695
HBUPP   GLY   53  HN  ALA   49  O    2.00      N   ALA   49  O    3.00  NOV  696
HBUPP   VAL   54  HN  ALA   49  O    2.00      N   ALA   49  O    3.00  NOV  697
HBUPP   LEU   59  HN  SER   55  O    2.00      N   SER   55  O    3.00  NOV  698
HBUPP   LEU   60  HN  VAL   56  O    2.00      N   VAL   56  O    3.00  NOV  699
HBUPP   ASN   61  HN  ASP-  57  O    2.00      N   ASP-  57  O    3.00  NOV  700
HBLOW   ARG+   5  HN  SER    1  O    1.70      N   SER    1  O    2.70  NOV  701
HBLOW   VAL    6  HN  ILE    2  O    1.70      N   ILE    2  O    2.70  NOV  702
HBLOW   LYS+   7  HN  SER    3  O    1.70      N   SER    3  O    2.70  NOV  703
HBLOW   SER    8  HN  SER    4  O    1.70      N   SER    4  O    2.70  NOV  704
HBLOW   LYS+   9  HN  ARG+   5  O    1.70      N   ARG+   5  O    2.70  NOV  705
HBLOW   ARG+  10  HN  VAL    6  O    1.70      N   VAL    6  O    2.70  NOV  706
HBLOW   ILE   11  HN  LYS+   7  O    1.70      N   LYS+   7  O    2.70  NOV  707
HBLOW   GLN   12  HN  SER    8  O    1.70      N   SER    8  O    2.70  NOV  708
HBLOW   LEU   13  HN  LYS+   9  O    1.70      N   LYS+   9  O    2.70  NOV  709
HBLOW   LEU   15  HN  ARG+  10  O    1.70      N   ARG+  10  O    2.70  NOV  710
HBLOW   GLU-  19  HN  ASN   16  OD1  1.70      N   ASN   16  OD1  2.70  NOV  711
HBLOW   LEU   20  HN  ASN   16  O    1.70      N   ASN   16  O    2.70  NOV  712
HBLOW   ALA   21  HN  GLN   17  O    1.70      N   GLN   17  O    2.70  NOV  713
HBLOW   GLN   22  HN  ALA   18  O    1.70      N   ALA   18  O    2.70  NOV  714
HBLOW   LYS+  23  HN  GLU-  19  O    1.70      N   GLU-  19  O    2.70  NOV  715
HBLOW   VAL   24  HN  LEU   20  O    1.70      N   LEU   20  O    2.70  NOV  716
HBLOW   GLY   25  HN  ALA   21  O    1.70      N   ALA   21  O    2.70  NOV  717
HBLOW   THR   26  HN  ALA   21  O    1.70      N   ALA   21  O    2.70  NOV  718
HBLOW   GLU-  32  HN  GLN   28  O    1.70      N   GLN   28  O    2.70  NOV  719
HBLOW   GLN   33  HN  GLN   29  O    1.70      N   GLN   29  O    2.70  NOV  720
HBLOW   LEU   34  HN  SER   30  O    1.70      N   SER   30  O    2.70  NOV  721
HBLOW   GLU-  35  HN  ILE   31  O    1.70      N   ILE   31  O    2.70  NOV  722
HBLOW   ASN   36  HN  GLU-  32  O    1.70      N   GLU-  32  O    2.70  NOV  723
HBLOW   GLY   37  HN  LEU   34  O    1.70      N   LEU   34  O    2.70  NOV  724
HBLOW   LEU   48  HN  PHE   44  O    1.70      N   PHE   44  O    2.70  NOV  725
HBLOW   ALA   49  HN  LEU   45  O    1.70      N   LEU   45  O    2.70  NOV  726
HBLOW   SER   50  HN  PRO   46  O    1.70      N   PRO   46  O    2.70  NOV  727
HBLOW   ALA   51  HN  GLU-  47  O    1.70      N   GLU-  47  O    2.70  NOV  728
HBLOW   LEU   52  HN  LEU   48  O    1.70      N   LEU   48  O    2.70  NOV  729
HBLOW   GLY   53  HN  ALA   49  O    1.70      N   ALA   49  O    2.70  NOV  730
HBLOW   VAL   54  HN  ALA   49  O    1.70      N   ALA   49  O    2.70  NOV  731
HBLOW   LEU   59  HN  SER   55  O    1.70      N   SER   55  O    2.70  NOV  732
HBLOW   LEU   60  HN  VAL   56  O    1.70      N   VAL   56  O    2.70  NOV  733
HBLOW   ASN   61  HN  ASP-  57  O    1.70      N   ASP-  57  O    2.70  NOV  734
ANGLE   ILE    2 PHI    -65.00  -55.00        PSI   -105.00  -15.00     NOV  735
ANGLE   ILE    2 CHI1   135.00  345.00                                  NOV  736
ANGLE   SER    3 PHI    -55.00  -35.00        PSI    -75.00  -15.00     NOV  737
ANGLE   SER    3 CHI1  -315.00   35.00                                  NOV  738
ANGLE   SER    4 PHI     85.00  295.00        PSI   -105.00  105.00     NOV  739
ANGLE   SER    4 CHI1  -315.00   35.00                                  NOV  740
ANGLE   ARG+   5 PHI    175.00  305.00        PSI   -105.00  -15.00     NOV  741
ANGLE   ARG+   5 CHI1  -105.00  105.00                                  NOV  742
ANGLE   VAL    6 PHI    -65.00  -55.00        PSI    -95.00  -25.00     NOV  743
ANGLE   VAL    6 CHI1   135.00  195.00                                  NOV  744
ANGLE   LYS+   7 PHI    -55.00  -45.00        PSI    -85.00  -25.00     NOV  745
ANGLE   LYS+   7 CHI1   135.00  225.00                                  NOV  746
ANGLE   SER    8 PHI    165.00  315.00        PSI   -105.00  115.00     NOV  747
ANGLE   SER    8 CHI1  -315.00   35.00                                  NOV  748
ANGLE   LYS+   9 PHI    -75.00  -65.00        PSI    -85.00   -5.00     NOV  749
ANGLE   LYS+   9 CHI1   115.00  255.00                                  NOV  750
ANGLE   ARG+  10 PHI    -55.00  -45.00        PSI    -85.00  -15.00     NOV  751
ANGLE   ARG+  10 CHI1   175.00  225.00                                  NOV  752
ANGLE   ILE   11 PHI    -65.00  -55.00        PSI    175.00  345.00     NOV  753
ANGLE   ILE   11 CHI1  -105.00  -45.00                                  NOV  754
ANGLE   GLN   12 PHI    175.00  305.00        PSI    -85.00   85.00     NOV  755
ANGLE   GLN   12 CHI1  -315.00   35.00                                  NOV  756
ANGLE   LEU   13 PHI    -85.00  -65.00        PSI   -105.00   15.00     NOV  757
ANGLE   LEU   13 CHI1  -105.00  105.00                                  NOV  758
ANGLE   LEU   15 PHI   -155.00  -85.00        PSI    115.00  185.00     NOV  759
ANGLE   LEU   15 CHI1  -105.00  -55.00                                  NOV  760
ANGLE   ASN   16 PHI   -155.00  -85.00        PSI    165.00  205.00     NOV  761
ANGLE   ASN   16 CHI1    45.00   85.00                                  NOV  762
ANGLE   GLN   17 PHI    -65.00  -35.00        PSI    -85.00  -15.00     NOV  763
ANGLE   GLN   17 CHI1  -105.00  -55.00                                  NOV  764
ANGLE   GLU-  19 PHI    -65.00  -55.00        PSI    -75.00  -25.00     NOV  765
ANGLE   GLU-  19 CHI1  -105.00  -55.00                                  NOV  766
ANGLE   LEU   20 PHI    -75.00  -65.00        PSI    -85.00  -15.00     NOV  767
ANGLE   LEU   20 CHI1   165.00  225.00                                  NOV  768
ANGLE   GLN   22 PHI    165.00  315.00        PSI    -85.00   95.00     NOV  769
ANGLE   GLN   22 CHI1  -315.00   35.00                                  NOV  770
ANGLE   LYS+  23 PHI     35.00  305.00        PSI    -95.00   95.00     NOV  771
ANGLE   LYS+  23 CHI1  -315.00   35.00                                  NOV  772
ANGLE   VAL   24 PHI   -155.00  -75.00        PSI    -85.00  -15.00     NOV  773
ANGLE   VAL   24 CHI1    75.00  215.00                                  NOV  774
ANGLE   THR   26 PHI   -145.00  -95.00        PSI    125.00  225.00     NOV  775
ANGLE   THR   26 CHI1    45.00  195.00                                  NOV  776
ANGLE   THR   27 PHI   -145.00  -95.00        PSI    135.00  185.00     NOV  777
ANGLE   THR   27 CHI1    -5.00  145.00                                  NOV  778
ANGLE   GLN   28 PHI    -55.00  -35.00        PSI    -85.00  -15.00     NOV  779
ANGLE   GLN   28 CHI1   125.00  225.00                                  NOV  780
ANGLE   GLN   29 PHI    -55.00  -35.00        PSI    -95.00  -15.00     NOV  781
ANGLE   GLN   29 CHI1    15.00  335.00                                  NOV  782
ANGLE   SER   30 PHI    175.00  305.00        PSI    -85.00  -15.00     NOV  783
ANGLE   SER   30 CHI1  -105.00   25.00                                  NOV  784
ANGLE   ILE   31 PHI    -85.00  -75.00        PSI    -85.00  -15.00     NOV  785
ANGLE   ILE   31 CHI1  -155.00  -45.00                                  NOV  786
ANGLE   GLU-  32 PHI    -55.00  -45.00        PSI    -75.00  -15.00     NOV  787
ANGLE   GLU-  32 CHI1   115.00  235.00                                  NOV  788
ANGLE   GLN   33 PHI    175.00  305.00        PSI    -95.00  -15.00     NOV  789
ANGLE   GLN   33 CHI1  -275.00   65.00                                  NOV  790
ANGLE   LEU   34 PHI    -75.00  -65.00        PSI    -85.00  -25.00     NOV  791
ANGLE   LEU   34 CHI1   175.00  195.00                                  NOV  792
ANGLE   GLU-  35 PHI    -65.00  -55.00        PSI    -85.00  -15.00     NOV  793
ANGLE   GLU-  35 CHI1  -105.00   25.00                                  NOV  794
ANGLE   ASN   36 PHI     45.00  285.00        PSI    -85.00   65.00     NOV  795
ANGLE   ASN   36 CHI1  -315.00   35.00                                  NOV  796
ANGLE   LYS+  38 PHI     55.00  275.00        PSI    -25.00   65.00     NOV  797
ANGLE   LYS+  38 CHI1  -315.00   35.00                                  NOV  798
ANGLE   THR   39 PHI   -155.00  -85.00        PSI     85.00  185.00     NOV  799
ANGLE   THR   39 CHI1  -235.00   25.00                                  NOV  800
ANGLE   LYS+  40 PHI   -165.00  -75.00        PSI    -95.00    5.00     NOV  801
ANGLE   LYS+  40 CHI1    45.00  345.00                                  NOV  802
ANGLE   ARG+  41 PHI   -145.00  -85.00        PSI   -105.00  225.00     NOV  803
ANGLE   ARG+  41 CHI1   135.00  255.00                                  NOV  804
ANGLE   ARG+  43 PHI     85.00  305.00        PSI   -105.00  115.00     NOV  805
ANGLE   ARG+  43 CHI1  -315.00   35.00                                  NOV  806
ANGLE   PHE   44 PHI   -155.00  -85.00        PSI   -145.00  115.00     NOV  807
ANGLE   PHE   44 CHI1    25.00   75.00                                  NOV  808
ANGLE   LEU   45 PHI    -55.00  -35.00        PSI     85.00  345.00     NOV  809
ANGLE   LEU   45 CHI1    25.00  315.00                                  NOV  810
ANGLE   GLU-  47 PHI    -75.00  -55.00        PSI    -85.00  -15.00     NOV  811
ANGLE   GLU-  47 CHI1  -105.00  -55.00                                  NOV  812
ANGLE   LEU   48 PHI    -65.00  -55.00        PSI    -75.00  -25.00     NOV  813
ANGLE   LEU   48 CHI1   175.00  195.00                                  NOV  814
ANGLE   SER   50 PHI    175.00  305.00        PSI    -85.00   85.00     NOV  815
ANGLE   SER   50 CHI1  -315.00   35.00                                  NOV  816
ANGLE   LEU   52 PHI   -155.00  -85.00        PSI    -95.00   45.00     NOV  817
ANGLE   LEU   52 CHI1  -105.00  105.00                                  NOV  818
ANGLE   VAL   54 PHI   -145.00  -95.00        PSI    155.00  205.00     NOV  819
ANGLE   VAL   54 CHI1   -85.00   -5.00                                  NOV  820
ANGLE   SER   55 PHI    -95.00  -75.00        PSI    125.00  195.00     NOV  821
ANGLE   SER   55 CHI1    25.00   95.00                                  NOV  822
ANGLE   VAL   56 PHI    -65.00  -55.00        PSI    -85.00  -15.00     NOV  823
ANGLE   VAL   56 CHI1    85.00  195.00                                  NOV  824
ANGLE   ASP-  57 PHI    155.00  325.00        PSI    -85.00  -15.00     NOV  825
ANGLE   ASP-  57 CHI1  -315.00   35.00                                  NOV  826
ANGLE   TRP   58 PHI    -75.00  -55.00        PSI    -85.00   -5.00     NOV  827
ANGLE   TRP   58 CHI1   165.00  225.00                                  NOV  828
ANGLE   LEU   59 PHI    -65.00  -55.00        PSI    -75.00  -15.00     NOV  829
ANGLE   LEU   59 CHI1  -105.00  -55.00                                  NOV  830
ANGLE   LEU   60 PHI   -175.00  -65.00        PSI    -95.00   -5.00     NOV  831
ANGLE   LEU   60 CHI1  -105.00  -55.00                                  NOV  832
ANGLE   ASN   61 PHI   -145.00  -95.00        PSI    -95.00   65.00     NOV  833
ANGLE   ASN   61 CHI1  -315.00   35.00                                  NOV  834
ANGLE   THR   63 PHI     55.00  215.00        PSI    105.00  135.00     NOV  835
ANGLE   THR   63 CHI1   -25.00  145.00                                  NOV  836
ANGLE   SER   64 PHI     35.00  325.00        PSI     25.00  205.00     NOV  837
ANGLE   SER   64 CHI1  -195.00   25.00                                  NOV  838
ANGLE   ASP-  65 PHI     35.00  325.00        PSI      5.00  225.00     NOV  839
ANGLE   ASP-  65 CHI1  -315.00   35.00                                  NOV  840
ANGLE   SER   66 PHI     35.00  325.00        PSI     45.00  185.00     NOV  841
ANGLE   SER   66 CHI1  -315.00   35.00                                  NOV  842
ANGLE   ASN   67 PHI     35.00  325.00        PSI   -105.00  135.00     NOV  843
ANGLE   ASN   67 CHI1  -315.00   35.00                                  NOV  844
ANGLE   VAL   68 PHI     35.00  325.00        PSI   -105.00  225.00     NOV  845
ANGLE   VAL   68 CHI1  -315.00   35.00                                  NOV  846
MASTER        0    0  157   93  444   34  112                           NOV  847
END                                                                     NOV  848


  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had 740 H/Q atoms
  Start of MODEL    1
    1    H    SER   1           HN       SER   1  -4.377  11.626   5.135
    2    HA   SER   1           HA       SER   1  -4.466  12.040   2.355
    3   1HB   SER   1          2HB       SER   1  -1.949  10.966   3.635
    4   2HB   SER   1          3HB       SER   1  -2.188  12.457   2.698
    5    HG   SER   1           HG       SER   1  -1.921  13.056   4.850
    6    QB   SER   1           QB       SER   1  -2.068  11.711   3.167
    7    H    ILE   2           HN       ILE   2  -3.107  10.554   0.787
    8    HA   ILE   2           HA       ILE   2  -4.088   7.972   0.570
    9    HB   ILE   2           HB       ILE   2  -3.193   8.986  -1.326
   10   1HG1  ILE   2          2HG1      ILE   2  -1.445   7.387  -2.150
   11   2HG1  ILE   2          3HG1      ILE   2  -1.319   6.710  -0.536
   12   1HG2  ILE   2          1HG2      ILE   2  -1.128  10.072   0.284
   13   2HG2  ILE   2          2HG2      ILE   2  -0.318   8.989  -0.847
   14   3HG2  ILE   2          3HG2      ILE   2  -1.383  10.264  -1.452
   15   1HD1  ILE   2          3HD1      ILE   2  -3.987   6.355  -0.889
   16   2HD1  ILE   2          1HD1      ILE   2  -3.491   6.474  -2.587
   17   3HD1  ILE   2          2HD1      ILE   2  -2.789   5.232  -1.540
   18    QG1  ILE   2           QG1      ILE   2  -1.382   7.049  -1.343
   19    QG2  ILE   2           QG2      ILE   2  -0.943   9.775  -0.672
   20    QD1  ILE   2           QD1      ILE   2  -3.422   6.020  -1.672
   21    H    SER   3           HN       SER   3  -0.704   8.697   1.735
   22    HA   SER   3           HA       SER   3  -0.227   6.040   2.378
   23   1HB   SER   3          2HB       SER   3   1.455   7.800   2.287
   24   2HB   SER   3          3HB       SER   3   0.939   8.437   3.865
   25    HG   SER   3           HG       SER   3   1.763   5.745   3.383
   26    QB   SER   3           QB       SER   3   1.197   8.119   3.076
   27    H    SER   4           HN       SER   4  -1.883   8.492   4.344
   28    HA   SER   4           HA       SER   4  -1.915   7.077   6.793
   29   1HB   SER   4          2HB       SER   4  -2.754   9.464   6.394
   30   2HB   SER   4          3HB       SER   4  -4.269   8.710   5.803
   31    HG   SER   4           HG       SER   4  -4.385   9.138   8.047
   32    QB   SER   4           QB       SER   4  -3.512   9.087   6.098
   33    NH1  ARG   5           NH2      ARG   5  -7.180   9.682   1.254
   34    NH2  ARG   5           NH1      ARG   5  -6.467   9.426  -0.938
   35    H    ARG   5           HN       ARG   5  -4.005   6.765   3.867
   36    HA   ARG   5           HA       ARG   5  -5.863   4.956   5.127
   37   1HB   ARG   5          2HB       ARG   5  -5.401   4.771   2.166
   38   2HB   ARG   5          3HB       ARG   5  -6.870   4.694   3.138
   39   1HG   ARG   5          2HG       ARG   5  -6.577   7.193   3.596
   40   2HG   ARG   5          3HG       ARG   5  -5.308   7.115   2.350
   41   1HD   ARG   5          2HD       ARG   5  -7.551   5.824   1.227
   42   2HD   ARG   5          3HD       ARG   5  -8.190   7.272   1.969
   43    HE   ARG   5           HE       ARG   5  -6.438   6.994  -0.359
   44   1HH1  ARG   5          2HH2      ARG   5  -7.481   9.239   2.109
   45   2HH1  ARG   5          1HH2      ARG   5  -7.367  10.662   1.111
   46   1HH2  ARG   5          2HH1      ARG   5  -6.364   8.828  -1.749
   47   2HH2  ARG   5          1HH1      ARG   5  -6.521  10.419  -1.105
   48    QB   ARG   5           QB       ARG   5  -6.135   4.733   2.652
   49    QG   ARG   5           QG       ARG   5  -5.943   7.154   2.973
   50    QD   ARG   5           QD       ARG   5  -7.871   6.548   1.598
   51    QH1  ARG   5           QH2      ARG   5  -7.424   9.950   1.610
   52    QH2  ARG   5           QH1      ARG   5  -6.442   9.624  -1.427
   53    H    VAL   6           HN       VAL   6  -3.060   4.416   2.933
   54    HA   VAL   6           HA       VAL   6  -3.163   1.582   2.972
   55    HB   VAL   6           HB       VAL   6  -0.826   3.492   2.566
   56   1HG1  VAL   6          1HG1      VAL   6  -0.977   0.478   2.084
   57   2HG1  VAL   6          2HG1      VAL   6   0.298   1.547   1.460
   58   3HG1  VAL   6          3HG1      VAL   6   0.103   1.340   3.200
   59   1HG2  VAL   6          3HG2      VAL   6  -2.578   1.933   0.625
   60   2HG2  VAL   6          1HG2      VAL   6  -2.597   3.695   0.860
   61   3HG2  VAL   6          2HG2      VAL   6  -1.168   2.910   0.173
   62    QG1  VAL   6           QG1      VAL   6  -0.192   1.122   2.248
   63    QG2  VAL   6           QG2      VAL   6  -2.114   2.846   0.553
   64    QQG  VAL   6           QQG      VAL   6  -1.153   1.984   1.400
   65    H    LYS   7           HN       LYS   7  -1.084   3.750   4.938
   66    HA   LYS   7           HA       LYS   7   0.043   1.717   6.490
   67   1HB   LYS   7          2HB       LYS   7   0.910   4.011   6.179
   68   2HB   LYS   7          3HB       LYS   7  -0.303   4.641   7.291
   69   1HG   LYS   7          2HG       LYS   7   1.408   2.331   8.217
   70   2HG   LYS   7          3HG       LYS   7   2.217   3.886   8.001
   71   1HD   LYS   7          2HD       LYS   7  -0.365   3.941   9.531
   72   2HD   LYS   7          3HD       LYS   7   0.947   3.080  10.314
   73   1HE   LYS   7          2HE       LYS   7   1.256   5.917   9.224
   74   2HE   LYS   7          3HE       LYS   7   0.707   5.566  10.869
   75   1HZ   LYS   7          1HZ       LYS   7   2.760   4.431  11.296
   76   2HZ   LYS   7          2HZ       LYS   7   3.309   4.724   9.772
   77   3HZ   LYS   7          3HZ       LYS   7   3.053   5.970  10.809
   78    QB   LYS   7           QB       LYS   7   0.303   4.326   6.735
   79    QG   LYS   7           QG       LYS   7   1.813   3.109   8.109
   80    QD   LYS   7           QD       LYS   7   0.291   3.511   9.923
   81    QE   LYS   7           QE       LYS   7   0.982   5.741  10.047
   82    QZ   LYS   7           QZ       LYS   7   3.041   5.042  10.626
   83    H    SER   8           HN       SER   8  -2.750   3.854   7.288
   84    HA   SER   8           HA       SER   8  -3.376   2.805   9.829
   85   1HB   SER   8          2HB       SER   8  -4.493   4.803   8.879
   86   2HB   SER   8          3HB       SER   8  -5.292   3.777   7.663
   87    HG   SER   8           HG       SER   8  -5.627   3.614  10.480
   88    QB   SER   8           QB       SER   8  -4.892   4.290   8.271
   89    H    LYS   9           HN       LYS   9  -4.401   1.650   6.522
   90    HA   LYS   9           HA       LYS   9  -6.045  -0.405   7.605
   91   1HB   LYS   9          2HB       LYS   9  -6.021   0.604   5.209
   92   2HB   LYS   9          3HB       LYS   9  -4.660  -0.479   4.923
   93   1HG   LYS   9          2HG       LYS   9  -6.522  -1.808   4.266
   94   2HG   LYS   9          3HG       LYS   9  -6.339  -2.293   5.961
   95   1HD   LYS   9          2HD       LYS   9  -8.026  -0.188   6.291
   96   2HD   LYS   9          3HD       LYS   9  -8.383  -0.565   4.597
   97   1HE   LYS   9          2HE       LYS   9  -8.567  -3.078   5.532
   98   2HE   LYS   9          3HE       LYS   9  -8.739  -2.264   7.096
   99   1HZ   LYS   9          1HZ       LYS   9 -10.616  -1.033   6.042
  100   2HZ   LYS   9          2HZ       LYS   9 -10.479  -2.025   4.732
  101   3HZ   LYS   9          3HZ       LYS   9 -10.864  -2.653   6.197
  102    QB   LYS   9           QB       LYS   9  -5.340   0.062   5.066
  103    QG   LYS   9           QG       LYS   9  -6.431  -2.051   5.114
  104    QD   LYS   9           QD       LYS   9  -8.204  -0.376   5.444
  105    QE   LYS   9           QE       LYS   9  -8.653  -2.671   6.314
  106    QZ   LYS   9           QZ       LYS   9 -10.653  -1.904   5.657
  107    NH1  ARG  10           NH2      ARG  10   1.999  -0.278   4.064
  108    NH2  ARG  10           NH1      ARG  10   2.610   1.491   5.359
  109    H    ARG  10           HN       ARG  10  -2.606  -0.244   6.634
  110    HA   ARG  10           HA       ARG  10  -1.874  -2.921   6.986
  111   1HB   ARG  10          2HB       ARG  10  -0.518  -0.517   6.494
  112   2HB   ARG  10          3HB       ARG  10   0.130  -1.020   8.055
  113   1HG   ARG  10          2HG       ARG  10   0.408  -3.359   6.873
  114   2HG   ARG  10          3HG       ARG  10   0.192  -2.426   5.391
  115   1HD   ARG  10          2HD       ARG  10   2.335  -2.303   7.483
  116   2HD   ARG  10          3HD       ARG  10   2.552  -2.589   5.748
  117    HE   ARG  10           HE       ARG  10   2.791  -0.192   7.184
  118   1HH1  ARG  10          2HH2      ARG  10   1.772  -1.252   3.931
  119   2HH1  ARG  10          1HH2      ARG  10   2.075   0.377   3.276
  120   1HH2  ARG  10          2HH1      ARG  10   2.781   1.960   6.229
  121   2HH2  ARG  10          1HH1      ARG  10   2.613   2.024   4.483
  122    QB   ARG  10           QB       ARG  10  -0.194  -0.768   7.275
  123    QG   ARG  10           QG       ARG  10   0.300  -2.893   6.132
  124    QD   ARG  10           QD       ARG  10   2.443  -2.446   6.615
  125    QH1  ARG  10           QH2      ARG  10   1.924  -0.438   3.603
  126    QH2  ARG  10           QH1      ARG  10   2.697   1.992   5.356
  127    H    ILE  11           HN       ILE  11  -1.996  -0.288   9.379
  128    HA   ILE  11           HA       ILE  11  -1.157  -1.780  11.652
  129    HB   ILE  11           HB       ILE  11  -2.988   0.629  11.598
  130   1HG1  ILE  11          2HG1      ILE  11  -1.082   1.524  10.642
  131   2HG1  ILE  11          3HG1      ILE  11  -0.758   1.705  12.341
  132   1HG2  ILE  11          1HG2      ILE  11  -3.027  -0.590  13.759
  133   2HG2  ILE  11          2HG2      ILE  11  -1.256  -0.492  13.833
  134   3HG2  ILE  11          3HG2      ILE  11  -2.246   0.982  13.893
  135   1HD1  ILE  11          1HD1      ILE  11   0.662  -0.374  12.279
  136   2HD1  ILE  11          2HD1      ILE  11   0.458  -0.395  10.510
  137   3HD1  ILE  11          3HD1      ILE  11   1.268   0.963  11.291
  138    QG1  ILE  11           QG1      ILE  11  -0.920   1.614  11.491
  139    QG2  ILE  11           QG2      ILE  11  -2.176  -0.033  13.828
  140    QD1  ILE  11           QD1      ILE  11   0.796   0.065  11.360
  141    H    GLN  12           HN       GLN  12  -4.480  -1.008  10.504
  142    HA   GLN  12           HA       GLN  12  -5.853  -2.586  12.430
  143   1HB   GLN  12          2HB       GLN  12  -6.548  -1.791   9.576
  144   2HB   GLN  12          3HB       GLN  12  -7.658  -2.722  10.585
  145   1HG   GLN  12          2HG       GLN  12  -6.485  -0.061  11.492
  146   2HG   GLN  12          3HG       GLN  12  -7.997  -0.186  10.588
  147   1HE2  GLN  12          2HE2      GLN  12  -9.850  -1.653  13.301
  148   2HE2  GLN  12          1HE2      GLN  12  -9.756  -1.603  11.551
  149    QB   GLN  12           QB       GLN  12  -7.103  -2.256  10.081
  150    QG   GLN  12           QG       GLN  12  -7.241  -0.124  11.040
  151    QE2  GLN  12           QE2      GLN  12  -9.803  -1.628  12.426
  152    H    LEU  13           HN       LEU  13  -4.481  -3.580   9.294
  153    HA   LEU  13           HA       LEU  13  -5.260  -6.359   9.465
  154   1HB   LEU  13          2HB       LEU  13  -3.476  -4.632   7.791
  155   2HB   LEU  13          3HB       LEU  13  -2.932  -6.278   7.940
  156    HG   LEU  13           HG       LEU  13  -4.421  -5.674   5.968
  157   1HD1  LEU  13          1HD1      LEU  13  -4.661  -8.087   7.733
  158   2HD1  LEU  13          2HD1      LEU  13  -5.670  -7.959   6.273
  159   3HD1  LEU  13          3HD1      LEU  13  -3.903  -7.889   6.141
  160   1HD2  LEU  13          1HD2      LEU  13  -6.200  -4.513   7.367
  161   2HD2  LEU  13          2HD2      LEU  13  -6.768  -5.683   6.162
  162   3HD2  LEU  13          3HD2      LEU  13  -6.742  -6.130   7.870
  163    QB   LEU  13           QB       LEU  13  -3.204  -5.455   7.865
  164    QD1  LEU  13           QD1      LEU  13  -4.745  -7.978   6.716
  165    QD2  LEU  13           QD2      LEU  13  -6.570  -5.442   7.133
  166    QQD  LEU  13           QQD      LEU  13  -5.657  -6.710   6.924
  167    H    GLY  14           HN       GLY  14  -2.861  -4.535  11.162
  168   1HA   GLY  14          1HA       GLY  14  -1.446  -5.167  12.832
  169   2HA   GLY  14          2HA       GLY  14  -2.105  -6.811  12.760
  170    QA   GLY  14           QA       GLY  14  -1.776  -5.989  12.796
  171    H    LEU  15           HN       LEU  15  -0.715  -5.053   9.983
  172    HA   LEU  15           HA       LEU  15   1.634  -6.927   9.996
  173   1HB   LEU  15          2HB       LEU  15   0.182  -5.835   7.561
  174   2HB   LEU  15          3HB       LEU  15   1.587  -6.909   7.579
  175    HG   LEU  15           HG       LEU  15  -1.237  -7.602   8.480
  176   1HD1  LEU  15          1HD1      LEU  15  -0.849  -7.462   6.037
  177   2HD1  LEU  15          2HD1      LEU  15   0.526  -8.577   6.198
  178   3HD1  LEU  15          3HD1      LEU  15  -1.129  -9.134   6.552
  179   1HD2  LEU  15          1HD2      LEU  15   1.355  -9.123   8.785
  180   2HD2  LEU  15          2HD2      LEU  15   0.026  -8.925   9.942
  181   3HD2  LEU  15          3HD2      LEU  15  -0.172  -9.988   8.549
  182    QB   LEU  15           QB       LEU  15   0.885  -6.372   7.570
  183    QD1  LEU  15           QD1      LEU  15  -0.484  -8.391   6.262
  184    QD2  LEU  15           QD2      LEU  15   0.403  -9.345   9.092
  185    QQD  LEU  15           QQD      LEU  15  -0.041  -8.868   7.677
  186    H    ASN  16           HN       ASN  16   3.436  -6.072   8.779
  187    HA   ASN  16           HA       ASN  16   3.720  -3.100   9.156
  188   1HB   ASN  16          2HB       ASN  16   5.976  -3.374   9.681
  189   2HB   ASN  16          3HB       ASN  16   5.109  -4.554  10.671
  190   1HD2  ASN  16          2HD2      ASN  16   6.479  -7.369   8.858
  191   2HD2  ASN  16          1HD2      ASN  16   5.000  -6.910   9.614
  192    QB   ASN  16           QB       ASN  16   5.542  -3.964  10.176
  193    QD2  ASN  16           QD2      ASN  16   5.740  -7.140   9.236
  194    H    GLN  17           HN       GLN  17   5.612  -2.298   7.828
  195    HA   GLN  17           HA       GLN  17   4.743  -2.254   5.101
  196   1HB   GLN  17          2HB       GLN  17   6.964  -1.019   6.692
  197   2HB   GLN  17          3HB       GLN  17   7.172  -1.167   4.939
  198   1HG   GLN  17          2HG       GLN  17   4.906   0.004   4.737
  199   2HG   GLN  17          3HG       GLN  17   5.127   0.448   6.444
  200   1HE2  GLN  17          2HE2      GLN  17   7.248   3.145   5.414
  201   2HE2  GLN  17          1HE2      GLN  17   6.002   2.609   6.517
  202    QB   GLN  17           QB       GLN  17   7.068  -1.093   5.815
  203    QG   GLN  17           QG       GLN  17   5.016   0.226   5.590
  204    QE2  GLN  17           QE2      GLN  17   6.625   2.877   5.965
  205    H    ALA  18           HN       ALA  18   7.408  -4.076   6.709
  206    HA   ALA  18           HA       ALA  18   8.577  -4.935   4.233
  207   1HB   ALA  18          1HB       ALA  18   9.631  -4.901   6.604
  208   2HB   ALA  18          2HB       ALA  18   8.805  -6.450   6.851
  209   3HB   ALA  18          3HB       ALA  18   9.987  -6.274   5.545
  210    QB   ALA  18           QB       ALA  18   9.474  -5.875   6.333
  211    H    GLU  19           HN       GLU  19   6.345  -6.525   6.576
  212    HA   GLU  19           HA       GLU  19   5.892  -8.925   5.125
  213   1HB   GLU  19          2HB       GLU  19   4.241  -7.280   7.057
  214   2HB   GLU  19          3HB       GLU  19   3.494  -8.633   6.212
  215   1HG   GLU  19          2HG       GLU  19   5.054 -10.222   7.067
  216   2HG   GLU  19          3HG       GLU  19   6.022  -8.982   7.858
  217    QB   GLU  19           QB       GLU  19   3.868  -7.956   6.634
  218    QG   GLU  19           QG       GLU  19   5.538  -9.602   7.463
  219    H    LEU  20           HN       LEU  20   4.137  -5.776   4.992
  220    HA   LEU  20           HA       LEU  20   2.354  -6.530   2.937
  221   1HB   LEU  20          2HB       LEU  20   2.108  -4.467   4.245
  222   2HB   LEU  20          3HB       LEU  20   3.548  -3.801   3.463
  223    HG   LEU  20           HG       LEU  20   1.960  -4.658   1.296
  224   1HD1  LEU  20          3HD1      LEU  20   0.054  -5.104   2.784
  225   2HD1  LEU  20          1HD1      LEU  20   0.072  -3.401   3.286
  226   3HD1  LEU  20          2HD1      LEU  20  -0.236  -3.825   1.586
  227   1HD2  LEU  20          2HD2      LEU  20   3.174  -2.338   1.901
  228   2HD2  LEU  20          3HD2      LEU  20   2.034  -2.568   0.592
  229   3HD2  LEU  20          1HD2      LEU  20   1.466  -1.859   2.091
  230    QB   LEU  20           QB       LEU  20   2.828  -4.134   3.854
  231    QD1  LEU  20           QD1      LEU  20  -0.037  -4.110   2.552
  232    QD2  LEU  20           QD2      LEU  20   2.225  -2.255   1.528
  233    QQD  LEU  20           QQD      LEU  20   1.094  -3.183   2.040
  234    H    ALA  21           HN       ALA  21   5.656  -5.030   2.657
  235    HA   ALA  21           HA       ALA  21   5.812  -4.933  -0.119
  236   1HB   ALA  21          3HB       ALA  21   7.547  -4.120   1.537
  237   2HB   ALA  21          1HB       ALA  21   8.142  -5.783   1.649
  238   3HB   ALA  21          2HB       ALA  21   8.162  -4.950   0.093
  239    QB   ALA  21           QB       ALA  21   7.950  -4.951   1.093
  240    H    GLN  22           HN       GLN  22   6.582  -7.739   2.009
  241    HA   GLN  22           HA       GLN  22   7.276  -9.473  -0.169
  242   1HB   GLN  22          2HB       GLN  22   6.305 -10.171   2.636
  243   2HB   GLN  22          3HB       GLN  22   6.997 -11.290   1.452
  244   1HG   GLN  22          2HG       GLN  22   8.889  -9.236   1.492
  245   2HG   GLN  22          3HG       GLN  22   8.362  -9.297   3.174
  246   1HE2  GLN  22          2HE2      GLN  22   9.870 -12.499   3.754
  247   2HE2  GLN  22          1HE2      GLN  22   8.706 -11.337   4.372
  248    QB   GLN  22           QB       GLN  22   6.651 -10.730   2.044
  249    QG   GLN  22           QG       GLN  22   8.625  -9.267   2.333
  250    QE2  GLN  22           QE2      GLN  22   9.288 -11.918   4.063
  251    H    LYS  23           HN       LYS  23   4.157  -8.933   1.509
  252    HA   LYS  23           HA       LYS  23   2.651 -10.938   0.125
  253   1HB   LYS  23          2HB       LYS  23   1.863  -8.292   1.383
  254   2HB   LYS  23          3HB       LYS  23   0.701  -9.457   0.788
  255   1HG   LYS  23          2HG       LYS  23   2.759 -10.557   2.699
  256   2HG   LYS  23          3HG       LYS  23   1.718  -9.301   3.344
  257   1HD   LYS  23          2HD       LYS  23  -0.187 -10.859   2.137
  258   2HD   LYS  23          3HD       LYS  23   1.034 -12.096   2.477
  259   1HE   LYS  23          2HE       LYS  23   0.997 -11.474   4.880
  260   2HE   LYS  23          3HE       LYS  23  -0.045 -10.085   4.517
  261   1HZ   LYS  23          3HZ       LYS  23  -1.776 -11.555   3.861
  262   2HZ   LYS  23          1HZ       LYS  23  -0.856 -12.882   4.196
  263   3HZ   LYS  23          2HZ       LYS  23  -1.309 -11.861   5.405
  264    QB   LYS  23           QB       LYS  23   1.282  -8.875   1.085
  265    QG   LYS  23           QG       LYS  23   2.238  -9.929   3.021
  266    QD   LYS  23           QD       LYS  23   0.424 -11.477   2.307
  267    QE   LYS  23           QE       LYS  23   0.476 -10.779   4.698
  268    QZ   LYS  23           QZ       LYS  23  -1.314 -12.099   4.487
  269    H    VAL  24           HN       VAL  24   3.404  -7.571  -0.635
  270    HA   VAL  24           HA       VAL  24   1.863  -7.412  -3.075
  271    HB   VAL  24           HB       VAL  24   4.132  -5.782  -1.867
  272   1HG1  VAL  24          2HG1      VAL  24   4.001  -5.496  -4.433
  273   2HG1  VAL  24          3HG1      VAL  24   2.356  -4.894  -4.139
  274   3HG1  VAL  24          1HG1      VAL  24   3.742  -4.038  -3.462
  275   1HG2  VAL  24          2HG2      VAL  24   1.865  -5.761  -0.704
  276   2HG2  VAL  24          3HG2      VAL  24   2.367  -4.183  -1.337
  277   3HG2  VAL  24          1HG2      VAL  24   1.166  -5.165  -2.199
  278    QG1  VAL  24           QG1      VAL  24   3.366  -4.809  -4.011
  279    QG2  VAL  24           QG2      VAL  24   1.799  -5.036  -1.413
  280    QQG  VAL  24           QQG      VAL  24   2.583  -4.923  -2.712
  281    H    GLY  25           HN       GLY  25   5.209  -8.311  -2.211
  282   1HA   GLY  25          1HA       GLY  25   6.580  -9.784  -3.407
  283   2HA   GLY  25          2HA       GLY  25   5.596  -9.593  -4.866
  284    QA   GLY  25           QA       GLY  25   6.088  -9.688  -4.137
  285    H    THR  26           HN       THR  26   6.993  -7.156  -2.667
  286    HA   THR  26           HA       THR  26   9.008  -6.320  -4.643
  287    HB   THR  26           HB       THR  26   7.004  -4.937  -5.118
  288    HG1  THR  26          1HG       THR  26   8.137  -2.966  -4.950
  289   1HG2  THR  26          1HG2      THR  26   6.045  -4.888  -2.803
  290   2HG2  THR  26          2HG2      THR  26   7.348  -3.803  -2.296
  291   3HG2  THR  26          3HG2      THR  26   6.197  -3.283  -3.538
  292    QG2  THR  26           QG2      THR  26   6.530  -3.991  -2.879
  293    H    THR  27           HN       THR  27   9.709  -4.043  -3.169
  294    HA   THR  27           HA       THR  27  11.002  -5.305  -0.779
  295    HB   THR  27           HB       THR  27  12.781  -3.589  -1.284
  296    HG1  THR  27          1HG       THR  27  12.557  -2.739  -3.506
  297   1HG2  THR  27          1HG2      THR  27  12.907  -5.941  -2.138
  298   2HG2  THR  27          2HG2      THR  27  12.089  -5.439  -3.627
  299   3HG2  THR  27          3HG2      THR  27  13.688  -4.785  -3.230
  300    QG2  THR  27           QG2      THR  27  12.895  -5.388  -2.998
  301    H    GLN  28           HN       GLN  28  11.052  -4.174   1.173
  302    HA   GLN  28           HA       GLN  28   8.978  -2.493   1.910
  303   1HB   GLN  28          2HB       GLN  28  10.479  -3.649   3.497
  304   2HB   GLN  28          3HB       GLN  28  11.790  -2.518   3.102
  305   1HG   GLN  28          2HG       GLN  28  10.462  -0.624   3.963
  306   2HG   GLN  28          3HG       GLN  28   9.052  -1.674   4.107
  307   1HE2  GLN  28          2HE2      GLN  28  12.061  -2.030   6.914
  308   2HE2  GLN  28          1HE2      GLN  28  12.468  -1.508   5.290
  309    QB   GLN  28           QB       GLN  28  11.135  -3.084   3.299
  310    QG   GLN  28           QG       GLN  28   9.757  -1.149   4.035
  311    QE2  GLN  28           QE2      GLN  28  12.264  -1.769   6.102
  312    H    GLN  29           HN       GLN  29  12.143  -1.569   0.620
  313    HA   GLN  29           HA       GLN  29  12.028   1.185   0.915
  314   1HB   GLN  29          2HB       GLN  29  13.833  -0.463  -0.035
  315   2HB   GLN  29          3HB       GLN  29  13.129  -0.105  -1.611
  316   1HG   GLN  29          2HG       GLN  29  14.151   1.986   0.389
  317   2HG   GLN  29          3HG       GLN  29  15.152   1.272  -0.876
  318   1HE2  GLN  29          2HE2      GLN  29  13.442   2.973  -3.572
  319   2HE2  GLN  29          1HE2      GLN  29  14.125   1.400  -3.190
  320    QB   GLN  29           QB       GLN  29  13.481  -0.284  -0.823
  321    QG   GLN  29           QG       GLN  29  14.652   1.629  -0.243
  322    QE2  GLN  29           QE2      GLN  29  13.784   2.187  -3.381
  323    H    SER  30           HN       SER  30  10.510  -0.830  -1.643
  324    HA   SER  30           HA       SER  30   9.561   1.345  -3.261
  325   1HB   SER  30          2HB       SER  30   8.364  -1.442  -2.941
  326   2HB   SER  30          3HB       SER  30   8.124  -0.301  -4.270
  327    HG   SER  30           HG       SER  30  10.467  -1.745  -3.615
  328    QB   SER  30           QB       SER  30   8.244  -0.872  -3.606
  329    H    ILE  31           HN       ILE  31   8.212  -0.482  -0.513
  330    HA   ILE  31           HA       ILE  31   5.589   0.717  -0.639
  331    HB   ILE  31           HB       ILE  31   7.020  -0.592   1.705
  332   1HG1  ILE  31          2HG1      ILE  31   6.928  -2.159  -0.168
  333   2HG1  ILE  31          3HG1      ILE  31   5.858  -2.634   1.143
  334   1HG2  ILE  31          1HG2      ILE  31   5.077   0.733   2.414
  335   2HG2  ILE  31          2HG2      ILE  31   4.041  -0.140   1.279
  336   3HG2  ILE  31          3HG2      ILE  31   4.821  -1.002   2.627
  337   1HD1  ILE  31          3HD1      ILE  31   4.314  -1.073  -0.778
  338   2HD1  ILE  31          1HD1      ILE  31   5.200  -2.362  -1.596
  339   3HD1  ILE  31          2HD1      ILE  31   4.133  -2.754  -0.254
  340    QG1  ILE  31           QG1      ILE  31   6.393  -2.397   0.488
  341    QG2  ILE  31           QG2      ILE  31   4.646  -0.136   2.107
  342    QD1  ILE  31           QD1      ILE  31   4.549  -2.063  -0.876
  343    H    GLU  32           HN       GLU  32   8.501   1.378   1.361
  344    HA   GLU  32           HA       GLU  32   7.469   3.561   2.759
  345   1HB   GLU  32          2HB       GLU  32   9.485   2.392   3.356
  346   2HB   GLU  32          3HB       GLU  32  10.354   3.033   1.952
  347   1HG   GLU  32          2HG       GLU  32  10.527   5.161   2.886
  348   2HG   GLU  32          3HG       GLU  32   9.006   5.018   3.783
  349    QB   GLU  32           QB       GLU  32   9.920   2.713   2.654
  350    QG   GLU  32           QG       GLU  32   9.766   5.089   3.335
  351    H    GLN  33           HN       GLN  33   9.201   3.505  -0.414
  352    HA   GLN  33           HA       GLN  33   9.108   6.242  -1.023
  353   1HB   GLN  33          2HB       GLN  33  10.374   4.907  -2.412
  354   2HB   GLN  33          3HB       GLN  33   9.112   3.706  -2.670
  355   1HG   GLN  33          2HG       GLN  33   7.900   5.028  -4.157
  356   2HG   GLN  33          3HG       GLN  33   8.665   6.521  -3.608
  357   1HE2  GLN  33          2HE2      GLN  33  10.301   4.624  -6.735
  358   2HE2  GLN  33          1HE2      GLN  33   8.807   4.056  -6.004
  359    QB   GLN  33           QB       GLN  33   9.743   4.307  -2.541
  360    QG   GLN  33           QG       GLN  33   8.283   5.774  -3.882
  361    QE2  GLN  33           QE2      GLN  33   9.554   4.340  -6.370
  362    H    LEU  34           HN       LEU  34   6.586   3.726  -1.625
  363    HA   LEU  34           HA       LEU  34   4.792   5.623  -2.777
  364   1HB   LEU  34          2HB       LEU  34   4.532   3.145  -3.001
  365   2HB   LEU  34          3HB       LEU  34   4.043   3.084  -1.296
  366    HG   LEU  34           HG       LEU  34   2.153   4.690  -1.867
  367   1HD1  LEU  34          1HD1      LEU  34   3.013   4.080  -4.725
  368   2HD1  LEU  34          2HD1      LEU  34   1.480   4.851  -4.255
  369   3HD1  LEU  34          3HD1      LEU  34   2.998   5.671  -3.942
  370   1HD2  LEU  34          2HD2      LEU  34   2.278   1.903  -2.160
  371   2HD2  LEU  34          3HD2      LEU  34   0.840   2.915  -1.995
  372   3HD2  LEU  34          1HD2      LEU  34   1.423   2.472  -3.605
  373    QB   LEU  34           QB       LEU  34   4.288   3.115  -2.149
  374    QD1  LEU  34           QD1      LEU  34   2.497   4.867  -4.307
  375    QD2  LEU  34           QD2      LEU  34   1.514   2.430  -2.587
  376    QQD  LEU  34           QQD      LEU  34   2.005   3.649  -3.447
  377    H    GLU  35           HN       GLU  35   5.111   4.466   0.586
  378    HA   GLU  35           HA       GLU  35   3.024   5.946   1.731
  379   1HB   GLU  35          2HB       GLU  35   5.537   4.600   2.631
  380   2HB   GLU  35          3HB       GLU  35   4.966   5.846   3.722
  381   1HG   GLU  35          2HG       GLU  35   4.363   3.311   4.052
  382   2HG   GLU  35          3HG       GLU  35   3.287   4.608   4.529
  383    QB   GLU  35           QB       GLU  35   5.252   5.223   3.177
  384    QG   GLU  35           QG       GLU  35   3.825   3.959   4.291
  385    H    ASN  36           HN       ASN  36   6.450   7.020   1.313
  386    HA   ASN  36           HA       ASN  36   5.714   9.665   2.332
  387   1HB   ASN  36          2HB       ASN  36   7.893  10.385   1.818
  388   2HB   ASN  36          3HB       ASN  36   7.975   8.788   2.575
  389   1HD2  ASN  36          2HD2      ASN  36  10.185   7.880  -0.045
  390   2HD2  ASN  36          1HD2      ASN  36   9.909   7.992   1.681
  391    QB   ASN  36           QB       ASN  36   7.934   9.586   2.197
  392    QD2  ASN  36           QD2      ASN  36  10.047   7.936   0.818
  393    H    GLY  37           HN       GLY  37   4.989   8.134  -0.614
  394   1HA   GLY  37          1HA       GLY  37   3.798   8.912  -2.366
  395   2HA   GLY  37          2HA       GLY  37   3.771  10.519  -1.640
  396    QA   GLY  37           QA       GLY  37   3.785   9.716  -2.003
  397    H    LYS  38           HN       LYS  38   6.707   8.636  -2.512
  398    HA   LYS  38           HA       LYS  38   7.503  10.818  -4.383
  399   1HB   LYS  38          2HB       LYS  38   8.934   8.535  -3.052
  400   2HB   LYS  38          3HB       LYS  38   9.685   9.335  -4.419
  401   1HG   LYS  38          2HG       LYS  38   8.673  11.154  -2.273
  402   2HG   LYS  38          3HG       LYS  38   9.961  10.044  -1.810
  403   1HD   LYS  38          2HD       LYS  38  10.899  12.126  -2.460
  404   2HD   LYS  38          3HD       LYS  38  11.472  10.785  -3.462
  405   1HE   LYS  38          2HE       LYS  38  10.253  11.486  -5.363
  406   2HE   LYS  38          3HE       LYS  38   9.159  12.516  -4.419
  407   1HZ   LYS  38          1HZ       LYS  38  12.028  13.093  -4.634
  408   2HZ   LYS  38          2HZ       LYS  38  10.919  13.688  -5.697
  409   3HZ   LYS  38          3HZ       LYS  38  10.821  14.081  -4.103
  410    QB   LYS  38           QB       LYS  38   9.309   8.935  -3.736
  411    QG   LYS  38           QG       LYS  38   9.317  10.599  -2.042
  412    QD   LYS  38           QD       LYS  38  11.185  11.455  -2.961
  413    QE   LYS  38           QE       LYS  38   9.706  12.001  -4.891
  414    QZ   LYS  38           QZ       LYS  38  11.256  13.621  -4.811
  415    H    THR  39           HN       THR  39   5.262   8.895  -5.152
  416    HA   THR  39           HA       THR  39   6.371   8.523  -7.823
  417    HB   THR  39           HB       THR  39   6.471   6.260  -6.434
  418    HG1  THR  39          1HG       THR  39   6.340   5.273  -8.421
  419   1HG2  THR  39          3HG2      THR  39   3.931   6.362  -5.937
  420   2HG2  THR  39          1HG2      THR  39   3.687   6.021  -7.661
  421   3HG2  THR  39          2HG2      THR  39   4.544   4.854  -6.650
  422    QG2  THR  39           QG2      THR  39   4.054   5.746  -6.749
  423    H    LYS  40           HN       LYS  40   4.669   8.066  -9.390
  424    HA   LYS  40           HA       LYS  40   2.292   9.795  -8.826
  425   1HB   LYS  40          2HB       LYS  40   3.701   8.935 -11.373
  426   2HB   LYS  40          3HB       LYS  40   2.182   9.845 -11.354
  427   1HG   LYS  40          2HG       LYS  40   3.137  11.782 -10.559
  428   2HG   LYS  40          3HG       LYS  40   4.448  10.956  -9.707
  429   1HD   LYS  40          2HD       LYS  40   5.609  10.443 -11.747
  430   2HD   LYS  40          3HD       LYS  40   4.266  11.048 -12.743
  431   1HE   LYS  40          2HE       LYS  40   4.621  13.319 -12.043
  432   2HE   LYS  40          3HE       LYS  40   5.751  12.845 -10.764
  433   1HZ   LYS  40          3HZ       LYS  40   6.322  12.348 -13.605
  434   2HZ   LYS  40          1HZ       LYS  40   6.746  13.743 -12.845
  435   3HZ   LYS  40          2HZ       LYS  40   7.367  12.311 -12.331
  436    QB   LYS  40           QB       LYS  40   2.941   9.390 -11.363
  437    QG   LYS  40           QG       LYS  40   3.792  11.369 -10.133
  438    QD   LYS  40           QD       LYS  40   4.938  10.745 -12.245
  439    QE   LYS  40           QE       LYS  40   5.186  13.082 -11.403
  440    QZ   LYS  40           QZ       LYS  40   6.812  12.801 -12.927
  441    NH1  ARG  41           NH2      ARG  41  -2.875   5.553 -14.149
  442    NH2  ARG  41           NH1      ARG  41  -1.830   7.234 -15.351
  443    H    ARG  41           HN       ARG  41   3.204   6.635 -10.325
  444    HA   ARG  41           HA       ARG  41   0.536   5.620  -9.600
  445   1HB   ARG  41          2HB       ARG  41   1.107   6.310 -12.259
  446   2HB   ARG  41          3HB       ARG  41   1.486   4.596 -12.202
  447   1HG   ARG  41          2HG       ARG  41  -0.750   4.453 -12.680
  448   2HG   ARG  41          3HG       ARG  41  -0.829   4.401 -10.924
  449   1HD   ARG  41          2HD       ARG  41  -2.473   6.043 -11.519
  450   2HD   ARG  41          3HD       ARG  41  -1.085   6.978 -11.004
  451    HE   ARG  41           HE       ARG  41  -0.786   7.794 -13.123
  452   1HH1  ARG  41          2HH2      ARG  41  -3.009   5.068 -13.274
  453   2HH1  ARG  41          1HH2      ARG  41  -3.386   5.239 -14.960
  454   1HH2  ARG  41          2HH1      ARG  41  -1.185   8.009 -15.405
  455   2HH2  ARG  41          1HH1      ARG  41  -2.299   6.946 -16.198
  456    QB   ARG  41           QB       ARG  41   1.296   5.453 -12.231
  457    QG   ARG  41           QG       ARG  41  -0.790   4.427 -11.802
  458    QD   ARG  41           QD       ARG  41  -1.779   6.511 -11.262
  459    QH1  ARG  41           QH2      ARG  41  -3.197   5.154 -14.117
  460    QH2  ARG  41           QH1      ARG  41  -1.742   7.478 -15.801
  461    HA   PRO  42           HA       PRO  42   3.689   2.562  -8.412
  462   1HB   PRO  42          2HB       PRO  42   1.993   0.910  -6.928
  463   2HB   PRO  42          3HB       PRO  42   2.906   2.314  -6.313
  464   1HG   PRO  42          2HG       PRO  42   0.011   2.070  -6.859
  465   2HG   PRO  42          3HG       PRO  42   0.844   3.211  -5.803
  466   1HD   PRO  42          2HD       PRO  42  -0.171   3.752  -8.404
  467   2HD   PRO  42          3HD       PRO  42   0.900   4.806  -7.435
  468    QB   PRO  42           QB       PRO  42   2.450   1.612  -6.620
  469    QG   PRO  42           QG       PRO  42   0.427   2.640  -6.331
  470    QD   PRO  42           QD       PRO  42   0.365   4.279  -7.920
  471    NH1  ARG  43           NH2      ARG  43   9.332  -3.506 -10.309
  472    NH2  ARG  43           NH1      ARG  43   8.200  -5.483 -10.722
  473    H    ARG  43           HN       ARG  43   4.303   0.803  -9.608
  474    HA   ARG  43           HA       ARG  43   2.652  -0.447 -11.573
  475   1HB   ARG  43          2HB       ARG  43   4.429  -2.170 -11.670
  476   2HB   ARG  43          3HB       ARG  43   5.125  -0.544 -11.621
  477   1HG   ARG  43          2HG       ARG  43   5.472  -0.849  -9.128
  478   2HG   ARG  43          3HG       ARG  43   4.965  -2.535  -9.300
  479   1HD   ARG  43          2HD       ARG  43   7.246  -1.426 -10.967
  480   2HD   ARG  43          3HD       ARG  43   7.467  -1.873  -9.261
  481    HE   ARG  43           HE       ARG  43   6.163  -3.990 -10.718
  482   1HH1  ARG  43          2HH2      ARG  43   9.316  -2.505 -10.185
  483   2HH1  ARG  43          1HH2      ARG  43  10.221  -3.983 -10.274
  484   1HH2  ARG  43          2HH1      ARG  43   7.337  -5.995 -10.845
  485   2HH2  ARG  43          1HH1      ARG  43   9.064  -6.005 -10.711
  486    QB   ARG  43           QB       ARG  43   4.777  -1.357 -11.645
  487    QG   ARG  43           QG       ARG  43   5.219  -1.692  -9.214
  488    QD   ARG  43           QD       ARG  43   7.356  -1.650 -10.114
  489    QH1  ARG  43           QH2      ARG  43   9.769  -3.244 -10.229
  490    QH2  ARG  43           QH1      ARG  43   8.200  -6.000 -10.778
  491    H    PHE  44           HN       PHE  44   3.258  -1.168  -8.199
  492    HA   PHE  44           HA       PHE  44   1.697  -3.641  -8.258
  493   1HB   PHE  44          2HB       PHE  44   2.345  -3.518  -5.763
  494   2HB   PHE  44          3HB       PHE  44   3.603  -3.770  -6.948
  495    HD1  PHE  44           HD2      PHE  44   2.002  -1.066  -4.884
  496    HD2  PHE  44           HD1      PHE  44   5.538  -2.483  -6.899
  497    HE1  PHE  44           HE2      PHE  44   3.271   0.894  -4.054
  498    HE2  PHE  44           HE1      PHE  44   6.762  -0.452  -6.182
  499    HZ   PHE  44           HZ       PHE  44   5.640   1.223  -4.710
  500    QB   PHE  44           QB       PHE  44   2.974  -3.644  -6.356
  501    QR   PHE  44           QR       PHE  44   4.393  -0.777  -5.505
  502    H    LEU  45           HN       LEU  45   0.173  -1.197  -8.966
  503    HA   LEU  45           HA       LEU  45  -1.526  -0.518  -6.794
  504   1HB   LEU  45          2HB       LEU  45  -1.945  -0.669  -9.776
  505   2HB   LEU  45          3HB       LEU  45  -3.358  -0.469  -8.735
  506    HG   LEU  45           HG       LEU  45  -0.957   1.363  -8.667
  507   1HD1  LEU  45          2HD1      LEU  45  -1.996   1.447 -10.881
  508   2HD1  LEU  45          3HD1      LEU  45  -3.594   1.705 -10.142
  509   3HD1  LEU  45          1HD1      LEU  45  -2.328   2.936  -9.978
  510   1HD2  LEU  45          3HD2      LEU  45  -2.421   1.445  -6.595
  511   2HD2  LEU  45          1HD2      LEU  45  -2.451   2.943  -7.525
  512   3HD2  LEU  45          2HD2      LEU  45  -3.801   1.813  -7.639
  513    QB   LEU  45           QB       LEU  45  -2.651  -0.569  -9.255
  514    QD1  LEU  45           QD1      LEU  45  -2.639   2.029 -10.334
  515    QD2  LEU  45           QD2      LEU  45  -2.891   2.067  -7.253
  516    QQD  LEU  45           QQD      LEU  45  -2.765   2.048  -8.793
  517    HA   PRO  46           HA       PRO  46  -4.382  -4.196  -7.627
  518   1HB   PRO  46          2HB       PRO  46  -3.492  -6.433  -8.968
  519   2HB   PRO  46          3HB       PRO  46  -4.335  -5.057  -9.733
  520   1HG   PRO  46          2HG       PRO  46  -1.375  -5.621  -9.668
  521   2HG   PRO  46          3HG       PRO  46  -2.364  -5.021 -11.027
  522   1HD   PRO  46          2HD       PRO  46  -0.822  -3.416  -9.461
  523   2HD   PRO  46          3HD       PRO  46  -2.334  -2.836 -10.204
  524    QB   PRO  46           QB       PRO  46  -3.913  -5.745  -9.351
  525    QG   PRO  46           QG       PRO  46  -1.870  -5.321 -10.347
  526    QD   PRO  46           QD       PRO  46  -1.578  -3.126  -9.832
  527    H    GLU  47           HN       GLU  47  -0.932  -5.143  -7.437
  528    HA   GLU  47           HA       GLU  47  -1.127  -7.178  -5.514
  529   1HB   GLU  47          2HB       GLU  47   1.020  -5.184  -6.220
  530   2HB   GLU  47          3HB       GLU  47   1.296  -6.550  -5.124
  531   1HG   GLU  47          2HG       GLU  47   1.108  -8.141  -6.773
  532   2HG   GLU  47          3HG       GLU  47   0.169  -7.114  -7.863
  533    QB   GLU  47           QB       GLU  47   1.158  -5.867  -5.672
  534    QG   GLU  47           QG       GLU  47   0.638  -7.627  -7.318
  535    H    LEU  48           HN       LEU  48  -0.778  -3.596  -5.010
  536    HA   LEU  48           HA       LEU  48  -0.649  -3.793  -2.137
  537   1HB   LEU  48          2HB       LEU  48   0.004  -1.828  -3.654
  538   2HB   LEU  48          3HB       LEU  48  -1.703  -1.462  -3.781
  539    HG   LEU  48           HG       LEU  48  -0.893   0.000  -2.143
  540   1HD1  LEU  48          1HD1      LEU  48  -2.858  -1.301  -1.152
  541   2HD1  LEU  48          2HD1      LEU  48  -1.651  -2.275  -0.283
  542   3HD1  LEU  48          3HD1      LEU  48  -1.766  -0.533  -0.004
  543   1HD2  LEU  48          1HD2      LEU  48   0.755  -2.315  -1.117
  544   2HD2  LEU  48          2HD2      LEU  48   1.345  -0.841  -1.907
  545   3HD2  LEU  48          3HD2      LEU  48   0.641  -0.746  -0.283
  546    QB   LEU  48           QB       LEU  48  -0.850  -1.645  -3.717
  547    QD1  LEU  48           QD1      LEU  48  -2.092  -1.370  -0.480
  548    QD2  LEU  48           QD2      LEU  48   0.914  -1.301  -1.102
  549    QQD  LEU  48           QQD      LEU  48  -0.589  -1.335  -0.791
  550    H    ALA  49           HN       ALA  49  -3.284  -3.119  -4.469
  551    HA   ALA  49           HA       ALA  49  -5.390  -2.809  -2.655
  552   1HB   ALA  49          2HB       ALA  49  -5.407  -3.972  -5.468
  553   2HB   ALA  49          3HB       ALA  49  -6.836  -3.409  -4.597
  554   3HB   ALA  49          1HB       ALA  49  -5.560  -2.263  -5.012
  555    QB   ALA  49           QB       ALA  49  -5.934  -3.215  -5.026
  556    H    SER  50           HN       SER  50  -4.172  -5.862  -4.145
  557    HA   SER  50           HA       SER  50  -6.055  -7.551  -2.789
  558   1HB   SER  50          2HB       SER  50  -4.638  -9.373  -3.572
  559   2HB   SER  50          3HB       SER  50  -4.922  -8.194  -4.873
  560    HG   SER  50           HG       SER  50  -2.714  -8.781  -4.739
  561    QB   SER  50           QB       SER  50  -4.780  -8.783  -4.222
  562    H    ALA  51           HN       ALA  51  -2.615  -6.691  -2.130
  563    HA   ALA  51           HA       ALA  51  -2.167  -8.225   0.112
  564   1HB   ALA  51          1HB       ALA  51  -0.429  -6.848  -0.915
  565   2HB   ALA  51          2HB       ALA  51  -1.206  -5.366  -0.310
  566   3HB   ALA  51          3HB       ALA  51  -0.523  -6.545   0.824
  567    QB   ALA  51           QB       ALA  51  -0.719  -6.253  -0.134
  568    H    LEU  52           HN       LEU  52  -3.722  -4.967   0.104
  569    HA   LEU  52           HA       LEU  52  -4.419  -5.323   2.951
  570   1HB   LEU  52          2HB       LEU  52  -4.639  -3.077   0.965
  571   2HB   LEU  52          3HB       LEU  52  -5.954  -3.210   2.120
  572    HG   LEU  52           HG       LEU  52  -4.602  -1.721   3.117
  573   1HD1  LEU  52          3HD1      LEU  52  -5.146  -3.785   4.621
  574   2HD1  LEU  52          1HD1      LEU  52  -3.418  -4.189   4.451
  575   3HD1  LEU  52          2HD1      LEU  52  -3.880  -2.670   5.175
  576   1HD2  LEU  52          1HD2      LEU  52  -2.207  -3.375   2.455
  577   2HD2  LEU  52          2HD2      LEU  52  -2.642  -1.763   1.819
  578   3HD2  LEU  52          3HD2      LEU  52  -2.176  -1.940   3.519
  579    QB   LEU  52           QB       LEU  52  -5.297  -3.143   1.542
  580    QD1  LEU  52           QD1      LEU  52  -4.148  -3.548   4.749
  581    QD2  LEU  52           QD2      LEU  52  -2.342  -2.359   2.598
  582    QQD  LEU  52           QQD      LEU  52  -3.245  -2.954   3.673
  583    H    GLY  53           HN       GLY  53  -6.020  -5.826  -0.139
  584   1HA   GLY  53          1HA       GLY  53  -7.950  -7.007  -0.541
  585   2HA   GLY  53          2HA       GLY  53  -8.283  -7.150   1.193
  586    QA   GLY  53           QA       GLY  53  -8.117  -7.078   0.326
  587    H    VAL  54           HN       VAL  54  -7.721  -4.430  -1.071
  588    HA   VAL  54           HA       VAL  54 -10.460  -3.378  -0.630
  589    HB   VAL  54           HB       VAL  54  -9.514  -1.045  -0.703
  590   1HG1  VAL  54          3HG1      VAL  54 -10.335  -2.053   1.395
  591   2HG1  VAL  54          1HG1      VAL  54  -8.697  -2.638   1.757
  592   3HG1  VAL  54          2HG1      VAL  54  -9.022  -0.894   1.662
  593   1HG2  VAL  54          3HG2      VAL  54  -7.228  -1.671  -1.547
  594   2HG2  VAL  54          1HG2      VAL  54  -7.195  -0.627  -0.120
  595   3HG2  VAL  54          2HG2      VAL  54  -6.866  -2.355   0.050
  596    QG1  VAL  54           QG1      VAL  54  -9.351  -1.862   1.605
  597    QG2  VAL  54           QG2      VAL  54  -7.096  -1.551  -0.539
  598    QQG  VAL  54           QQG      VAL  54  -8.224  -1.706   0.533
  599    H    SER  55           HN       SER  55 -10.777  -1.563  -2.480
  600    HA   SER  55           HA       SER  55 -10.051  -2.894  -4.989
  601   1HB   SER  55          2HB       SER  55 -11.699  -1.087  -5.816
  602   2HB   SER  55          3HB       SER  55 -12.332  -2.366  -4.759
  603    HG   SER  55           HG       SER  55 -12.987  -0.265  -4.073
  604    QB   SER  55           QB       SER  55 -12.015  -1.726  -5.288
  605    H    VAL  56           HN       VAL  56  -8.875  -1.907  -6.626
  606    HA   VAL  56           HA       VAL  56  -6.825  -0.025  -6.109
  607    HB   VAL  56           HB       VAL  56  -8.302  -0.611  -8.720
  608   1HG1  VAL  56          3HG1      VAL  56  -5.548   0.550  -8.189
  609   2HG1  VAL  56          1HG1      VAL  56  -6.197   0.128  -9.789
  610   3HG1  VAL  56          2HG1      VAL  56  -6.930   1.438  -8.857
  611   1HG2  VAL  56          2HG2      VAL  56  -6.606  -2.337  -7.130
  612   2HG2  VAL  56          3HG2      VAL  56  -7.337  -2.640  -8.711
  613   3HG2  VAL  56          1HG2      VAL  56  -5.733  -1.901  -8.596
  614    QG1  VAL  56           QG1      VAL  56  -6.225   0.705  -8.945
  615    QG2  VAL  56           QG2      VAL  56  -6.559  -2.293  -8.146
  616    QQG  VAL  56           QQG      VAL  56  -6.392  -0.794  -8.545
  617    H    ASP  57           HN       ASP  57 -10.150   0.458  -7.343
  618    HA   ASP  57           HA       ASP  57 -10.120   3.187  -7.803
  619   1HB   ASP  57          2HB       ASP  57 -12.120   1.146  -7.535
  620   2HB   ASP  57          3HB       ASP  57 -12.582   2.413  -6.397
  621    QB   ASP  57           QB       ASP  57 -12.351   1.779  -6.966
  622    CH2  TRP  58           CH2      TRP  58  -8.365   2.648   2.707
  623    H    TRP  58           HN       TRP  58 -10.336   1.471  -4.701
  624    HA   TRP  58           HA       TRP  58 -10.814   3.929  -3.190
  625   1HB   TRP  58          2HB       TRP  58 -11.739   1.758  -2.469
  626   2HB   TRP  58          3HB       TRP  58 -10.102   1.171  -2.168
  627    HD1  TRP  58           HD1      TRP  58 -12.653   3.755  -0.894
  628    HE1  TRP  58           HE1      TRP  58 -12.170   4.329   1.492
  629    HE3  TRP  58           HE3      TRP  58  -8.075   1.495  -0.494
  630    HZ2  TRP  58           HZ2      TRP  58 -10.005   3.848   3.445
  631    HZ3  TRP  58           HZ3      TRP  58  -6.814   1.595   1.647
  632    HH2  TRP  58           HH2      TRP  58  -7.821   2.654   3.640
  633    QB   TRP  58           QB       TRP  58 -10.921   1.464  -2.319
  634    H    LEU  59           HN       LEU  59  -8.035   1.761  -3.980
  635    HA   LEU  59           HA       LEU  59  -6.169   3.248  -2.398
  636   1HB   LEU  59          2HB       LEU  59  -6.008   1.465  -4.791
  637   2HB   LEU  59          3HB       LEU  59  -4.621   2.474  -4.530
  638    HG   LEU  59           HG       LEU  59  -5.804   0.445  -2.587
  639   1HD1  LEU  59          1HD1      LEU  59  -4.407  -0.272  -4.632
  640   2HD1  LEU  59          2HD1      LEU  59  -3.043   0.557  -3.857
  641   3HD1  LEU  59          3HD1      LEU  59  -3.846  -0.806  -3.047
  642   1HD2  LEU  59          3HD2      LEU  59  -3.581   2.491  -2.177
  643   2HD2  LEU  59          1HD2      LEU  59  -4.920   2.086  -1.077
  644   3HD2  LEU  59          2HD2      LEU  59  -3.600   0.952  -1.299
  645    QB   LEU  59           QB       LEU  59  -5.315   1.970  -4.660
  646    QD1  LEU  59           QD1      LEU  59  -3.765  -0.174  -3.845
  647    QD2  LEU  59           QD2      LEU  59  -4.034   1.843  -1.518
  648    QQD  LEU  59           QQD      LEU  59  -3.900   0.835  -2.681
  649    H    LEU  60           HN       LEU  60  -7.426   3.916  -5.658
  650    HA   LEU  60           HA       LEU  60  -5.771   6.267  -6.012
  651   1HB   LEU  60          2HB       LEU  60  -8.278   5.294  -7.421
  652   2HB   LEU  60          3HB       LEU  60  -7.336   6.699  -7.937
  653    HG   LEU  60           HG       LEU  60  -6.218   3.856  -7.735
  654   1HD1  LEU  60          1HD1      LEU  60  -7.131   5.466 -10.153
  655   2HD1  LEU  60          2HD1      LEU  60  -6.337   3.875 -10.196
  656   3HD1  LEU  60          3HD1      LEU  60  -7.946   4.041  -9.471
  657   1HD2  LEU  60          2HD2      LEU  60  -5.050   6.464  -8.795
  658   2HD2  LEU  60          3HD2      LEU  60  -4.389   5.416  -7.519
  659   3HD2  LEU  60          1HD2      LEU  60  -4.396   4.862  -9.192
  660    QB   LEU  60           QB       LEU  60  -7.807   5.997  -7.679
  661    QD1  LEU  60           QD1      LEU  60  -7.138   4.461  -9.940
  662    QD2  LEU  60           QD2      LEU  60  -4.612   5.581  -8.502
  663    QQD  LEU  60           QQD      LEU  60  -5.875   5.021  -9.221
  664    H    ASN  61           HN       ASN  61  -9.308   5.981  -5.360
  665    HA   ASN  61           HA       ASN  61  -9.470   8.843  -4.692
  666   1HB   ASN  61          2HB       ASN  61 -11.510   6.570  -4.595
  667   2HB   ASN  61          3HB       ASN  61 -11.830   8.219  -4.050
  668   1HD2  ASN  61          2HD2      ASN  61 -12.026   7.451  -8.001
  669   2HD2  ASN  61          1HD2      ASN  61 -11.730   6.153  -6.882
  670    QB   ASN  61           QB       ASN  61 -11.670   7.395  -4.323
  671    QD2  ASN  61           QD2      ASN  61 -11.878   6.802  -7.441
  672    H    GLY  62           HN       GLY  62 -10.131   5.812  -2.873
  673   1HA   GLY  62          1HA       GLY  62  -9.817   5.322  -0.645
  674   2HA   GLY  62          2HA       GLY  62  -8.721   6.681  -0.628
  675    QA   GLY  62           QA       GLY  62  -9.269   6.002  -0.636
  676    H    THR  63           HN       THR  63 -12.156   5.868  -0.754
  677    HA   THR  63           HA       THR  63 -12.794   7.693   1.472
  678    HB   THR  63           HB       THR  63 -14.807   8.353   0.170
  679    HG1  THR  63          1HG       THR  63 -13.263   7.383  -2.017
  680   1HG2  THR  63          1HG2      THR  63 -12.731   9.809   0.439
  681   2HG2  THR  63          2HG2      THR  63 -12.155   9.200  -1.126
  682   3HG2  THR  63          3HG2      THR  63 -13.649  10.147  -1.048
  683    QG2  THR  63           QG2      THR  63 -12.845   9.719  -0.578
  684    H    SER  64           HN       SER  64 -13.591   6.389   2.956
  685    HA   SER  64           HA       SER  64 -15.725   4.440   2.323
  686   1HB   SER  64          2HB       SER  64 -13.195   3.786   3.911
  687   2HB   SER  64          3HB       SER  64 -14.685   2.832   3.945
  688    HG   SER  64           HG       SER  64 -13.264   2.001   2.393
  689    QB   SER  64           QB       SER  64 -13.940   3.309   3.928
  690    H    ASP  65           HN       ASP  65 -16.955   6.229   3.204
  691    HA   ASP  65           HA       ASP  65 -18.078   7.338   4.795
  692   1HB   ASP  65          2HB       ASP  65 -18.527   5.144   5.728
  693   2HB   ASP  65          3HB       ASP  65 -17.007   5.173   6.651
  694    QB   ASP  65           QB       ASP  65 -17.767   5.158   6.190
  695    H    SER  66           HN       SER  66 -17.822   8.546   6.963
  696    HA   SER  66           HA       SER  66 -15.067   9.340   7.715
  697   1HB   SER  66          2HB       SER  66 -16.888  11.394   6.388
  698   2HB   SER  66          3HB       SER  66 -15.379  11.753   7.210
  699    HG   SER  66           HG       SER  66 -14.982   9.799   5.395
  700    QB   SER  66           QB       SER  66 -16.134  11.574   6.799
  701    H    ASN  67           HN       ASN  67 -15.292   9.279   9.890
  702    HA   ASN  67           HA       ASN  67 -17.803  10.335  11.154
  703   1HB   ASN  67          2HB       ASN  67 -17.592   7.860  11.245
  704   2HB   ASN  67          3HB       ASN  67 -16.046   8.035  12.085
  705   1HD2  ASN  67          2HD2      ASN  67 -19.577   9.029  14.020
  706   2HD2  ASN  67          1HD2      ASN  67 -19.517   9.022  12.264
  707    QB   ASN  67           QB       ASN  67 -16.819   7.948  11.665
  708    QD2  ASN  67           QD2      ASN  67 -19.547   9.026  13.142
  709    H    VAL  68           HN       VAL  68 -16.757  12.391  11.166
  710    HA   VAL  68           HA       VAL  68 -15.775  14.105  12.199
  711    HB   VAL  68           HB       VAL  68 -14.969  12.176  14.422
  712   1HG1  VAL  68          1HG1      VAL  68 -14.855  15.206  14.290
  713   2HG1  VAL  68          2HG1      VAL  68 -14.786  14.261  15.789
  714   3HG1  VAL  68          3HG1      VAL  68 -13.520  14.065  14.587
  715   1HG2  VAL  68          2HG2      VAL  68 -17.294  14.136  14.164
  716   2HG2  VAL  68          3HG2      VAL  68 -17.422  12.364  14.158
  717   3HG2  VAL  68          1HG2      VAL  68 -16.882  13.202  15.613
  718    QG1  VAL  68           QG1      VAL  68 -14.387  14.511  14.889
  719    QG2  VAL  68           QG2      VAL  68 -17.199  13.234  14.645
  720    QQG  VAL  68           QQG      VAL  68 -15.793  13.872  14.767
  721    NH1  ARG  69           NH2      ARG  69 -10.229  17.113  15.361
  722    NH2  ARG  69           NH1      ARG  69  -9.479  18.666  13.814
  723    H    ARG  69           HN       ARG  69 -13.815  15.184  12.200
  724    HA   ARG  69           HA       ARG  69 -11.806  15.734  11.365
  725   1HB   ARG  69          2HB       ARG  69 -10.972  12.858  11.905
  726   2HB   ARG  69          3HB       ARG  69  -9.912  14.172  11.433
  727   1HG   ARG  69          2HG       ARG  69 -11.458  14.993  13.768
  728   2HG   ARG  69          3HG       ARG  69 -10.740  13.404  14.049
  729   1HD   ARG  69          2HD       ARG  69  -9.030  14.826  14.791
  730   2HD   ARG  69          3HD       ARG  69  -8.524  14.435  13.169
  731    HE   ARG  69           HE       ARG  69  -8.897  16.604  12.461
  732   1HH1  ARG  69          2HH2      ARG  69 -10.403  16.148  15.599
  733   2HH1  ARG  69          1HH2      ARG  69 -10.519  17.833  16.005
  734   1HH2  ARG  69          2HH1      ARG  69  -9.050  18.889  12.928
  735   2HH2  ARG  69          1HH1      ARG  69  -9.763  19.428  14.413
  736    QB   ARG  69           QB       ARG  69 -10.442  13.515  11.669
  737    QG   ARG  69           QG       ARG  69 -11.099  14.198  13.908
  738    QD   ARG  69           QD       ARG  69  -8.777  14.630  13.980
  739    QH1  ARG  69           QH2      ARG  69 -10.461  16.991  15.802
  740    QH2  ARG  69           QH1      ARG  69  -9.407  19.159  13.670
   
  Start of MODEL           2
 Raw file had 740 H/Q atoms
  Start of MODEL    2
    1    H    SER   1           HN       SER   1  -5.178   9.874   4.143
    2    HA   SER   1           HA       SER   1  -3.747  11.497   2.147
    3   1HB   SER   1          2HB       SER   1  -2.297  10.453   4.608
    4   2HB   SER   1          3HB       SER   1  -1.749  11.686   3.438
    5    HG   SER   1           HG       SER   1  -2.998  13.106   4.502
    6    QB   SER   1           QB       SER   1  -2.023  11.069   4.023
    7    H    ILE   2           HN       ILE   2  -2.283  10.030   0.883
    8    HA   ILE   2           HA       ILE   2  -3.214   7.437   0.489
    9    HB   ILE   2           HB       ILE   2  -2.014   8.648  -1.160
   10   1HG1  ILE   2          2HG1      ILE   2  -0.277   6.228  -0.601
   11   2HG1  ILE   2          3HG1      ILE   2  -1.994   6.029  -0.972
   12   1HG2  ILE   2          2HG2      ILE   2  -0.248   9.687   0.426
   13   2HG2  ILE   2          3HG2      ILE   2   0.643   8.163   0.252
   14   3HG2  ILE   2          1HG2      ILE   2   0.308   9.163  -1.160
   15   1HD1  ILE   2          3HD1      ILE   2  -0.276   7.708  -2.816
   16   2HD1  ILE   2          1HD1      ILE   2  -0.287   5.943  -2.930
   17   3HD1  ILE   2          2HD1      ILE   2  -1.794   6.852  -3.141
   18    QG1  ILE   2           QG1      ILE   2  -1.135   6.128  -0.787
   19    QG2  ILE   2           QG2      ILE   2   0.234   9.004  -0.161
   20    QD1  ILE   2           QD1      ILE   2  -0.786   6.834  -2.962
   21    H    SER   3           HN       SER   3  -0.184   8.360   2.225
   22    HA   SER   3           HA       SER   3   0.470   5.775   3.074
   23   1HB   SER   3          2HB       SER   3   1.934   6.851   4.645
   24   2HB   SER   3          3HB       SER   3   1.927   7.790   3.158
   25    HG   SER   3           HG       SER   3   1.700   8.959   5.218
   26    QB   SER   3           QB       SER   3   1.931   7.321   3.902
   27    H    SER   4           HN       SER   4  -1.577   8.247   4.595
   28    HA   SER   4           HA       SER   4  -2.132   6.870   7.003
   29   1HB   SER   4          2HB       SER   4  -2.884   9.095   6.953
   30   2HB   SER   4          3HB       SER   4  -3.771   8.862   5.444
   31    HG   SER   4           HG       SER   4  -4.529   7.417   7.710
   32    QB   SER   4           QB       SER   4  -3.328   8.979   6.199
   33    NH1  ARG   5           NH2      ARG   5  -5.818   8.747  -0.104
   34    NH2  ARG   5           NH1      ARG   5  -5.393   7.608  -2.066
   35    H    ARG   5           HN       ARG   5  -3.618   6.416   3.735
   36    HA   ARG   5           HA       ARG   5  -5.657   4.646   4.778
   37   1HB   ARG   5          2HB       ARG   5  -4.703   4.324   1.934
   38   2HB   ARG   5          3HB       ARG   5  -6.288   4.241   2.672
   39   1HG   ARG   5          2HG       ARG   5  -6.021   6.761   3.173
   40   2HG   ARG   5          3HG       ARG   5  -4.728   6.670   1.942
   41   1HD   ARG   5          2HD       ARG   5  -7.351   5.478   1.229
   42   2HD   ARG   5          3HD       ARG   5  -7.319   7.207   1.415
   43    HE   ARG   5           HE       ARG   5  -6.075   5.596  -0.712
   44   1HH1  ARG   5          2HH2      ARG   5  -6.096   8.717   0.862
   45   2HH1  ARG   5          1HH2      ARG   5  -5.680   9.629  -0.574
   46   1HH2  ARG   5          2HH1      ARG   5  -5.304   6.731  -2.578
   47   2HH2  ARG   5          1HH1      ARG   5  -5.326   8.460  -2.608
   48    QB   ARG   5           QB       ARG   5  -5.495   4.282   2.303
   49    QG   ARG   5           QG       ARG   5  -5.374   6.715   2.557
   50    QD   ARG   5           QD       ARG   5  -7.335   6.343   1.321
   51    QH1  ARG   5           QH2      ARG   5  -5.889   9.173   0.144
   52    QH2  ARG   5           QH1      ARG   5  -5.314   7.595  -2.593
   53    H    VAL   6           HN       VAL   6  -2.596   4.097   3.051
   54    HA   VAL   6           HA       VAL   6  -2.624   1.274   3.166
   55    HB   VAL   6           HB       VAL   6  -0.268   3.219   3.031
   56   1HG1  VAL   6          2HG1      VAL   6  -0.461   0.239   2.422
   57   2HG1  VAL   6          3HG1      VAL   6   0.926   1.287   2.009
   58   3HG1  VAL   6          1HG1      VAL   6   0.453   1.056   3.701
   59   1HG2  VAL   6          1HG2      VAL   6  -2.084   1.967   0.938
   60   2HG2  VAL   6          2HG2      VAL   6  -1.608   3.667   1.122
   61   3HG2  VAL   6          3HG2      VAL   6  -0.436   2.489   0.544
   62    QG1  VAL   6           QG1      VAL   6   0.306   0.861   2.710
   63    QG2  VAL   6           QG2      VAL   6  -1.376   2.708   0.868
   64    QQG  VAL   6           QQG      VAL   6  -0.535   1.785   1.789
   65    H    LYS   7           HN       LYS   7  -0.968   3.569   5.344
   66    HA   LYS   7           HA       LYS   7   0.021   1.667   7.160
   67   1HB   LYS   7          2HB       LYS   7   0.817   4.043   6.856
   68   2HB   LYS   7          3HB       LYS   7  -0.593   4.576   7.771
   69   1HG   LYS   7          2HG       LYS   7   0.641   2.451   9.270
   70   2HG   LYS   7          3HG       LYS   7   1.962   3.449   8.690
   71   1HD   LYS   7          2HD       LYS   7  -0.457   4.741  10.005
   72   2HD   LYS   7          3HD       LYS   7   0.757   3.935  11.002
   73   1HE   LYS   7          2HE       LYS   7   2.526   5.334  10.327
   74   2HE   LYS   7          3HE       LYS   7   1.611   6.026   8.979
   75   1HZ   LYS   7          3HZ       LYS   7   0.936   6.408  11.828
   76   2HZ   LYS   7          1HZ       LYS   7   1.762   7.486  10.903
   77   3HZ   LYS   7          2HZ       LYS   7   0.201   7.125  10.541
   78    QB   LYS   7           QB       LYS   7   0.112   4.309   7.314
   79    QG   LYS   7           QG       LYS   7   1.301   2.950   8.979
   80    QD   LYS   7           QD       LYS   7   0.150   4.337  10.504
   81    QE   LYS   7           QE       LYS   7   2.069   5.680   9.653
   82    QZ   LYS   7           QZ       LYS   7   0.967   7.006  11.091
   83    H    SER   8           HN       SER   8  -2.967   3.732   7.351
   84    HA   SER   8           HA       SER   8  -3.953   2.874   9.842
   85   1HB   SER   8          2HB       SER   8  -5.097   4.612   8.559
   86   2HB   SER   8          3HB       SER   8  -5.509   3.437   7.276
   87    HG   SER   8           HG       SER   8  -7.233   3.787   8.722
   88    QB   SER   8           QB       SER   8  -5.303   4.025   7.918
   89    H    LYS   9           HN       LYS   9  -4.333   1.320   6.564
   90    HA   LYS   9           HA       LYS   9  -5.860  -0.786   7.712
   91   1HB   LYS   9          2HB       LYS   9  -5.709   0.096   5.242
   92   2HB   LYS   9          3HB       LYS   9  -4.297  -0.948   5.147
   93   1HG   LYS   9          2HG       LYS   9  -6.277  -2.175   4.360
   94   2HG   LYS   9          3HG       LYS   9  -5.838  -2.861   5.947
   95   1HD   LYS   9          2HD       LYS   9  -7.634  -1.778   7.030
   96   2HD   LYS   9          3HD       LYS   9  -7.901  -0.657   5.677
   97   1HE   LYS   9          2HE       LYS   9  -8.875  -2.308   4.316
   98   2HE   LYS   9          3HE       LYS   9  -8.165  -3.652   5.227
   99   1HZ   LYS   9          2HZ       LYS   9 -10.168  -1.869   6.419
  100   2HZ   LYS   9          3HZ       LYS   9 -10.569  -3.240   5.600
  101   3HZ   LYS   9          1HZ       LYS   9  -9.649  -3.335   6.959
  102    QB   LYS   9           QB       LYS   9  -5.003  -0.427   5.194
  103    QG   LYS   9           QG       LYS   9  -6.057  -2.517   5.154
  104    QD   LYS   9           QD       LYS   9  -7.767  -1.217   6.354
  105    QE   LYS   9           QE       LYS   9  -8.519  -2.980   4.772
  106    QZ   LYS   9           QZ       LYS   9 -10.129  -2.814   6.326
  107    NH1  ARG  10           NH2      ARG  10   2.124  -0.849   3.889
  108    NH2  ARG  10           NH1      ARG  10   2.781   1.166   4.756
  109    H    ARG  10           HN       ARG  10  -2.398  -0.428   6.908
  110    HA   ARG  10           HA       ARG  10  -1.405  -2.932   7.529
  111   1HB   ARG  10          2HB       ARG  10  -0.234  -0.684   6.827
  112   2HB   ARG  10          3HB       ARG  10  -0.026  -0.420   8.555
  113   1HG   ARG  10          2HG       ARG  10   1.779  -1.746   8.594
  114   2HG   ARG  10          3HG       ARG  10   0.818  -3.099   7.970
  115   1HD   ARG  10          2HD       ARG  10   2.563  -2.748   6.378
  116   2HD   ARG  10          3HD       ARG  10   1.026  -2.216   5.722
  117    HE   ARG  10           HE       ARG  10   2.837  -0.170   6.944
  118   1HH1  ARG  10          2HH2      ARG  10   1.896  -1.822   4.011
  119   2HH1  ARG  10          1HH2      ARG  10   2.139  -0.467   2.956
  120   1HH2  ARG  10          2HH1      ARG  10   3.083   1.818   5.491
  121   2HH2  ARG  10          1HH1      ARG  10   2.832   1.569   3.835
  122    QB   ARG  10           QB       ARG  10  -0.131  -0.552   7.691
  123    QG   ARG  10           QG       ARG  10   1.298  -2.422   8.282
  124    QD   ARG  10           QD       ARG  10   1.795  -2.482   6.050
  125    QH1  ARG  10           QH2      ARG  10   2.018  -1.144   3.484
  126    QH2  ARG  10           QH1      ARG  10   2.957   1.693   4.663
  127    H    ILE  11           HN       ILE  11  -2.184  -0.271   9.785
  128    HA   ILE  11           HA       ILE  11  -1.496  -1.647  12.202
  129    HB   ILE  11           HB       ILE  11  -3.074   0.839  11.505
  130   1HG1  ILE  11          2HG1      ILE  11  -1.564   1.630  13.447
  131   2HG1  ILE  11          3HG1      ILE  11  -0.693   0.107  13.259
  132   1HG2  ILE  11          3HG2      ILE  11  -3.275  -0.533  14.209
  133   2HG2  ILE  11          1HG2      ILE  11  -3.659   1.175  13.912
  134   3HG2  ILE  11          2HG2      ILE  11  -4.613  -0.063  13.127
  135   1HD1  ILE  11          2HD1      ILE  11  -0.303   0.757  10.839
  136   2HD1  ILE  11          3HD1      ILE  11  -1.105   2.310  11.198
  137   3HD1  ILE  11          1HD1      ILE  11   0.412   1.869  12.011
  138    QG1  ILE  11           QG1      ILE  11  -1.128   0.869  13.352
  139    QG2  ILE  11           QG2      ILE  11  -3.849   0.194  13.749
  140    QD1  ILE  11           QD1      ILE  11  -0.332   1.646  11.349
  141    H    GLN  12           HN       GLN  12  -4.716  -1.072  10.718
  142    HA   GLN  12           HA       GLN  12  -6.063  -2.633  12.584
  143   1HB   GLN  12          2HB       GLN  12  -6.795  -1.131  10.402
  144   2HB   GLN  12          3HB       GLN  12  -7.193  -2.737   9.810
  145   1HG   GLN  12          2HG       GLN  12  -9.055  -2.812  11.084
  146   2HG   GLN  12          3HG       GLN  12  -8.182  -2.404  12.556
  147   1HE2  GLN  12          2HE2      GLN  12  -9.737   0.750  12.670
  148   2HE2  GLN  12          1HE2      GLN  12  -9.169  -0.662  13.537
  149    QB   GLN  12           QB       GLN  12  -6.994  -1.934  10.106
  150    QG   GLN  12           QG       GLN  12  -8.619  -2.608  11.820
  151    QE2  GLN  12           QE2      GLN  12  -9.452   0.044  13.104
  152    H    LEU  13           HN       LEU  13  -4.378  -3.704   9.711
  153    HA   LEU  13           HA       LEU  13  -5.073  -6.540   9.899
  154   1HB   LEU  13          2HB       LEU  13  -3.209  -4.767   8.327
  155   2HB   LEU  13          3HB       LEU  13  -2.774  -6.430   8.438
  156    HG   LEU  13           HG       LEU  13  -4.225  -5.492   6.474
  157   1HD1  LEU  13          1HD1      LEU  13  -3.649  -8.064   7.378
  158   2HD1  LEU  13          2HD1      LEU  13  -5.400  -8.091   7.154
  159   3HD1  LEU  13          3HD1      LEU  13  -4.340  -7.607   5.818
  160   1HD2  LEU  13          2HD2      LEU  13  -6.110  -4.671   7.925
  161   2HD2  LEU  13          3HD2      LEU  13  -6.592  -5.771   6.620
  162   3HD2  LEU  13          1HD2      LEU  13  -6.513  -6.366   8.278
  163    QB   LEU  13           QB       LEU  13  -2.992  -5.599   8.382
  164    QD1  LEU  13           QD1      LEU  13  -4.464  -7.921   6.783
  165    QD2  LEU  13           QD2      LEU  13  -6.405  -5.603   7.607
  166    QQD  LEU  13           QQD      LEU  13  -5.434  -6.761   7.195
  167    H    GLY  14           HN       GLY  14  -2.525  -4.466  11.209
  168   1HA   GLY  14          1HA       GLY  14  -1.147  -4.859  13.011
  169   2HA   GLY  14          2HA       GLY  14  -1.785  -6.505  13.174
  170    QA   GLY  14           QA       GLY  14  -1.465  -5.682  13.093
  171    H    LEU  15           HN       LEU  15  -0.407  -4.936  10.287
  172    HA   LEU  15           HA       LEU  15   1.888  -6.882  10.314
  173   1HB   LEU  15          2HB       LEU  15   0.360  -5.813   7.908
  174   2HB   LEU  15          3HB       LEU  15   1.767  -6.877   7.860
  175    HG   LEU  15           HG       LEU  15  -0.972  -7.571   9.019
  176   1HD1  LEU  15          1HD1      LEU  15  -0.821  -7.489   6.556
  177   2HD1  LEU  15          2HD1      LEU  15   0.536  -8.660   6.638
  178   3HD1  LEU  15          3HD1      LEU  15  -1.098  -9.136   7.159
  179   1HD2  LEU  15          3HD2      LEU  15   1.683  -9.010   9.161
  180   2HD2  LEU  15          1HD2      LEU  15   0.367  -8.923  10.353
  181   3HD2  LEU  15          2HD2      LEU  15   0.208  -9.961   8.937
  182    QB   LEU  15           QB       LEU  15   1.063  -6.345   7.884
  183    QD1  LEU  15           QD1      LEU  15  -0.461  -8.428   6.785
  184    QD2  LEU  15           QD2      LEU  15   0.752  -9.298   9.483
  185    QQD  LEU  15           QQD      LEU  15   0.146  -8.863   8.134
  186    H    ASN  16           HN       ASN  16   3.688  -5.974   8.841
  187    HA   ASN  16           HA       ASN  16   4.041  -3.049   9.341
  188   1HB   ASN  16          2HB       ASN  16   6.460  -3.512   9.446
  189   2HB   ASN  16          3HB       ASN  16   5.568  -4.305  10.751
  190   1HD2  ASN  16          2HD2      ASN  16   7.942  -6.849   9.465
  191   2HD2  ASN  16          1HD2      ASN  16   8.092  -5.315  10.301
  192    QB   ASN  16           QB       ASN  16   6.014  -3.909  10.099
  193    QD2  ASN  16           QD2      ASN  16   8.017  -6.082   9.883
  194    H    GLN  17           HN       GLN  17   5.536  -2.067   7.774
  195    HA   GLN  17           HA       GLN  17   4.698  -2.356   5.102
  196   1HB   GLN  17          2HB       GLN  17   7.002  -1.017   6.498
  197   2HB   GLN  17          3HB       GLN  17   7.114  -1.304   4.743
  198   1HG   GLN  17          2HG       GLN  17   4.964  -0.132   4.490
  199   2HG   GLN  17          3HG       GLN  17   5.077   0.376   6.199
  200   1HE2  GLN  17          2HE2      GLN  17   6.982   3.177   5.067
  201   2HE2  GLN  17          1HE2      GLN  17   5.425   2.703   5.744
  202    QB   GLN  17           QB       GLN  17   7.058  -1.161   5.621
  203    QG   GLN  17           QG       GLN  17   5.020   0.122   5.345
  204    QE2  GLN  17           QE2      GLN  17   6.203   2.939   5.405
  205    H    ALA  18           HN       ALA  18   7.291  -4.105   6.821
  206    HA   ALA  18           HA       ALA  18   8.480  -5.226   4.491
  207   1HB   ALA  18          3HB       ALA  18   9.481  -5.116   6.811
  208   2HB   ALA  18          1HB       ALA  18   8.446  -6.496   7.242
  209   3HB   ALA  18          2HB       ALA  18   9.656  -6.665   5.962
  210    QB   ALA  18           QB       ALA  18   9.195  -6.092   6.672
  211    H    GLU  19           HN       GLU  19   6.120  -6.742   6.810
  212    HA   GLU  19           HA       GLU  19   5.586  -9.108   5.402
  213   1HB   GLU  19          2HB       GLU  19   3.933  -7.375   7.231
  214   2HB   GLU  19          3HB       GLU  19   3.242  -8.795   6.474
  215   1HG   GLU  19          2HG       GLU  19   5.867  -8.982   7.997
  216   2HG   GLU  19          3HG       GLU  19   4.300  -9.159   8.798
  217    QB   GLU  19           QB       GLU  19   3.588  -8.085   6.853
  218    QG   GLU  19           QG       GLU  19   5.083  -9.071   8.397
  219    H    LEU  20           HN       LEU  20   4.188  -5.829   5.143
  220    HA   LEU  20           HA       LEU  20   2.343  -6.634   3.159
  221   1HB   LEU  20          2HB       LEU  20   2.464  -4.461   4.682
  222   2HB   LEU  20          3HB       LEU  20   3.212  -3.779   3.241
  223    HG   LEU  20           HG       LEU  20   0.899  -5.368   2.420
  224   1HD1  LEU  20          3HD1      LEU  20   0.275  -5.044   4.911
  225   2HD1  LEU  20          1HD1      LEU  20  -0.117  -3.384   4.404
  226   3HD1  LEU  20          2HD1      LEU  20  -0.898  -4.757   3.627
  227   1HD2  LEU  20          1HD2      LEU  20   1.790  -2.574   2.115
  228   2HD2  LEU  20          2HD2      LEU  20   1.183  -3.775   0.993
  229   3HD2  LEU  20          3HD2      LEU  20   0.052  -2.884   2.031
  230    QB   LEU  20           QB       LEU  20   2.838  -4.120   3.961
  231    QD1  LEU  20           QD1      LEU  20  -0.247  -4.395   4.313
  232    QD2  LEU  20           QD2      LEU  20   1.008  -3.078   1.713
  233    QQD  LEU  20           QQD      LEU  20   0.381  -3.737   3.013
  234    H    ALA  21           HN       ALA  21   5.664  -5.335   2.901
  235    HA   ALA  21           HA       ALA  21   5.730  -5.024   0.087
  236   1HB   ALA  21          1HB       ALA  21   7.429  -4.123   1.559
  237   2HB   ALA  21          2HB       ALA  21   7.989  -5.748   1.999
  238   3HB   ALA  21          3HB       ALA  21   8.147  -5.186   0.329
  239    QB   ALA  21           QB       ALA  21   7.855  -5.019   1.296
  240    H    GLN  22           HN       GLN  22   6.599  -7.850   2.148
  241    HA   GLN  22           HA       GLN  22   7.304  -9.490  -0.097
  242   1HB   GLN  22          2HB       GLN  22   7.172 -11.424   1.370
  243   2HB   GLN  22          3HB       GLN  22   8.079 -10.089   2.102
  244   1HG   GLN  22          2HG       GLN  22   6.187  -9.466   3.414
  245   2HG   GLN  22          3HG       GLN  22   5.162 -10.749   2.725
  246   1HE2  GLN  22          2HE2      GLN  22   5.930 -12.322   5.780
  247   2HE2  GLN  22          1HE2      GLN  22   4.707 -11.751   4.713
  248    QB   GLN  22           QB       GLN  22   7.626 -10.757   1.736
  249    QG   GLN  22           QG       GLN  22   5.675 -10.107   3.070
  250    QE2  GLN  22           QE2      GLN  22   5.318 -12.037   5.246
  251    H    LYS  23           HN       LYS  23   4.123  -9.078   1.624
  252    HA   LYS  23           HA       LYS  23   2.882 -11.039  -0.078
  253   1HB   LYS  23          2HB       LYS  23   0.986 -10.750   1.110
  254   2HB   LYS  23          3HB       LYS  23   2.192 -10.141   2.258
  255   1HG   LYS  23          2HG       LYS  23   1.656  -7.815   1.387
  256   2HG   LYS  23          3HG       LYS  23   0.394  -8.523   0.383
  257   1HD   LYS  23          2HD       LYS  23  -0.371  -7.411   2.480
  258   2HD   LYS  23          3HD       LYS  23  -0.991  -9.035   2.235
  259   1HE   LYS  23          2HE       LYS  23   1.519  -8.523   3.901
  260   2HE   LYS  23          3HE       LYS  23  -0.085  -8.214   4.557
  261   1HZ   LYS  23          1HZ       LYS  23   0.491 -10.797   3.340
  262   2HZ   LYS  23          2HZ       LYS  23   1.034 -10.498   4.863
  263   3HZ   LYS  23          3HZ       LYS  23  -0.580 -10.430   4.536
  264    QB   LYS  23           QB       LYS  23   1.588 -10.446   1.684
  265    QG   LYS  23           QG       LYS  23   1.025  -8.169   0.885
  266    QD   LYS  23           QD       LYS  23  -0.681  -8.223   2.358
  267    QE   LYS  23           QE       LYS  23   0.717  -8.369   4.229
  268    QZ   LYS  23           QZ       LYS  23   0.315 -10.575   4.247
  269    H    VAL  24           HN       VAL  24   3.445  -7.586  -0.412
  270    HA   VAL  24           HA       VAL  24   1.842  -7.208  -2.793
  271    HB   VAL  24           HB       VAL  24   4.145  -5.696  -1.514
  272   1HG1  VAL  24          1HG1      VAL  24   2.584  -5.015  -4.030
  273   2HG1  VAL  24          2HG1      VAL  24   3.572  -3.851  -3.127
  274   3HG1  VAL  24          3HG1      VAL  24   4.339  -5.240  -3.913
  275   1HG2  VAL  24          2HG2      VAL  24   1.662  -5.706  -0.586
  276   2HG2  VAL  24          3HG2      VAL  24   2.489  -4.151  -0.839
  277   3HG2  VAL  24          1HG2      VAL  24   1.335  -4.760  -2.035
  278    QG1  VAL  24           QG1      VAL  24   3.499  -4.702  -3.691
  279    QG2  VAL  24           QG2      VAL  24   1.829  -4.872  -1.153
  280    QQG  VAL  24           QQG      VAL  24   2.663  -4.787  -2.422
  281    H    GLY  25           HN       GLY  25   5.117  -8.466  -2.120
  282   1HA   GLY  25          1HA       GLY  25   6.349  -9.819  -3.584
  283   2HA   GLY  25          2HA       GLY  25   5.277  -9.399  -4.929
  284    QA   GLY  25           QA       GLY  25   5.813  -9.609  -4.256
  285    H    THR  26           HN       THR  26   6.895  -7.207  -2.628
  286    HA   THR  26           HA       THR  26   8.873  -6.373  -4.660
  287    HB   THR  26           HB       THR  26   6.917  -4.896  -5.003
  288    HG1  THR  26          1HG       THR  26   8.977  -4.076  -5.348
  289   1HG2  THR  26          2HG2      THR  26   6.300  -4.938  -2.413
  290   2HG2  THR  26          3HG2      THR  26   7.365  -3.531  -2.341
  291   3HG2  THR  26          1HG2      THR  26   5.972  -3.512  -3.416
  292    QG2  THR  26           QG2      THR  26   6.546  -3.994  -2.723
  293    H    THR  27           HN       THR  27   9.401  -4.072  -2.847
  294    HA   THR  27           HA       THR  27  10.657  -5.461  -0.515
  295    HB   THR  27           HB       THR  27  12.537  -3.659  -1.068
  296    HG1  THR  27          1HG       THR  27  11.218  -2.815  -2.853
  297   1HG2  THR  27          3HG2      THR  27  12.496  -6.346  -1.372
  298   2HG2  THR  27          1HG2      THR  27  12.531  -5.903  -3.086
  299   3HG2  THR  27          2HG2      THR  27  13.816  -5.348  -1.996
  300    QG2  THR  27           QG2      THR  27  12.948  -5.866  -2.151
  301    H    GLN  28           HN       GLN  28  10.788  -4.277   1.334
  302    HA   GLN  28           HA       GLN  28   8.801  -2.556   2.061
  303   1HB   GLN  28          2HB       GLN  28  10.606  -3.762   3.487
  304   2HB   GLN  28          3HB       GLN  28  11.577  -2.292   3.251
  305   1HG   GLN  28          2HG       GLN  28   9.547  -0.983   4.132
  306   2HG   GLN  28          3HG       GLN  28   8.816  -2.572   4.459
  307   1HE2  GLN  28          2HE2      GLN  28  10.304  -1.369   7.633
  308   2HE2  GLN  28          1HE2      GLN  28   9.076  -0.770   6.533
  309    QB   GLN  28           QB       GLN  28  11.092  -3.027   3.369
  310    QG   GLN  28           QG       GLN  28   9.182  -1.778   4.295
  311    QE2  GLN  28           QE2      GLN  28   9.690  -1.069   7.083
  312    H    GLN  29           HN       GLN  29  11.963  -1.607   0.715
  313    HA   GLN  29           HA       GLN  29  11.820   1.124   0.909
  314   1HB   GLN  29          2HB       GLN  29  13.314   1.240  -0.901
  315   2HB   GLN  29          3HB       GLN  29  13.661  -0.278  -0.068
  316   1HG   GLN  29          2HG       GLN  29  12.407  -1.469  -1.841
  317   2HG   GLN  29          3HG       GLN  29  12.182   0.056  -2.724
  318   1HE2  GLN  29          2HE2      GLN  29  15.418   0.257  -4.017
  319   2HE2  GLN  29          1HE2      GLN  29  13.924   1.130  -3.699
  320    QB   GLN  29           QB       GLN  29  13.488   0.481  -0.485
  321    QG   GLN  29           QG       GLN  29  12.295  -0.707  -2.282
  322    QE2  GLN  29           QE2      GLN  29  14.671   0.693  -3.858
  323    H    SER  30           HN       SER  30  10.302  -0.853  -1.674
  324    HA   SER  30           HA       SER  30   9.322   1.377  -3.172
  325   1HB   SER  30          2HB       SER  30   8.400  -1.525  -3.058
  326   2HB   SER  30          3HB       SER  30   7.914  -0.354  -4.295
  327    HG   SER  30           HG       SER  30   9.918  -1.798  -4.576
  328    QB   SER  30           QB       SER  30   8.157  -0.939  -3.676
  329    H    ILE  31           HN       ILE  31   7.937  -0.567  -0.548
  330    HA   ILE  31           HA       ILE  31   5.340   0.682  -0.597
  331    HB   ILE  31           HB       ILE  31   6.741  -0.618   1.764
  332   1HG1  ILE  31          2HG1      ILE  31   6.736  -2.231  -0.089
  333   2HG1  ILE  31          3HG1      ILE  31   5.623  -2.683   1.196
  334   1HG2  ILE  31          3HG2      ILE  31   3.812  -0.060   1.127
  335   2HG2  ILE  31          1HG2      ILE  31   4.399  -1.073   2.468
  336   3HG2  ILE  31          2HG2      ILE  31   4.789   0.664   2.406
  337   1HD1  ILE  31          1HD1      ILE  31   4.785  -1.383  -1.432
  338   2HD1  ILE  31          2HD1      ILE  31   4.681  -3.101  -1.032
  339   3HD1  ILE  31          3HD1      ILE  31   3.697  -1.942  -0.136
  340    QG1  ILE  31           QG1      ILE  31   6.178  -2.457   0.554
  341    QG2  ILE  31           QG2      ILE  31   4.333  -0.157   2.000
  342    QD1  ILE  31           QD1      ILE  31   4.387  -2.142  -0.866
  343    H    GLU  32           HN       GLU  32   8.384   1.372   1.225
  344    HA   GLU  32           HA       GLU  32   7.321   3.542   2.682
  345   1HB   GLU  32          2HB       GLU  32   9.377   2.400   3.284
  346   2HB   GLU  32          3HB       GLU  32  10.216   3.045   1.874
  347   1HG   GLU  32          2HG       GLU  32  10.453   5.130   2.825
  348   2HG   GLU  32          3HG       GLU  32   8.842   5.096   3.558
  349    QB   GLU  32           QB       GLU  32   9.797   2.723   2.579
  350    QG   GLU  32           QG       GLU  32   9.648   5.112   3.191
  351    H    GLN  33           HN       GLN  33   9.299   3.586  -0.284
  352    HA   GLN  33           HA       GLN  33   9.253   6.307  -0.894
  353   1HB   GLN  33          2HB       GLN  33   9.178   3.886  -2.767
  354   2HB   GLN  33          3HB       GLN  33   9.548   5.528  -3.285
  355   1HG   GLN  33          2HG       GLN  33  11.239   3.776  -1.453
  356   2HG   GLN  33          3HG       GLN  33  11.598   4.324  -3.074
  357   1HE2  GLN  33          2HE2      GLN  33  12.758   6.522   0.071
  358   2HE2  GLN  33          1HE2      GLN  33  12.197   4.873   0.199
  359    QB   GLN  33           QB       GLN  33   9.363   4.707  -3.026
  360    QG   GLN  33           QG       GLN  33  11.418   4.050  -2.264
  361    QE2  GLN  33           QE2      GLN  33  12.477   5.697   0.135
  362    H    LEU  34           HN       LEU  34   6.783   3.798  -1.674
  363    HA   LEU  34           HA       LEU  34   5.030   5.666  -2.924
  364   1HB   LEU  34          2HB       LEU  34   4.909   3.262  -3.309
  365   2HB   LEU  34          3HB       LEU  34   4.428   2.990  -1.626
  366    HG   LEU  34           HG       LEU  34   2.327   4.273  -1.991
  367   1HD1  LEU  34          1HD1      LEU  34   3.550   4.691  -4.732
  368   2HD1  LEU  34          2HD1      LEU  34   1.796   4.826  -4.473
  369   3HD1  LEU  34          3HD1      LEU  34   2.887   5.928  -3.640
  370   1HD2  LEU  34          2HD2      LEU  34   2.932   2.142  -4.049
  371   2HD2  LEU  34          3HD2      LEU  34   2.387   1.883  -2.384
  372   3HD2  LEU  34          1HD2      LEU  34   1.294   2.651  -3.557
  373    QB   LEU  34           QB       LEU  34   4.668   3.126  -2.468
  374    QD1  LEU  34           QD1      LEU  34   2.744   5.148  -4.281
  375    QD2  LEU  34           QD2      LEU  34   2.204   2.226  -3.330
  376    QQD  LEU  34           QQD      LEU  34   2.474   3.687  -3.806
  377    H    GLU  35           HN       GLU  35   5.209   4.489   0.491
  378    HA   GLU  35           HA       GLU  35   2.976   5.907   1.511
  379   1HB   GLU  35          2HB       GLU  35   5.533   4.845   2.691
  380   2HB   GLU  35          3HB       GLU  35   4.758   6.155   3.549
  381   1HG   GLU  35          2HG       GLU  35   2.592   4.553   3.274
  382   2HG   GLU  35          3HG       GLU  35   3.870   3.330   3.173
  383    QB   GLU  35           QB       GLU  35   5.146   5.500   3.121
  384    QG   GLU  35           QG       GLU  35   3.231   3.941   3.224
  385    H    ASN  36           HN       ASN  36   6.319   7.015   0.828
  386    HA   ASN  36           HA       ASN  36   5.794   9.678   1.814
  387   1HB   ASN  36          2HB       ASN  36   7.896   9.181  -0.262
  388   2HB   ASN  36          3HB       ASN  36   7.888  10.322   1.077
  389   1HD2  ASN  36          2HD2      ASN  36   8.570   7.230   3.266
  390   2HD2  ASN  36          1HD2      ASN  36   7.132   8.220   3.114
  391    QB   ASN  36           QB       ASN  36   7.892   9.752   0.408
  392    QD2  ASN  36           QD2      ASN  36   7.851   7.725   3.190
  393    H    GLY  37           HN       GLY  37   4.413   8.212  -0.862
  394   1HA   GLY  37          1HA       GLY  37   3.115   9.008  -2.527
  395   2HA   GLY  37          2HA       GLY  37   3.178  10.594  -1.743
  396    QA   GLY  37           QA       GLY  37   3.147   9.801  -2.135
  397    H    LYS  38           HN       LYS  38   5.722   8.540  -3.221
  398    HA   LYS  38           HA       LYS  38   6.711  10.846  -4.781
  399   1HB   LYS  38          2HB       LYS  38   7.757   8.009  -4.489
  400   2HB   LYS  38          3HB       LYS  38   8.545   9.354  -5.352
  401   1HG   LYS  38          2HG       LYS  38   8.646  10.681  -3.261
  402   2HG   LYS  38          3HG       LYS  38   7.778   9.406  -2.415
  403   1HD   LYS  38          2HD       LYS  38  10.071   9.232  -1.829
  404   2HD   LYS  38          3HD       LYS  38   9.620   7.827  -2.770
  405   1HE   LYS  38          2HE       LYS  38  10.961  10.269  -4.058
  406   2HE   LYS  38          3HE       LYS  38  11.900   9.040  -3.222
  407   1HZ   LYS  38          2HZ       LYS  38  10.725   7.414  -4.716
  408   2HZ   LYS  38          3HZ       LYS  38  10.362   8.710  -5.673
  409   3HZ   LYS  38          1HZ       LYS  38  11.928   8.327  -5.354
  410    QB   LYS  38           QB       LYS  38   8.151   8.681  -4.921
  411    QG   LYS  38           QG       LYS  38   8.212  10.044  -2.838
  412    QD   LYS  38           QD       LYS  38   9.845   8.529  -2.300
  413    QE   LYS  38           QE       LYS  38  11.431   9.654  -3.640
  414    QZ   LYS  38           QZ       LYS  38  11.005   8.150  -5.248
  415    H    THR  39           HN       THR  39   4.330   8.504  -5.394
  416    HA   THR  39           HA       THR  39   4.497   9.191  -8.210
  417    HB   THR  39           HB       THR  39   5.685   6.849  -7.738
  418    HG1  THR  39          1HG       THR  39   5.400   7.550  -9.767
  419   1HG2  THR  39          2HG2      THR  39   3.666   5.939  -6.495
  420   2HG2  THR  39          3HG2      THR  39   2.798   5.939  -8.036
  421   3HG2  THR  39          1HG2      THR  39   4.244   4.944  -7.850
  422    QG2  THR  39           QG2      THR  39   3.569   5.608  -7.460
  423    H    LYS  40           HN       LYS  40   2.497   8.625  -9.284
  424    HA   LYS  40           HA       LYS  40   0.165   9.047  -7.489
  425   1HB   LYS  40          2HB       LYS  40  -1.022   9.555  -9.602
  426   2HB   LYS  40          3HB       LYS  40   0.275  10.672  -9.194
  427   1HG   LYS  40          2HG       LYS  40   1.089   8.421 -10.994
  428   2HG   LYS  40          3HG       LYS  40  -0.112   9.493 -11.666
  429   1HD   LYS  40          2HD       LYS  40   2.492  10.518 -10.434
  430   2HD   LYS  40          3HD       LYS  40   2.332  10.014 -12.120
  431   1HE   LYS  40          2HE       LYS  40   0.173  11.754 -11.881
  432   2HE   LYS  40          3HE       LYS  40   1.303  12.455 -10.722
  433   1HZ   LYS  40          2HZ       LYS  40   2.872  12.062 -12.844
  434   2HZ   LYS  40          3HZ       LYS  40   1.432  12.335 -13.590
  435   3HZ   LYS  40          1HZ       LYS  40   2.048  13.453 -12.560
  436    QB   LYS  40           QB       LYS  40  -0.373  10.113  -9.398
  437    QG   LYS  40           QG       LYS  40   0.488   8.956 -11.329
  438    QD   LYS  40           QD       LYS  40   2.412  10.266 -11.277
  439    QE   LYS  40           QE       LYS  40   0.738  12.104 -11.301
  440    QZ   LYS  40           QZ       LYS  40   2.118  12.617 -12.998
  441    NH1  ARG  41           NH2      ARG  41  -2.276   3.179 -14.151
  442    NH2  ARG  41           NH1      ARG  41  -3.625   1.303 -13.969
  443    H    ARG  41           HN       ARG  41   1.510   6.704  -9.830
  444    HA   ARG  41           HA       ARG  41  -0.511   4.744  -8.988
  445   1HB   ARG  41          2HB       ARG  41  -1.326   6.122 -10.965
  446   2HB   ARG  41          3HB       ARG  41  -0.147   5.258 -11.944
  447   1HG   ARG  41          2HG       ARG  41  -2.287   3.935 -10.183
  448   2HG   ARG  41          3HG       ARG  41  -2.536   4.393 -11.851
  449   1HD   ARG  41          2HD       ARG  41  -0.308   2.871 -12.235
  450   2HD   ARG  41          3HD       ARG  41  -0.807   2.204 -10.692
  451    HE   ARG  41           HE       ARG  41  -2.450   1.038 -11.739
  452   1HH1  ARG  41          2HH2      ARG  41  -1.577   3.779 -13.737
  453   2HH1  ARG  41          1HH2      ARG  41  -2.656   3.418 -15.054
  454   1HH2  ARG  41          2HH1      ARG  41  -3.947   0.496 -13.456
  455   2HH2  ARG  41          1HH1      ARG  41  -4.040   1.491 -14.871
  456    QB   ARG  41           QB       ARG  41  -0.737   5.690 -11.454
  457    QG   ARG  41           QG       ARG  41  -2.411   4.164 -11.018
  458    QD   ARG  41           QD       ARG  41  -0.558   2.537 -11.463
  459    QH1  ARG  41           QH2      ARG  41  -2.117   3.599 -14.396
  460    QH2  ARG  41           QH1      ARG  41  -3.993   0.993 -14.164
  461    HA   PRO  42           HA       PRO  42   3.713   2.936  -9.395
  462   1HB   PRO  42          2HB       PRO  42   3.364   1.003  -7.407
  463   2HB   PRO  42          3HB       PRO  42   3.915   2.664  -7.116
  464   1HG   PRO  42          2HG       PRO  42   1.224   1.466  -6.660
  465   2HG   PRO  42          3HG       PRO  42   2.009   2.825  -5.814
  466   1HD   PRO  42          2HD       PRO  42   0.043   3.070  -7.738
  467   2HD   PRO  42          3HD       PRO  42   1.086   4.377  -7.178
  468    QB   PRO  42           QB       PRO  42   3.639   1.834  -7.262
  469    QG   PRO  42           QG       PRO  42   1.617   2.145  -6.237
  470    QD   PRO  42           QD       PRO  42   0.565   3.724  -7.458
  471    NH1  ARG  43           NH2      ARG  43   7.719   0.008 -14.521
  472    NH2  ARG  43           NH1      ARG  43   6.821   1.696 -15.833
  473    H    ARG  43           HN       ARG  43   4.401   0.592  -9.766
  474    HA   ARG  43           HA       ARG  43   2.613  -0.624 -11.721
  475   1HB   ARG  43          2HB       ARG  43   5.342  -1.382 -10.567
  476   2HB   ARG  43          3HB       ARG  43   4.396  -2.500 -11.549
  477   1HG   ARG  43          2HG       ARG  43   5.753  -1.512 -13.127
  478   2HG   ARG  43          3HG       ARG  43   4.211  -0.685 -13.321
  479   1HD   ARG  43          2HD       ARG  43   5.167   1.181 -11.826
  480   2HD   ARG  43          3HD       ARG  43   6.736   0.400 -11.964
  481    HE   ARG  43           HE       ARG  43   5.260   2.002 -13.894
  482   1HH1  ARG  43          2HH2      ARG  43   7.695  -0.531 -13.669
  483   2HH1  ARG  43          1HH2      ARG  43   8.412  -0.217 -15.219
  484   1HH2  ARG  43          2HH1      ARG  43   6.140   2.427 -15.978
  485   2HH2  ARG  43          1HH1      ARG  43   7.483   1.509 -16.570
  486    QB   ARG  43           QB       ARG  43   4.868  -1.941 -11.058
  487    QG   ARG  43           QG       ARG  43   4.982  -1.098 -13.223
  488    QD   ARG  43           QD       ARG  43   5.951   0.791 -11.895
  489    QH1  ARG  43           QH2      ARG  43   8.053  -0.374 -14.443
  490    QH2  ARG  43           QH1      ARG  43   6.811   1.968 -16.275
  491    H    PHE  44           HN       PHE  44   3.443  -1.155  -8.351
  492    HA   PHE  44           HA       PHE  44   1.808  -3.615  -8.215
  493   1HB   PHE  44          2HB       PHE  44   2.768  -3.699  -5.903
  494   2HB   PHE  44          3HB       PHE  44   3.955  -3.756  -7.176
  495    HD1  PHE  44          1HD       PHE  44   5.529  -1.901  -7.533
  496    HD2  PHE  44          2HD       PHE  44   2.562  -1.737  -4.412
  497    HE1  PHE  44          1HE       PHE  44   6.581   0.162  -6.638
  498    HE2  PHE  44          2HE       PHE  44   3.780   0.144  -3.366
  499    HZ   PHE  44           HZ       PHE  44   5.693   1.204  -4.554
  500    QB   PHE  44           QB       PHE  44   3.362  -3.727  -6.539
  501    QR   PHE  44           QR       PHE  44   4.613  -0.833  -5.487
  502    H    LEU  45           HN       LEU  45   0.628  -0.857  -8.678
  503    HA   LEU  45           HA       LEU  45  -0.750  -0.170  -6.316
  504   1HB   LEU  45          2HB       LEU  45  -0.491   1.046  -8.578
  505   2HB   LEU  45          3HB       LEU  45  -1.926   0.195  -9.104
  506    HG   LEU  45           HG       LEU  45  -2.011   2.642  -8.180
  507   1HD1  LEU  45          3HD1      LEU  45  -3.943   0.468  -7.567
  508   2HD1  LEU  45          1HD1      LEU  45  -4.294   2.170  -7.207
  509   3HD1  LEU  45          2HD1      LEU  45  -3.912   1.680  -8.879
  510   1HD2  LEU  45          1HD2      LEU  45  -0.897   2.096  -5.927
  511   2HD2  LEU  45          2HD2      LEU  45  -2.429   2.971  -5.871
  512   3HD2  LEU  45          3HD2      LEU  45  -2.397   1.226  -5.551
  513    QB   LEU  45           QB       LEU  45  -1.209   0.620  -8.841
  514    QD1  LEU  45           QD1      LEU  45  -4.050   1.439  -7.884
  515    QD2  LEU  45           QD2      LEU  45  -1.908   2.098  -5.783
  516    QQD  LEU  45           QQD      LEU  45  -2.978   1.769  -6.834
  517    HA   PRO  46           HA       PRO  46  -4.191  -3.283  -7.513
  518   1HB   PRO  46          2HB       PRO  46  -3.541  -5.415  -9.145
  519   2HB   PRO  46          3HB       PRO  46  -4.346  -3.921  -9.685
  520   1HG   PRO  46          2HG       PRO  46  -1.526  -4.761 -10.109
  521   2HG   PRO  46          3HG       PRO  46  -2.533  -3.654 -11.074
  522   1HD   PRO  46          2HD       PRO  46  -0.549  -3.012  -9.184
  523   2HD   PRO  46          3HD       PRO  46  -1.660  -1.850  -9.949
  524    QB   PRO  46           QB       PRO  46  -3.944  -4.668  -9.415
  525    QG   PRO  46           QG       PRO  46  -2.029  -4.207 -10.591
  526    QD   PRO  46           QD       PRO  46  -1.105  -2.431  -9.566
  527    H    GLU  47           HN       GLU  47  -0.859  -4.583  -7.524
  528    HA   GLU  47           HA       GLU  47  -1.362  -6.846  -5.938
  529   1HB   GLU  47          2HB       GLU  47   1.159  -5.151  -6.044
  530   2HB   GLU  47          3HB       GLU  47   1.046  -6.834  -5.521
  531   1HG   GLU  47          2HG       GLU  47   0.306  -7.501  -7.786
  532   2HG   GLU  47          3HG       GLU  47   0.437  -5.830  -8.356
  533    QB   GLU  47           QB       GLU  47   1.103  -5.992  -5.783
  534    QG   GLU  47           QG       GLU  47   0.372  -6.666  -8.071
  535    H    LEU  48           HN       LEU  48  -0.504  -3.496  -4.970
  536    HA   LEU  48           HA       LEU  48  -0.591  -3.986  -2.158
  537   1HB   LEU  48          2HB       LEU  48   0.626  -2.134  -3.130
  538   2HB   LEU  48          3HB       LEU  48  -0.864  -1.436  -3.777
  539    HG   LEU  48           HG       LEU  48  -1.657  -1.008  -1.440
  540   1HD1  LEU  48          2HD1      LEU  48  -0.440  -2.825  -0.295
  541   2HD1  LEU  48          3HD1      LEU  48   1.086  -1.932  -0.552
  542   3HD1  LEU  48          1HD1      LEU  48  -0.215  -1.236   0.439
  543   1HD2  LEU  48          3HD2      LEU  48   1.112   0.020  -2.165
  544   2HD2  LEU  48          1HD2      LEU  48  -0.438   0.772  -2.597
  545   3HD2  LEU  48          2HD2      LEU  48   0.089   0.729  -0.903
  546    QB   LEU  48           QB       LEU  48  -0.119  -1.786  -3.453
  547    QD1  LEU  48           QD1      LEU  48   0.144  -1.998  -0.136
  548    QD2  LEU  48           QD2      LEU  48   0.255   0.507  -1.889
  549    QQD  LEU  48           QQD      LEU  48   0.199  -0.746  -1.012
  550    H    ALA  49           HN       ALA  49  -3.069  -2.825  -4.473
  551    HA   ALA  49           HA       ALA  49  -5.050  -2.338  -2.525
  552   1HB   ALA  49          3HB       ALA  49  -4.955  -2.232  -5.329
  553   2HB   ALA  49          1HB       ALA  49  -6.201  -3.432  -4.994
  554   3HB   ALA  49          2HB       ALA  49  -6.311  -1.809  -4.286
  555    QB   ALA  49           QB       ALA  49  -5.823  -2.491  -4.870
  556    H    SER  50           HN       SER  50  -4.506  -5.319  -4.435
  557    HA   SER  50           HA       SER  50  -6.343  -6.950  -2.998
  558   1HB   SER  50          2HB       SER  50  -4.004  -7.430  -4.837
  559   2HB   SER  50          3HB       SER  50  -4.575  -8.786  -3.859
  560    HG   SER  50           HG       SER  50  -6.651  -8.463  -4.694
  561    QB   SER  50           QB       SER  50  -4.289  -8.108  -4.348
  562    H    ALA  51           HN       ALA  51  -2.856  -6.307  -2.398
  563    HA   ALA  51           HA       ALA  51  -2.366  -8.168  -0.408
  564   1HB   ALA  51          3HB       ALA  51  -1.364  -5.297  -0.556
  565   2HB   ALA  51          1HB       ALA  51  -0.681  -6.537   0.458
  566   3HB   ALA  51          2HB       ALA  51  -0.597  -6.723  -1.300
  567    QB   ALA  51           QB       ALA  51  -0.880  -6.186  -0.466
  568    H    LEU  52           HN       LEU  52  -3.796  -4.893  -0.034
  569    HA   LEU  52           HA       LEU  52  -4.364  -5.458   2.790
  570   1HB   LEU  52          2HB       LEU  52  -4.589  -3.069   0.980
  571   2HB   LEU  52          3HB       LEU  52  -5.839  -3.218   2.200
  572    HG   LEU  52           HG       LEU  52  -4.383  -1.909   3.255
  573   1HD1  LEU  52          2HD1      LEU  52  -4.770  -4.143   4.567
  574   2HD1  LEU  52          3HD1      LEU  52  -3.076  -4.496   4.207
  575   3HD1  LEU  52          1HD1      LEU  52  -3.473  -3.073   5.152
  576   1HD2  LEU  52          3HD2      LEU  52  -2.103  -3.399   2.055
  577   2HD2  LEU  52          1HD2      LEU  52  -2.599  -1.701   1.815
  578   3HD2  LEU  52          2HD2      LEU  52  -1.923  -2.197   3.373
  579    QB   LEU  52           QB       LEU  52  -5.214  -3.143   1.589
  580    QD1  LEU  52           QD1      LEU  52  -3.773  -3.904   4.642
  581    QD2  LEU  52           QD2      LEU  52  -2.208  -2.432   2.414
  582    QQD  LEU  52           QQD      LEU  52  -2.991  -3.168   3.528
  583    H    GLY  53           HN       GLY  53  -6.153  -5.521  -0.220
  584   1HA   GLY  53          1HA       GLY  53  -8.028  -6.928  -0.542
  585   2HA   GLY  53          2HA       GLY  53  -8.456  -6.817   1.170
  586    QA   GLY  53           QA       GLY  53  -8.242  -6.872   0.314
  587    H    VAL  54           HN       VAL  54  -7.594  -4.239  -1.165
  588    HA   VAL  54           HA       VAL  54 -10.339  -3.095  -1.063
  589    HB   VAL  54           HB       VAL  54  -9.220  -0.825  -1.051
  590   1HG1  VAL  54          2HG1      VAL  54 -10.349  -1.734   0.936
  591   2HG1  VAL  54          3HG1      VAL  54  -8.820  -2.466   1.477
  592   3HG1  VAL  54          1HG1      VAL  54  -8.977  -0.700   1.360
  593   1HG2  VAL  54          2HG2      VAL  54  -6.766  -2.411  -0.144
  594   2HG2  VAL  54          3HG2      VAL  54  -6.945  -1.488  -1.657
  595   3HG2  VAL  54          1HG2      VAL  54  -6.925  -0.667  -0.095
  596    QG1  VAL  54           QG1      VAL  54  -9.382  -1.633   1.258
  597    QG2  VAL  54           QG2      VAL  54  -6.878  -1.522  -0.632
  598    QQG  VAL  54           QQG      VAL  54  -8.130  -1.578   0.313
  599    H    SER  55           HN       SER  55 -10.577  -1.497  -2.882
  600    HA   SER  55           HA       SER  55  -9.596  -2.764  -5.338
  601   1HB   SER  55          2HB       SER  55 -11.215  -1.331  -6.451
  602   2HB   SER  55          3HB       SER  55 -11.971  -2.086  -5.040
  603    HG   SER  55           HG       SER  55 -11.216  -0.001  -3.951
  604    QB   SER  55           QB       SER  55 -11.593  -1.708  -5.745
  605    H    VAL  56           HN       VAL  56  -8.434  -1.715  -6.980
  606    HA   VAL  56           HA       VAL  56  -6.436   0.207  -6.368
  607    HB   VAL  56           HB       VAL  56  -7.783  -0.816  -8.917
  608   1HG1  VAL  56          1HG1      VAL  56  -6.052   1.590  -8.743
  609   2HG1  VAL  56          2HG1      VAL  56  -5.738   0.447 -10.062
  610   3HG1  VAL  56          3HG1      VAL  56  -7.337   1.171  -9.863
  611   1HG2  VAL  56          2HG2      VAL  56  -5.182  -1.265  -7.478
  612   2HG2  VAL  56          3HG2      VAL  56  -6.355  -2.429  -8.094
  613   3HG2  VAL  56          1HG2      VAL  56  -5.282  -1.577  -9.219
  614    QG1  VAL  56           QG1      VAL  56  -6.375   1.069  -9.556
  615    QG2  VAL  56           QG2      VAL  56  -5.606  -1.757  -8.263
  616    QQG  VAL  56           QQG      VAL  56  -5.990  -0.344  -8.910
  617    H    ASP  57           HN       ASP  57  -9.715   0.694  -7.693
  618    HA   ASP  57           HA       ASP  57  -9.708   3.444  -8.101
  619   1HB   ASP  57          2HB       ASP  57 -11.706   2.209  -8.577
  620   2HB   ASP  57          3HB       ASP  57 -11.831   1.616  -6.906
  621    QB   ASP  57           QB       ASP  57 -11.769   1.912  -7.742
  622    CH2  TRP  58           CH2      TRP  58  -7.836   2.345   2.424
  623    H    TRP  58           HN       TRP  58 -10.060   1.665  -5.017
  624    HA   TRP  58           HA       TRP  58 -10.365   4.085  -3.457
  625   1HB   TRP  58          2HB       TRP  58 -11.287   1.917  -2.748
  626   2HB   TRP  58          3HB       TRP  58  -9.650   1.287  -2.530
  627    HD1  TRP  58           HD1      TRP  58 -11.949   4.025  -1.138
  628    HE1  TRP  58           HE1      TRP  58 -11.362   4.508   1.291
  629    HE3  TRP  58           HE3      TRP  58  -7.624   1.362  -0.841
  630    HZ2  TRP  58           HZ2      TRP  58  -9.356   3.672   3.207
  631    HZ3  TRP  58           HZ3      TRP  58  -6.377   1.223   1.316
  632    HH2  TRP  58           HH2      TRP  58  -7.270   2.296   3.344
  633    QB   TRP  58           QB       TRP  58 -10.468   1.602  -2.639
  634    H    LEU  59           HN       LEU  59  -7.589   1.829  -4.068
  635    HA   LEU  59           HA       LEU  59  -5.803   3.231  -2.370
  636   1HB   LEU  59          2HB       LEU  59  -5.550   1.335  -4.611
  637   2HB   LEU  59          3HB       LEU  59  -4.190   2.424  -4.511
  638    HG   LEU  59           HG       LEU  59  -5.294   0.705  -2.248
  639   1HD1  LEU  59          1HD1      LEU  59  -4.040  -0.414  -4.174
  640   2HD1  LEU  59          2HD1      LEU  59  -2.587   0.414  -3.580
  641   3HD1  LEU  59          3HD1      LEU  59  -3.467  -0.691  -2.518
  642   1HD2  LEU  59          3HD2      LEU  59  -3.467   3.005  -2.112
  643   2HD2  LEU  59          1HD2      LEU  59  -4.166   2.026  -0.800
  644   3HD2  LEU  59          2HD2      LEU  59  -2.659   1.531  -1.573
  645    QB   LEU  59           QB       LEU  59  -4.870   1.879  -4.561
  646    QD1  LEU  59           QD1      LEU  59  -3.365  -0.230  -3.424
  647    QD2  LEU  59           QD2      LEU  59  -3.430   2.187  -1.496
  648    QQD  LEU  59           QQD      LEU  59  -3.398   0.978  -2.460
  649    H    LEU  60           HN       LEU  60  -6.690   3.932  -5.756
  650    HA   LEU  60           HA       LEU  60  -5.046   6.294  -5.942
  651   1HB   LEU  60          2HB       LEU  60  -7.330   5.125  -7.542
  652   2HB   LEU  60          3HB       LEU  60  -6.735   6.743  -7.930
  653    HG   LEU  60           HG       LEU  60  -4.831   4.399  -7.670
  654   1HD1  LEU  60          2HD1      LEU  60  -6.534   3.808  -9.384
  655   2HD1  LEU  60          3HD1      LEU  60  -6.202   5.330 -10.232
  656   3HD1  LEU  60          1HD1      LEU  60  -4.934   4.092 -10.099
  657   1HD2  LEU  60          2HD2      LEU  60  -4.070   6.928  -7.763
  658   2HD2  LEU  60          3HD2      LEU  60  -3.286   5.752  -8.822
  659   3HD2  LEU  60          1HD2      LEU  60  -4.534   6.835  -9.462
  660    QB   LEU  60           QB       LEU  60  -7.033   5.935  -7.737
  661    QD1  LEU  60           QD1      LEU  60  -5.889   4.410  -9.905
  662    QD2  LEU  60           QD2      LEU  60  -3.963   6.505  -8.683
  663    QQD  LEU  60           QQD      LEU  60  -4.926   5.457  -9.294
  664    H    ASN  61           HN       ASN  61  -8.550   5.926  -5.259
  665    HA   ASN  61           HA       ASN  61  -8.913   8.796  -4.818
  666   1HB   ASN  61          2HB       ASN  61 -10.749   6.379  -4.490
  667   2HB   ASN  61          3HB       ASN  61 -11.193   7.998  -3.961
  668   1HD2  ASN  61          2HD2      ASN  61 -11.108   7.141  -7.959
  669   2HD2  ASN  61          1HD2      ASN  61 -10.305   6.083  -6.816
  670    QB   ASN  61           QB       ASN  61 -10.971   7.189  -4.226
  671    QD2  ASN  61           QD2      ASN  61 -10.706   6.612  -7.387
  672    H    GLY  62           HN       GLY  62  -9.472   5.975  -2.688
  673   1HA   GLY  62          1HA       GLY  62  -8.580   5.762  -0.558
  674   2HA   GLY  62          2HA       GLY  62  -8.528   7.543  -0.363
  675    QA   GLY  62           QA       GLY  62  -8.554   6.653  -0.461
  676    H    THR  63           HN       THR  63 -11.436   6.956  -1.709
  677    HA   THR  63           HA       THR  63 -12.911   6.290   0.743
  678    HB   THR  63           HB       THR  63 -14.171   8.469   0.324
  679    HG1  THR  63          1HG       THR  63 -12.853  10.101  -0.715
  680   1HG2  THR  63          2HG2      THR  63 -12.430   8.099   2.196
  681   2HG2  THR  63          3HG2      THR  63 -11.284   8.981   1.162
  682   3HG2  THR  63          1HG2      THR  63 -12.748   9.782   1.739
  683    QG2  THR  63           QG2      THR  63 -12.154   8.954   1.699
  684    H    SER  64           HN       SER  64 -14.347   4.783  -0.008
  685    HA   SER  64           HA       SER  64 -15.786   5.254  -2.485
  686   1HB   SER  64          2HB       SER  64 -13.747   3.881  -3.208
  687   2HB   SER  64          3HB       SER  64 -14.315   2.610  -2.094
  688    HG   SER  64           HG       SER  64 -15.299   3.422  -4.540
  689    QB   SER  64           QB       SER  64 -14.031   3.246  -2.651
  690    H    ASP  65           HN       ASP  65 -17.425   3.385  -2.612
  691    HA   ASP  65           HA       ASP  65 -18.810   3.296  -0.017
  692   1HB   ASP  65          2HB       ASP  65 -20.603   2.118  -1.416
  693   2HB   ASP  65          3HB       ASP  65 -20.253   3.809  -1.790
  694    QB   ASP  65           QB       ASP  65 -20.428   2.964  -1.603
  695    H    SER  66           HN       SER  66 -19.774   1.243   0.659
  696    HA   SER  66           HA       SER  66 -17.820  -1.038   0.518
  697   1HB   SER  66          2HB       SER  66 -19.569   0.016   2.760
  698   2HB   SER  66          3HB       SER  66 -18.974  -1.650   2.736
  699    HG   SER  66           HG       SER  66 -17.188   0.479   2.286
  700    QB   SER  66           QB       SER  66 -19.271  -0.818   2.748
  701    H    ASN  67           HN       ASN  67 -18.735  -1.938  -1.317
  702    HA   ASN  67           HA       ASN  67 -21.420  -3.222  -0.928
  703   1HB   ASN  67          2HB       ASN  67 -20.158  -1.990  -3.409
  704   2HB   ASN  67          3HB       ASN  67 -21.475  -3.169  -3.484
  705   1HD2  ASN  67          2HD2      ASN  67 -23.947  -0.938  -2.117
  706   2HD2  ASN  67          1HD2      ASN  67 -23.504  -2.639  -2.155
  707    QB   ASN  67           QB       ASN  67 -20.816  -2.579  -3.446
  708    QD2  ASN  67           QD2      ASN  67 -23.726  -1.788  -2.136
  709    H    VAL  68           HN       VAL  68 -20.547  -5.114  -0.028
  710    HA   VAL  68           HA       VAL  68 -19.400  -6.924  -1.962
  711    HB   VAL  68           HB       VAL  68 -17.434  -5.730  -0.929
  712   1HG1  VAL  68          3HG1      VAL  68 -18.384  -5.483   1.383
  713   2HG1  VAL  68          1HG1      VAL  68 -18.142  -7.223   1.630
  714   3HG1  VAL  68          2HG1      VAL  68 -16.750  -6.166   1.340
  715   1HG2  VAL  68          3HG2      VAL  68 -17.629  -8.365  -1.650
  716   2HG2  VAL  68          1HG2      VAL  68 -16.140  -7.524  -1.213
  717   3HG2  VAL  68          2HG2      VAL  68 -16.986  -8.504  -0.004
  718    QG1  VAL  68           QG1      VAL  68 -17.759  -6.290   1.451
  719    QG2  VAL  68           QG2      VAL  68 -16.919  -8.131  -0.955
  720    QQG  VAL  68           QQG      VAL  68 -17.339  -7.211   0.248
  721    NH1  ARG  69           NH2      ARG  69 -25.841  -9.161  -0.803
  722    NH2  ARG  69           NH1      ARG  69 -27.652 -10.028   0.353
  723    H    ARG  69           HN       ARG  69 -19.406  -9.239  -0.885
  724    HA   ARG  69           HA       ARG  69 -21.109  -9.602   1.359
  725   1HB   ARG  69          2HB       ARG  69 -22.674  -9.103  -0.749
  726   2HB   ARG  69          3HB       ARG  69 -22.150 -10.696  -1.273
  727   1HG   ARG  69          2HG       ARG  69 -24.042 -11.272  -0.117
  728   2HG   ARG  69          3HG       ARG  69 -22.860 -11.456   1.164
  729   1HD   ARG  69          2HD       ARG  69 -23.747  -9.792   2.411
  730   2HD   ARG  69          3HD       ARG  69 -23.888  -8.671   1.078
  731    HE   ARG  69           HE       ARG  69 -25.949 -10.353   2.197
  732   1HH1  ARG  69          2HH2      ARG  69 -24.849  -8.972  -0.828
  733   2HH1  ARG  69          1HH2      ARG  69 -26.397  -8.960  -1.619
  734   1HH2  ARG  69          2HH1      ARG  69 -28.043 -10.464   1.176
  735   2HH2  ARG  69          1HH1      ARG  69 -28.259  -9.870  -0.437
  736    QB   ARG  69           QB       ARG  69 -22.413  -9.900  -1.011
  737    QG   ARG  69           QG       ARG  69 -23.452 -11.364   0.523
  738    QD   ARG  69           QD       ARG  69 -23.818  -9.232   1.744
  739    QH1  ARG  69           QH2      ARG  69 -25.623  -8.966  -1.224
  740    QH2  ARG  69           QH1      ARG  69 -28.151 -10.167   0.370
   
  Start of MODEL           3
 Raw file had 740 H/Q atoms
  Start of MODEL    3
    1    H    SER   1           HN       SER   1  -5.269  10.859   2.656
    2    HA   SER   1           HA       SER   1  -3.493  11.132   1.292
    3   1HB   SER   1          2HB       SER   1  -1.933  10.860   3.906
    4   2HB   SER   1          3HB       SER   1  -1.120  10.946   2.341
    5    HG   SER   1           HG       SER   1  -2.727  12.933   3.554
    6    QB   SER   1           QB       SER   1  -1.527  10.903   3.124
    7    H    ILE   2           HN       ILE   2  -1.701   9.707   0.235
    8    HA   ILE   2           HA       ILE   2  -2.694   7.099  -0.191
    9    HB   ILE   2           HB       ILE   2   0.109   8.176  -0.626
   10   1HG1  ILE   2          2HG1      ILE   2  -2.295   7.954  -2.506
   11   2HG1  ILE   2          3HG1      ILE   2  -1.695   9.451  -1.788
   12   1HG2  ILE   2          2HG2      ILE   2  -1.299   5.666  -1.647
   13   2HG2  ILE   2          3HG2      ILE   2   0.211   6.308  -2.321
   14   3HG2  ILE   2          1HG2      ILE   2   0.174   5.745  -0.654
   15   1HD1  ILE   2          1HD1      ILE   2   0.587   8.814  -2.913
   16   2HD1  ILE   2          2HD1      ILE   2  -0.438   7.803  -3.959
   17   3HD1  ILE   2          3HD1      ILE   2  -0.718   9.548  -3.861
   18    QG1  ILE   2           QG1      ILE   2  -1.994   8.701  -2.147
   19    QG2  ILE   2           QG2      ILE   2  -0.305   5.907  -1.541
   20    QD1  ILE   2           QD1      ILE   2  -0.190   8.721  -3.578
   21    H    SER   3           HN       SER   3   0.115   8.156   1.815
   22    HA   SER   3           HA       SER   3   0.739   5.746   3.023
   23   1HB   SER   3          2HB       SER   3   1.411   7.438   4.946
   24   2HB   SER   3          3HB       SER   3   2.167   7.586   3.362
   25    HG   SER   3           HG       SER   3   0.526   9.344   4.606
   26    QB   SER   3           QB       SER   3   1.790   7.512   4.154
   27    H    SER   4           HN       SER   4  -1.938   8.001   3.787
   28    HA   SER   4           HA       SER   4  -2.362   6.792   6.394
   29   1HB   SER   4          2HB       SER   4  -4.270   8.071   6.676
   30   2HB   SER   4          3HB       SER   4  -3.085   9.120   5.882
   31    HG   SER   4           HG       SER   4  -5.395   7.850   4.800
   32    QB   SER   4           QB       SER   4  -3.677   8.595   6.280
   33    NH1  ARG   5           NH2      ARG   5  -5.120   8.559  -1.416
   34    NH2  ARG   5           NH1      ARG   5  -5.840   7.166  -3.097
   35    H    ARG   5           HN       ARG   5  -3.843   6.397   3.104
   36    HA   ARG   5           HA       ARG   5  -5.592   4.304   3.856
   37   1HB   ARG   5          2HB       ARG   5  -4.095   4.681   1.245
   38   2HB   ARG   5          3HB       ARG   5  -5.209   3.477   1.431
   39   1HG   ARG   5          2HG       ARG   5  -6.888   4.920   0.875
   40   2HG   ARG   5          3HG       ARG   5  -6.550   5.833   2.338
   41   1HD   ARG   5          2HD       ARG   5  -6.298   7.473   0.803
   42   2HD   ARG   5          3HD       ARG   5  -4.630   6.864   0.843
   43    HE   ARG   5           HE       ARG   5  -6.081   5.486  -1.199
   44   1HH1  ARG   5          2HH2      ARG   5  -4.874   8.694  -0.452
   45   2HH1  ARG   5          1HH2      ARG   5  -5.012   9.312  -2.080
   46   1HH2  ARG   5          2HH1      ARG   5  -5.861   6.227  -3.482
   47   2HH2  ARG   5          1HH1      ARG   5  -5.966   7.921  -3.762
   48    QB   ARG   5           QB       ARG   5  -4.653   4.079   1.338
   49    QG   ARG   5           QG       ARG   5  -6.719   5.377   1.606
   50    QD   ARG   5           QD       ARG   5  -5.464   7.169   0.823
   51    QH1  ARG   5           QH2      ARG   5  -4.943   9.002  -1.266
   52    QH2  ARG   5           QH1      ARG   5  -5.914   7.074  -3.622
   53    H    VAL   6           HN       VAL   6  -2.189   3.987   2.630
   54    HA   VAL   6           HA       VAL   6  -2.134   1.178   2.869
   55    HB   VAL   6           HB       VAL   6   0.266   3.037   3.172
   56   1HG1  VAL   6          2HG1      VAL   6   0.040   0.123   2.301
   57   2HG1  VAL   6          3HG1      VAL   6   1.518   1.098   2.252
   58   3HG1  VAL   6          1HG1      VAL   6   0.780   0.710   3.805
   59   1HG2  VAL   6          2HG2      VAL   6  -1.237   2.023   0.742
   60   2HG2  VAL   6          3HG2      VAL   6  -0.677   3.657   1.089
   61   3HG2  VAL   6          1HG2      VAL   6   0.494   2.424   0.653
   62    QG1  VAL   6           QG1      VAL   6   0.779   0.645   2.786
   63    QG2  VAL   6           QG2      VAL   6  -0.474   2.701   0.828
   64    QQG  VAL   6           QQG      VAL   6   0.153   1.673   1.807
   65    H    LYS   7           HN       LYS   7  -0.919   3.598   5.228
   66    HA   LYS   7           HA       LYS   7  -0.089   1.689   7.102
   67   1HB   LYS   7          2HB       LYS   7   0.598   4.126   6.875
   68   2HB   LYS   7          3HB       LYS   7  -0.854   4.535   7.798
   69   1HG   LYS   7          2HG       LYS   7   0.565   2.397   9.161
   70   2HG   LYS   7          3HG       LYS   7   1.760   3.596   8.681
   71   1HD   LYS   7          2HD       LYS   7  -0.827   4.259  10.157
   72   2HD   LYS   7          3HD       LYS   7   0.661   3.873  11.013
   73   1HE   LYS   7          2HE       LYS   7   0.638   6.094   8.936
   74   2HE   LYS   7          3HE       LYS   7  -0.014   6.384  10.553
   75   1HZ   LYS   7          1HZ       LYS   7   2.716   5.403  10.074
   76   2HZ   LYS   7          2HZ       LYS   7   2.319   6.976  10.330
   77   3HZ   LYS   7          3HZ       LYS   7   2.060   5.870  11.511
   78    QB   LYS   7           QB       LYS   7  -0.128   4.330   7.336
   79    QG   LYS   7           QG       LYS   7   1.163   2.997   8.921
   80    QD   LYS   7           QD       LYS   7  -0.083   4.066  10.584
   81    QE   LYS   7           QE       LYS   7   0.312   6.239   9.744
   82    QZ   LYS   7           QZ       LYS   7   2.365   6.083  10.638
   83    H    SER   8           HN       SER   8  -3.156   3.678   7.029
   84    HA   SER   8           HA       SER   8  -4.394   2.748   9.354
   85   1HB   SER   8          2HB       SER   8  -5.597   3.405   6.627
   86   2HB   SER   8          3HB       SER   8  -6.556   3.100   8.072
   87    HG   SER   8           HG       SER   8  -5.556   4.853   9.087
   88    QB   SER   8           QB       SER   8  -6.077   3.252   7.349
   89    H    LYS   9           HN       LYS   9  -4.464   1.243   6.055
   90    HA   LYS   9           HA       LYS   9  -6.104  -0.912   7.003
   91   1HB   LYS   9          2HB       LYS   9  -5.555  -0.042   4.520
   92   2HB   LYS   9          3HB       LYS   9  -4.277  -1.250   4.643
   93   1HG   LYS   9          2HG       LYS   9  -6.208  -2.338   3.697
   94   2HG   LYS   9          3HG       LYS   9  -6.094  -2.908   5.363
   95   1HD   LYS   9          2HD       LYS   9  -7.751  -0.654   5.628
   96   2HD   LYS   9          3HD       LYS   9  -8.078  -1.115   3.990
   97   1HE   LYS   9          2HE       LYS   9  -9.716  -2.201   5.312
   98   2HE   LYS   9          3HE       LYS   9  -8.601  -3.476   4.785
   99   1HZ   LYS   9          2HZ       LYS   9  -8.518  -2.109   7.396
  100   2HZ   LYS   9          3HZ       LYS   9  -9.239  -3.545   7.151
  101   3HZ   LYS   9          1HZ       LYS   9  -7.609  -3.414   6.979
  102    QB   LYS   9           QB       LYS   9  -4.916  -0.646   4.581
  103    QG   LYS   9           QG       LYS   9  -6.151  -2.623   4.530
  104    QD   LYS   9           QD       LYS   9  -7.914  -0.885   4.809
  105    QE   LYS   9           QE       LYS   9  -9.159  -2.839   5.048
  106    QZ   LYS   9           QZ       LYS   9  -8.456  -3.023   7.176
  107    NH1  ARG  10           NH2      ARG  10   2.990  -1.058  10.024
  108    NH2  ARG  10           NH1      ARG  10   3.815   0.899   9.094
  109    H    ARG  10           HN       ARG  10  -2.578  -0.597   6.478
  110    HA   ARG  10           HA       ARG  10  -1.763  -3.120   7.325
  111   1HB   ARG  10          2HB       ARG  10  -0.294  -1.498   6.282
  112   2HB   ARG  10          3HB       ARG  10  -0.391  -0.432   7.696
  113   1HG   ARG  10          2HG       ARG  10   0.718  -1.933   9.095
  114   2HG   ARG  10          3HG       ARG  10   0.545  -3.265   7.949
  115   1HD   ARG  10          2HD       ARG  10   2.750  -2.722   7.733
  116   2HD   ARG  10          3HD       ARG  10   2.023  -2.009   6.316
  117    HE   ARG  10           HE       ARG  10   3.011  -0.061   6.950
  118   1HH1  ARG  10          2HH2      ARG  10   2.558  -1.981   9.923
  119   2HH1  ARG  10          1HH2      ARG  10   3.295  -0.795  10.949
  120   1HH2  ARG  10          2HH1      ARG  10   3.951   1.506   8.293
  121   2HH2  ARG  10          1HH1      ARG  10   4.227   1.169   9.975
  122    QB   ARG  10           QB       ARG  10  -0.343  -0.966   6.989
  123    QG   ARG  10           QG       ARG  10   0.632  -2.598   8.522
  124    QD   ARG  10           QD       ARG  10   2.386  -2.366   7.024
  125    QH1  ARG  10           QH2      ARG  10   2.926  -1.388  10.435
  126    QH2  ARG  10           QH1      ARG  10   4.090   1.337   9.135
  127    H    ILE  11           HN       ILE  11  -2.713  -0.342   9.376
  128    HA   ILE  11           HA       ILE  11  -2.019  -1.569  11.891
  129    HB   ILE  11           HB       ILE  11  -3.696   0.779  11.032
  130   1HG1  ILE  11          2HG1      ILE  11  -2.389   1.785  12.944
  131   2HG1  ILE  11          3HG1      ILE  11  -1.519   0.257  13.111
  132   1HG2  ILE  11          2HG2      ILE  11  -3.977  -0.492  13.782
  133   2HG2  ILE  11          3HG2      ILE  11  -4.481   1.153  13.363
  134   3HG2  ILE  11          1HG2      ILE  11  -5.283  -0.205  12.608
  135   1HD1  ILE  11          1HD1      ILE  11  -0.717   0.566  10.724
  136   2HD1  ILE  11          2HD1      ILE  11  -1.590   2.124  10.717
  137   3HD1  ILE  11          3HD1      ILE  11  -0.224   1.868  11.819
  138    QG1  ILE  11           QG1      ILE  11  -1.953   1.021  13.027
  139    QG2  ILE  11           QG2      ILE  11  -4.580   0.152  13.251
  140    QD1  ILE  11           QD1      ILE  11  -0.844   1.519  11.087
  141    H    GLN  12           HN       GLN  12  -5.149  -1.285  10.189
  142    HA   GLN  12           HA       GLN  12  -6.646  -2.907  11.964
  143   1HB   GLN  12          2HB       GLN  12  -6.878  -2.306   9.015
  144   2HB   GLN  12          3HB       GLN  12  -8.034  -3.396   9.813
  145   1HG   GLN  12          2HG       GLN  12  -8.827  -1.703  11.270
  146   2HG   GLN  12          3HG       GLN  12  -7.464  -0.632  10.928
  147   1HE2  GLN  12          2HE2      GLN  12  -9.335   1.011   8.419
  148   2HE2  GLN  12          1HE2      GLN  12  -8.184   1.125   9.739
  149    QB   GLN  12           QB       GLN  12  -7.457  -2.852   9.414
  150    QG   GLN  12           QG       GLN  12  -8.146  -1.168  11.099
  151    QE2  GLN  12           QE2      GLN  12  -8.760   1.068   9.079
  152    H    LEU  13           HN       LEU  13  -4.597  -3.921   9.226
  153    HA   LEU  13           HA       LEU  13  -5.140  -6.772   9.598
  154   1HB   LEU  13          2HB       LEU  13  -3.083  -5.158   8.075
  155   2HB   LEU  13          3HB       LEU  13  -3.006  -6.916   8.142
  156    HG   LEU  13           HG       LEU  13  -5.717  -5.837   7.518
  157   1HD1  LEU  13          3HD1      LEU  13  -4.181  -4.288   6.259
  158   2HD1  LEU  13          1HD1      LEU  13  -3.575  -5.689   5.371
  159   3HD1  LEU  13          2HD1      LEU  13  -5.293  -5.227   5.278
  160   1HD2  LEU  13          3HD2      LEU  13  -4.890  -8.303   7.498
  161   2HD2  LEU  13          1HD2      LEU  13  -5.863  -7.743   6.126
  162   3HD2  LEU  13          2HD2      LEU  13  -4.100  -7.894   5.969
  163    QB   LEU  13           QB       LEU  13  -3.045  -6.037   8.109
  164    QD1  LEU  13           QD1      LEU  13  -4.350  -5.068   5.636
  165    QD2  LEU  13           QD2      LEU  13  -4.950  -7.980   6.532
  166    QQD  LEU  13           QQD      LEU  13  -4.650  -6.524   6.084
  167    H    GLY  14           HN       GLY  14  -2.660  -4.493  10.765
  168   1HA   GLY  14          1HA       GLY  14  -1.370  -4.630  12.654
  169   2HA   GLY  14          2HA       GLY  14  -1.970  -6.266  12.978
  170    QA   GLY  14           QA       GLY  14  -1.670  -5.448  12.816
  171    H    LEU  15           HN       LEU  15  -0.172  -4.640  10.292
  172    HA   LEU  15           HA       LEU  15   1.947  -6.768  10.476
  173   1HB   LEU  15          2HB       LEU  15   0.615  -5.656   7.979
  174   2HB   LEU  15          3HB       LEU  15   1.998  -6.748   7.969
  175    HG   LEU  15           HG       LEU  15  -0.670  -7.512   9.230
  176   1HD1  LEU  15          3HD1      LEU  15  -0.957  -6.957   6.819
  177   2HD1  LEU  15          1HD1      LEU  15   0.288  -8.161   6.425
  178   3HD1  LEU  15          2HD1      LEU  15  -1.240  -8.663   7.197
  179   1HD2  LEU  15          3HD2      LEU  15   1.692  -9.175   8.243
  180   2HD2  LEU  15          1HD2      LEU  15   1.285  -8.883   9.940
  181   3HD2  LEU  15          2HD2      LEU  15   0.180  -9.812   8.919
  182    QB   LEU  15           QB       LEU  15   1.306  -6.202   7.973
  183    QD1  LEU  15           QD1      LEU  15  -0.637  -7.927   6.814
  184    QD2  LEU  15           QD2      LEU  15   1.052  -9.289   9.034
  185    QQD  LEU  15           QQD      LEU  15   0.208  -8.608   7.924
  186    H    ASN  16           HN       ASN  16   3.971  -6.102   9.310
  187    HA   ASN  16           HA       ASN  16   4.415  -3.145   9.512
  188   1HB   ASN  16          2HB       ASN  16   6.743  -3.514   9.681
  189   2HB   ASN  16          3HB       ASN  16   5.872  -4.404  10.940
  190   1HD2  ASN  16          2HD2      ASN  16   8.195  -6.944   9.912
  191   2HD2  ASN  16          1HD2      ASN  16   8.155  -5.499  10.917
  192    QB   ASN  16           QB       ASN  16   6.307  -3.959  10.311
  193    QD2  ASN  16           QD2      ASN  16   8.175  -6.221  10.414
  194    H    GLN  17           HN       GLN  17   5.947  -2.214   7.926
  195    HA   GLN  17           HA       GLN  17   4.763  -2.370   5.342
  196   1HB   GLN  17          2HB       GLN  17   7.179  -1.015   6.509
  197   2HB   GLN  17          3HB       GLN  17   7.055  -1.239   4.737
  198   1HG   GLN  17          2HG       GLN  17   4.884   0.062   4.883
  199   2HG   GLN  17          3HG       GLN  17   5.266   0.361   6.579
  200   1HE2  GLN  17          2HE2      GLN  17   6.949   3.260   5.292
  201   2HE2  GLN  17          1HE2      GLN  17   5.334   2.796   5.813
  202    QB   GLN  17           QB       GLN  17   7.116  -1.127   5.623
  203    QG   GLN  17           QG       GLN  17   5.075   0.212   5.732
  204    QE2  GLN  17           QE2      GLN  17   6.142   3.028   5.552
  205    H    ALA  18           HN       ALA  18   7.578  -4.031   6.757
  206    HA   ALA  18           HA       ALA  18   8.673  -5.180   4.410
  207   1HB   ALA  18          3HB       ALA  18   8.671  -5.977   7.333
  208   2HB   ALA  18          1HB       ALA  18   9.524  -6.911   6.101
  209   3HB   ALA  18          2HB       ALA  18   9.958  -5.221   6.396
  210    QB   ALA  18           QB       ALA  18   9.384  -6.037   6.610
  211    H    GLU  19           HN       GLU  19   6.375  -6.687   6.745
  212    HA   GLU  19           HA       GLU  19   5.840  -9.080   5.396
  213   1HB   GLU  19          2HB       GLU  19   4.212  -7.334   7.218
  214   2HB   GLU  19          3HB       GLU  19   3.614  -8.898   6.653
  215   1HG   GLU  19          2HG       GLU  19   5.100 -10.137   7.892
  216   2HG   GLU  19          3HG       GLU  19   6.390  -8.939   7.778
  217    QB   GLU  19           QB       GLU  19   3.913  -8.117   6.935
  218    QG   GLU  19           QG       GLU  19   5.745  -9.538   7.835
  219    H    LEU  20           HN       LEU  20   4.314  -5.862   5.174
  220    HA   LEU  20           HA       LEU  20   2.371  -6.567   3.194
  221   1HB   LEU  20          2HB       LEU  20   2.049  -4.689   4.547
  222   2HB   LEU  20          3HB       LEU  20   3.570  -3.952   4.093
  223    HG   LEU  20           HG       LEU  20   1.509  -2.927   3.134
  224   1HD1  LEU  20          2HD1      LEU  20   3.930  -2.953   2.164
  225   2HD1  LEU  20          3HD1      LEU  20   3.206  -3.830   0.815
  226   3HD1  LEU  20          1HD1      LEU  20   2.624  -2.216   1.258
  227   1HD2  LEU  20          2HD2      LEU  20   0.282  -5.073   2.665
  228   2HD2  LEU  20          3HD2      LEU  20   0.312  -3.941   1.306
  229   3HD2  LEU  20          1HD2      LEU  20   1.362  -5.353   1.288
  230    QB   LEU  20           QB       LEU  20   2.809  -4.321   4.320
  231    QD1  LEU  20           QD1      LEU  20   3.253  -3.000   1.412
  232    QD2  LEU  20           QD2      LEU  20   0.651  -4.789   1.753
  233    QQD  LEU  20           QQD      LEU  20   1.953  -3.894   1.583
  234    H    ALA  21           HN       ALA  21   5.726  -5.255   2.895
  235    HA   ALA  21           HA       ALA  21   5.823  -5.021   0.122
  236   1HB   ALA  21          3HB       ALA  21   7.610  -4.256   1.717
  237   2HB   ALA  21          1HB       ALA  21   8.159  -5.934   1.852
  238   3HB   ALA  21          2HB       ALA  21   8.201  -5.128   0.289
  239    QB   ALA  21           QB       ALA  21   7.990  -5.106   1.286
  240    H    GLN  22           HN       GLN  22   6.648  -7.911   2.112
  241    HA   GLN  22           HA       GLN  22   7.206  -9.517  -0.234
  242   1HB   GLN  22          2HB       GLN  22   7.070 -11.486   1.197
  243   2HB   GLN  22          3HB       GLN  22   8.124 -10.232   1.873
  244   1HG   GLN  22          2HG       GLN  22   6.491  -9.570   3.448
  245   2HG   GLN  22          3HG       GLN  22   5.220 -10.571   2.696
  246   1HE2  GLN  22          2HE2      GLN  22   5.748 -12.832   5.285
  247   2HE2  GLN  22          1HE2      GLN  22   4.699 -11.586   4.631
  248    QB   GLN  22           QB       GLN  22   7.597 -10.858   1.535
  249    QG   GLN  22           QG       GLN  22   5.856 -10.071   3.072
  250    QE2  GLN  22           QE2      GLN  22   5.223 -12.209   4.957
  251    H    LYS  23           HN       LYS  23   4.209  -8.885   1.594
  252    HA   LYS  23           HA       LYS  23   2.556 -10.790   0.265
  253   1HB   LYS  23          2HB       LYS  23   2.256  -8.511   2.078
  254   2HB   LYS  23          3HB       LYS  23   0.985  -8.527   0.893
  255   1HG   LYS  23          2HG       LYS  23   0.100 -10.546   1.600
  256   2HG   LYS  23          3HG       LYS  23   1.622 -11.081   2.353
  257   1HD   LYS  23          2HD       LYS  23   1.475  -9.462   4.101
  258   2HD   LYS  23          3HD       LYS  23   0.069  -8.670   3.396
  259   1HE   LYS  23          2HE       LYS  23  -0.048 -11.617   4.181
  260   2HE   LYS  23          3HE       LYS  23  -0.170 -10.366   5.418
  261   1HZ   LYS  23          2HZ       LYS  23  -2.024  -9.410   4.087
  262   2HZ   LYS  23          3HZ       LYS  23  -2.012 -10.757   3.156
  263   3HZ   LYS  23          1HZ       LYS  23  -2.327 -10.874   4.766
  264    QB   LYS  23           QB       LYS  23   1.621  -8.519   1.486
  265    QG   LYS  23           QG       LYS  23   0.861 -10.813   1.976
  266    QD   LYS  23           QD       LYS  23   0.772  -9.066   3.749
  267    QE   LYS  23           QE       LYS  23  -0.109 -10.991   4.800
  268    QZ   LYS  23           QZ       LYS  23  -2.121 -10.346   4.003
  269    H    VAL  24           HN       VAL  24   3.431  -7.442  -0.584
  270    HA   VAL  24           HA       VAL  24   1.937  -7.410  -3.081
  271    HB   VAL  24           HB       VAL  24   4.276  -5.784  -2.010
  272   1HG1  VAL  24          2HG1      VAL  24   2.640  -5.439  -4.544
  273   2HG1  VAL  24          3HG1      VAL  24   3.637  -4.161  -3.837
  274   3HG1  VAL  24          1HG1      VAL  24   4.399  -5.636  -4.451
  275   1HG2  VAL  24          1HG2      VAL  24   1.765  -5.649  -1.073
  276   2HG2  VAL  24          2HG2      VAL  24   2.744  -4.195  -1.383
  277   3HG2  VAL  24          3HG2      VAL  24   1.541  -4.722  -2.565
  278    QG1  VAL  24           QG1      VAL  24   3.559  -5.078  -4.278
  279    QG2  VAL  24           QG2      VAL  24   2.017  -4.855  -1.674
  280    QQG  VAL  24           QQG      VAL  24   2.788  -4.967  -2.975
  281    H    GLY  25           HN       GLY  25   5.174  -8.467  -2.075
  282   1HA   GLY  25          1HA       GLY  25   6.576  -9.971  -3.200
  283   2HA   GLY  25          2HA       GLY  25   5.625  -9.812  -4.685
  284    QA   GLY  25           QA       GLY  25   6.100  -9.892  -3.942
  285    H    THR  26           HN       THR  26   6.850  -7.218  -2.595
  286    HA   THR  26           HA       THR  26   8.889  -6.421  -4.606
  287    HB   THR  26           HB       THR  26   6.865  -5.014  -4.891
  288    HG1  THR  26          1HG       THR  26   8.741  -4.009  -5.382
  289   1HG2  THR  26          2HG2      THR  26   6.511  -5.064  -2.173
  290   2HG2  THR  26          3HG2      THR  26   7.325  -3.512  -2.352
  291   3HG2  THR  26          1HG2      THR  26   5.838  -3.827  -3.243
  292    QG2  THR  26           QG2      THR  26   6.558  -4.134  -2.590
  293    H    THR  27           HN       THR  27   9.420  -4.110  -2.805
  294    HA   THR  27           HA       THR  27  10.783  -5.496  -0.532
  295    HB   THR  27           HB       THR  27  12.706  -3.804  -1.213
  296    HG1  THR  27          1HG       THR  27  11.339  -4.212  -3.673
  297   1HG2  THR  27          2HG2      THR  27  12.130  -6.368  -2.773
  298   2HG2  THR  27          3HG2      THR  27  13.697  -5.527  -2.718
  299   3HG2  THR  27          1HG2      THR  27  13.013  -6.233  -1.237
  300    QG2  THR  27           QG2      THR  27  12.947  -6.043  -2.243
  301    H    GLN  28           HN       GLN  28  11.011  -4.233   1.307
  302    HA   GLN  28           HA       GLN  28   9.011  -2.455   1.935
  303   1HB   GLN  28          2HB       GLN  28  10.331  -3.592   3.590
  304   2HB   GLN  28          3HB       GLN  28  11.786  -2.664   3.174
  305   1HG   GLN  28          2HG       GLN  28  10.805  -0.605   3.979
  306   2HG   GLN  28          3HG       GLN  28   9.204  -1.346   4.098
  307   1HE2  GLN  28          2HE2      GLN  28  10.384  -1.174   7.552
  308   2HE2  GLN  28          1HE2      GLN  28   9.764  -0.114   6.293
  309    QB   GLN  28           QB       GLN  28  11.059  -3.128   3.382
  310    QG   GLN  28           QG       GLN  28  10.005  -0.976   4.038
  311    QE2  GLN  28           QE2      GLN  28  10.074  -0.644   6.923
  312    H    GLN  29           HN       GLN  29  12.158  -1.645   0.487
  313    HA   GLN  29           HA       GLN  29  12.205   1.101   0.679
  314   1HB   GLN  29          2HB       GLN  29  13.524   1.089  -1.286
  315   2HB   GLN  29          3HB       GLN  29  13.868  -0.418  -0.429
  316   1HG   GLN  29          2HG       GLN  29  12.408  -1.618  -2.021
  317   2HG   GLN  29          3HG       GLN  29  12.119  -0.125  -2.915
  318   1HE2  GLN  29          2HE2      GLN  29  15.147   0.044  -4.593
  319   2HE2  GLN  29          1HE2      GLN  29  13.710   0.928  -4.081
  320    QB   GLN  29           QB       GLN  29  13.696   0.335  -0.857
  321    QG   GLN  29           QG       GLN  29  12.263  -0.871  -2.468
  322    QE2  GLN  29           QE2      GLN  29  14.429   0.486  -4.337
  323    H    SER  30           HN       SER  30  10.314  -0.849  -1.608
  324    HA   SER  30           HA       SER  30   9.328   1.387  -3.143
  325   1HB   SER  30          2HB       SER  30   8.276  -1.456  -2.955
  326   2HB   SER  30          3HB       SER  30   7.919  -0.281  -4.230
  327    HG   SER  30           HG       SER  30  10.168  -0.254  -4.716
  328    QB   SER  30           QB       SER  30   8.098  -0.868  -3.592
  329    H    ILE  31           HN       ILE  31   8.186  -0.466  -0.361
  330    HA   ILE  31           HA       ILE  31   5.510   0.627  -0.321
  331    HB   ILE  31           HB       ILE  31   7.106  -0.606   1.956
  332   1HG1  ILE  31          2HG1      ILE  31   7.198  -2.240   0.231
  333   2HG1  ILE  31          3HG1      ILE  31   5.918  -2.715   1.314
  334   1HG2  ILE  31          2HG2      ILE  31   5.082   0.618   2.628
  335   2HG2  ILE  31          3HG2      ILE  31   4.106  -0.343   1.510
  336   3HG2  ILE  31          1HG2      ILE  31   4.923  -1.117   2.887
  337   1HD1  ILE  31          2HD1      ILE  31   4.279  -1.613  -0.374
  338   2HD1  ILE  31          3HD1      ILE  31   5.668  -1.503  -1.470
  339   3HD1  ILE  31          1HD1      ILE  31   5.108  -3.078  -0.910
  340    QG1  ILE  31           QG1      ILE  31   6.558  -2.478   0.773
  341    QG2  ILE  31           QG2      ILE  31   4.703  -0.281   2.342
  342    QD1  ILE  31           QD1      ILE  31   5.018  -2.064  -0.918
  343    H    GLU  32           HN       GLU  32   8.504   1.301   1.577
  344    HA   GLU  32           HA       GLU  32   7.590   3.592   2.909
  345   1HB   GLU  32          2HB       GLU  32   9.664   2.597   3.512
  346   2HB   GLU  32          3HB       GLU  32  10.383   2.873   1.919
  347   1HG   GLU  32          2HG       GLU  32  10.676   5.165   2.280
  348   2HG   GLU  32          3HG       GLU  32   9.326   5.282   3.417
  349    QB   GLU  32           QB       GLU  32  10.023   2.736   2.716
  350    QG   GLU  32           QG       GLU  32  10.001   5.224   2.848
  351    H    GLN  33           HN       GLN  33   9.252   3.389  -0.298
  352    HA   GLN  33           HA       GLN  33   9.026   6.095  -0.974
  353   1HB   GLN  33          2HB       GLN  33   9.163   3.539  -2.558
  354   2HB   GLN  33          3HB       GLN  33   8.923   5.051  -3.397
  355   1HG   GLN  33          2HG       GLN  33  10.968   5.997  -2.331
  356   2HG   GLN  33          3HG       GLN  33  11.209   4.509  -1.432
  357   1HE2  GLN  33          2HE2      GLN  33  12.289   2.609  -4.277
  358   2HE2  GLN  33          1HE2      GLN  33  11.532   2.532  -2.672
  359    QB   GLN  33           QB       GLN  33   9.043   4.296  -2.977
  360    QG   GLN  33           QG       GLN  33  11.089   5.253  -1.882
  361    QE2  GLN  33           QE2      GLN  33  11.910   2.571  -3.474
  362    H    LEU  34           HN       LEU  34   6.488   3.569  -1.339
  363    HA   LEU  34           HA       LEU  34   4.640   5.333  -2.632
  364   1HB   LEU  34          2HB       LEU  34   4.402   2.928  -2.735
  365   2HB   LEU  34          3HB       LEU  34   4.158   2.816  -0.993
  366    HG   LEU  34           HG       LEU  34   2.052   4.063  -1.167
  367   1HD1  LEU  34          3HD1      LEU  34   2.739   4.180  -4.134
  368   2HD1  LEU  34          1HD1      LEU  34   1.105   4.460  -3.496
  369   3HD1  LEU  34          2HD1      LEU  34   2.426   5.552  -3.054
  370   1HD2  LEU  34          2HD2      LEU  34   2.096   1.584  -1.459
  371   2HD2  LEU  34          3HD2      LEU  34   0.748   2.377  -2.298
  372   3HD2  LEU  34          1HD2      LEU  34   2.163   1.827  -3.220
  373    QB   LEU  34           QB       LEU  34   4.280   2.872  -1.864
  374    QD1  LEU  34           QD1      LEU  34   2.090   4.730  -3.561
  375    QD2  LEU  34           QD2      LEU  34   1.669   1.929  -2.326
  376    QQD  LEU  34           QQD      LEU  34   1.880   3.330  -2.943
  377    H    GLU  35           HN       GLU  35   4.950   4.343   0.830
  378    HA   GLU  35           HA       GLU  35   2.962   6.118   1.818
  379   1HB   GLU  35          2HB       GLU  35   5.224   4.527   3.007
  380   2HB   GLU  35          3HB       GLU  35   4.549   5.824   3.992
  381   1HG   GLU  35          2HG       GLU  35   2.391   4.890   4.024
  382   2HG   GLU  35          3HG       GLU  35   2.709   3.817   2.666
  383    QB   GLU  35           QB       GLU  35   4.887   5.176   3.500
  384    QG   GLU  35           QG       GLU  35   2.550   4.354   3.346
  385    H    ASN  36           HN       ASN  36   6.291   6.716   0.877
  386    HA   ASN  36           HA       ASN  36   6.480   9.354   2.025
  387   1HB   ASN  36          2HB       ASN  36   8.363   7.761   1.351
  388   2HB   ASN  36          3HB       ASN  36   8.042   8.229  -0.331
  389   1HD2  ASN  36          2HD2      ASN  36  10.819  10.329   0.609
  390   2HD2  ASN  36          1HD2      ASN  36  10.431   8.733  -0.003
  391    QB   ASN  36           QB       ASN  36   8.203   7.995   0.510
  392    QD2  ASN  36           QD2      ASN  36  10.625   9.531   0.302
  393    H    GLY  37           HN       GLY  37   4.599   8.183  -0.580
  394   1HA   GLY  37          1HA       GLY  37   3.258   9.231  -2.066
  395   2HA   GLY  37          2HA       GLY  37   3.549  10.725  -1.148
  396    QA   GLY  37           QA       GLY  37   3.404   9.978  -1.607
  397    H    LYS  38           HN       LYS  38   6.078   8.837  -2.815
  398    HA   LYS  38           HA       LYS  38   6.847  11.253  -4.256
  399   1HB   LYS  38          2HB       LYS  38   8.823  10.207  -4.787
  400   2HB   LYS  38          3HB       LYS  38   8.430   9.603  -3.173
  401   1HG   LYS  38          2HG       LYS  38   7.466   7.531  -4.239
  402   2HG   LYS  38          3HG       LYS  38   8.001   8.112  -5.824
  403   1HD   LYS  38          2HD       LYS  38   9.788   7.527  -3.451
  404   2HD   LYS  38          3HD       LYS  38   9.530   6.488  -4.869
  405   1HE   LYS  38          2HE       LYS  38  10.336   8.955  -5.981
  406   2HE   LYS  38          3HE       LYS  38  11.335   8.781  -4.530
  407   1HZ   LYS  38          1HZ       LYS  38  11.886   6.521  -5.378
  408   2HZ   LYS  38          2HZ       LYS  38  11.092   6.882  -6.767
  409   3HZ   LYS  38          3HZ       LYS  38  12.422   7.751  -6.343
  410    QB   LYS  38           QB       LYS  38   8.626   9.906  -3.980
  411    QG   LYS  38           QG       LYS  38   7.734   7.822  -5.031
  412    QD   LYS  38           QD       LYS  38   9.658   7.008  -4.160
  413    QE   LYS  38           QE       LYS  38  10.835   8.868  -5.255
  414    QZ   LYS  38           QZ       LYS  38  11.800   7.051  -6.163
  415    H    THR  39           HN       THR  39   4.638   8.757  -5.017
  416    HA   THR  39           HA       THR  39   4.772   9.477  -7.888
  417    HB   THR  39           HB       THR  39   5.848   7.287  -7.701
  418    HG1  THR  39          1HG       THR  39   4.698   6.509  -9.360
  419   1HG2  THR  39          3HG2      THR  39   3.287   6.472  -6.266
  420   2HG2  THR  39          1HG2      THR  39   4.229   5.311  -7.204
  421   3HG2  THR  39          2HG2      THR  39   4.973   6.142  -5.831
  422    QG2  THR  39           QG2      THR  39   4.164   5.975  -6.434
  423    H    LYS  40           HN       LYS  40   2.791   9.100  -8.975
  424    HA   LYS  40           HA       LYS  40   0.392   9.718  -7.296
  425   1HB   LYS  40          2HB       LYS  40   1.130  10.205 -10.200
  426   2HB   LYS  40          3HB       LYS  40  -0.540  10.328  -9.640
  427   1HG   LYS  40          2HG       LYS  40   1.659  11.806  -8.181
  428   2HG   LYS  40          3HG       LYS  40   1.039  12.483  -9.674
  429   1HD   LYS  40          2HD       LYS  40  -1.002  11.645  -7.589
  430   2HD   LYS  40          3HD       LYS  40   0.016  13.031  -7.228
  431   1HE   LYS  40          2HE       LYS  40  -2.014  13.847  -8.248
  432   2HE   LYS  40          3HE       LYS  40  -0.639  14.165  -9.308
  433   1HZ   LYS  40          1HZ       LYS  40  -1.302  12.170 -10.555
  434   2HZ   LYS  40          2HZ       LYS  40  -2.655  12.044  -9.620
  435   3HZ   LYS  40          3HZ       LYS  40  -2.436  13.360 -10.580
  436    QB   LYS  40           QB       LYS  40   0.295  10.266  -9.920
  437    QG   LYS  40           QG       LYS  40   1.349  12.144  -8.927
  438    QD   LYS  40           QD       LYS  40  -0.493  12.338  -7.408
  439    QE   LYS  40           QE       LYS  40  -1.326  14.006  -8.778
  440    QZ   LYS  40           QZ       LYS  40  -2.130  12.525 -10.251
  441    NH1  ARG  41           NH2      ARG  41  -3.599   7.416 -10.709
  442    NH2  ARG  41           NH1      ARG  41  -4.609   7.279 -12.791
  443    H    ARG  41           HN       ARG  41   1.664   7.492  -9.780
  444    HA   ARG  41           HA       ARG  41  -0.526   5.607  -9.127
  445   1HB   ARG  41          2HB       ARG  41  -0.963   6.776 -11.344
  446   2HB   ARG  41          3HB       ARG  41   0.506   6.006 -11.939
  447   1HG   ARG  41          2HG       ARG  41  -1.069   4.434 -12.586
  448   2HG   ARG  41          3HG       ARG  41  -0.610   3.779 -11.021
  449   1HD   ARG  41          2HD       ARG  41  -2.942   3.676 -11.087
  450   2HD   ARG  41          3HD       ARG  41  -2.631   5.036 -10.029
  451    HE   ARG  41           HE       ARG  41  -3.619   4.998 -12.855
  452   1HH1  ARG  41          2HH2      ARG  41  -3.006   7.017  -9.993
  453   2HH1  ARG  41          1HH2      ARG  41  -4.017   8.317 -10.537
  454   1HH2  ARG  41          2HH1      ARG  41  -4.816   6.765 -13.636
  455   2HH2  ARG  41          1HH1      ARG  41  -4.994   8.207 -12.698
  456    QB   ARG  41           QB       ARG  41  -0.228   6.391 -11.642
  457    QG   ARG  41           QG       ARG  41  -0.840   4.107 -11.803
  458    QD   ARG  41           QD       ARG  41  -2.786   4.356 -10.558
  459    QH1  ARG  41           QH2      ARG  41  -3.511   7.667 -10.265
  460    QH2  ARG  41           QH1      ARG  41  -4.905   7.487 -13.167
  461    HA   PRO  42           HA       PRO  42   3.505   3.373  -8.826
  462   1HB   PRO  42          2HB       PRO  42   2.633   1.445  -7.056
  463   2HB   PRO  42          3HB       PRO  42   3.233   3.032  -6.539
  464   1HG   PRO  42          2HG       PRO  42   0.450   2.012  -6.597
  465   2HG   PRO  42          3HG       PRO  42   1.127   3.324  -5.621
  466   1HD   PRO  42          2HD       PRO  42  -0.335   3.515  -8.151
  467   2HD   PRO  42          3HD       PRO  42   0.249   4.856  -7.130
  468    QB   PRO  42           QB       PRO  42   2.933   2.239  -6.797
  469    QG   PRO  42           QG       PRO  42   0.788   2.667  -6.109
  470    QD   PRO  42           QD       PRO  42  -0.044   4.185  -7.640
  471    NH1  ARG  43           NH2      ARG  43   6.955  -1.778 -12.274
  472    NH2  ARG  43           NH1      ARG  43   7.649  -2.302 -14.422
  473    H    ARG  43           HN       ARG  43   3.918   1.089  -9.416
  474    HA   ARG  43           HA       ARG  43   1.993   0.193 -11.433
  475   1HB   ARG  43          2HB       ARG  43   4.657   0.184 -11.523
  476   2HB   ARG  43          3HB       ARG  43   4.465  -1.339 -10.639
  477   1HG   ARG  43          2HG       ARG  43   2.585  -1.469 -12.763
  478   2HG   ARG  43          3HG       ARG  43   3.964  -0.665 -13.490
  479   1HD   ARG  43          2HD       ARG  43   4.535  -3.198 -11.909
  480   2HD   ARG  43          3HD       ARG  43   3.544  -3.350 -13.334
  481    HE   ARG  43           HE       ARG  43   5.278  -3.082 -14.698
  482   1HH1  ARG  43          2HH2      ARG  43   6.211  -1.767 -11.595
  483   2HH1  ARG  43          1HH2      ARG  43   7.869  -1.440 -12.014
  484   1HH2  ARG  43          2HH1      ARG  43   7.455  -2.669 -15.343
  485   2HH2  ARG  43          1HH1      ARG  43   8.583  -1.973 -14.228
  486    QB   ARG  43           QB       ARG  43   4.561  -0.577 -11.081
  487    QG   ARG  43           QG       ARG  43   3.275  -1.067 -13.126
  488    QD   ARG  43           QD       ARG  43   4.039  -3.274 -12.622
  489    QH1  ARG  43           QH2      ARG  43   7.040  -1.604 -11.804
  490    QH2  ARG  43           QH1      ARG  43   8.020  -2.320 -14.786
  491    H    PHE  44           HN       PHE  44   3.032  -0.687  -8.184
  492    HA   PHE  44           HA       PHE  44   1.716  -3.323  -8.333
  493   1HB   PHE  44          2HB       PHE  44   2.733  -3.666  -6.130
  494   2HB   PHE  44          3HB       PHE  44   3.895  -3.333  -7.390
  495    HD1  PHE  44          1HD       PHE  44   5.151  -1.177  -7.435
  496    HD2  PHE  44          2HD       PHE  44   2.407  -2.121  -4.251
  497    HE1  PHE  44          1HE       PHE  44   6.025   0.730  -6.108
  498    HE2  PHE  44          2HE       PHE  44   3.393  -0.321  -2.865
  499    HZ   PHE  44           HZ       PHE  44   5.202   1.112  -3.798
  500    QB   PHE  44           QB       PHE  44   3.314  -3.499  -6.760
  501    QR   PHE  44           QR       PHE  44   4.244  -0.723  -5.165
  502    H    LEU  45           HN       LEU  45   0.196  -0.717  -8.379
  503    HA   LEU  45           HA       LEU  45  -1.067  -0.310  -5.873
  504   1HB   LEU  45          2HB       LEU  45  -1.124   1.186  -7.944
  505   2HB   LEU  45          3HB       LEU  45  -2.327   0.115  -8.585
  506    HG   LEU  45           HG       LEU  45  -3.512   0.577  -6.203
  507   1HD1  LEU  45          1HD1      LEU  45  -1.693   2.960  -6.688
  508   2HD1  LEU  45          2HD1      LEU  45  -3.240   3.225  -5.988
  509   3HD1  LEU  45          3HD1      LEU  45  -2.070   2.167  -5.159
  510   1HD2  LEU  45          3HD2      LEU  45  -4.442   0.835  -8.422
  511   2HD2  LEU  45          1HD2      LEU  45  -4.874   2.207  -7.379
  512   3HD2  LEU  45          2HD2      LEU  45  -3.603   2.389  -8.619
  513    QB   LEU  45           QB       LEU  45  -1.725   0.651  -8.265
  514    QD1  LEU  45           QD1      LEU  45  -2.335   2.784  -5.945
  515    QD2  LEU  45           QD2      LEU  45  -4.306   1.811  -8.140
  516    QQD  LEU  45           QQD      LEU  45  -3.321   2.297  -7.042
  517    HA   PRO  46           HA       PRO  46  -4.400  -3.485  -7.168
  518   1HB   PRO  46          2HB       PRO  46  -3.671  -5.496  -8.971
  519   2HB   PRO  46          3HB       PRO  46  -4.718  -4.093  -9.285
  520   1HG   PRO  46          2HG       PRO  46  -1.931  -4.530 -10.142
  521   2HG   PRO  46          3HG       PRO  46  -3.147  -3.412 -10.797
  522   1HD   PRO  46          2HD       PRO  46  -0.960  -2.789  -9.116
  523   2HD   PRO  46          3HD       PRO  46  -2.289  -1.711  -9.593
  524    QB   PRO  46           QB       PRO  46  -4.195  -4.794  -9.128
  525    QG   PRO  46           QG       PRO  46  -2.539  -3.971 -10.470
  526    QD   PRO  46           QD       PRO  46  -1.625  -2.250  -9.354
  527    H    GLU  47           HN       GLU  47  -1.057  -4.874  -7.488
  528    HA   GLU  47           HA       GLU  47  -1.406  -7.084  -5.842
  529   1HB   GLU  47          2HB       GLU  47   1.033  -5.300  -6.141
  530   2HB   GLU  47          3HB       GLU  47   0.998  -6.911  -5.394
  531   1HG   GLU  47          2HG       GLU  47   1.687  -7.515  -7.463
  532   2HG   GLU  47          3HG       GLU  47  -0.052  -7.629  -7.743
  533    QB   GLU  47           QB       GLU  47   1.016  -6.106  -5.767
  534    QG   GLU  47           QG       GLU  47   0.817  -7.572  -7.602
  535    H    LEU  48           HN       LEU  48  -0.520  -3.724  -4.814
  536    HA   LEU  48           HA       LEU  48  -0.481  -4.329  -2.003
  537   1HB   LEU  48          2HB       LEU  48   0.506  -2.286  -3.045
  538   2HB   LEU  48          3HB       LEU  48  -1.129  -1.696  -3.353
  539    HG   LEU  48           HG       LEU  48  -1.312  -2.251  -0.665
  540   1HD1  LEU  48          2HD1      LEU  48   1.082  -2.938  -0.555
  541   2HD1  LEU  48          3HD1      LEU  48   1.551  -1.295  -1.033
  542   3HD1  LEU  48          1HD1      LEU  48   0.664  -1.559   0.483
  543   1HD2  LEU  48          1HD2      LEU  48  -1.875  -0.108  -1.725
  544   2HD2  LEU  48          2HD2      LEU  48  -0.929   0.101  -0.245
  545   3HD2  LEU  48          3HD2      LEU  48  -0.150   0.293  -1.834
  546    QB   LEU  48           QB       LEU  48  -0.311  -1.991  -3.199
  547    QD1  LEU  48           QD1      LEU  48   1.099  -1.930  -0.369
  548    QD2  LEU  48           QD2      LEU  48  -0.985   0.095  -1.269
  549    QQD  LEU  48           QQD      LEU  48   0.057  -0.918  -0.819
  550    H    ALA  49           HN       ALA  49  -3.095  -3.082  -4.129
  551    HA   ALA  49           HA       ALA  49  -5.051  -2.817  -2.161
  552   1HB   ALA  49          2HB       ALA  49  -5.080  -3.153  -5.116
  553   2HB   ALA  49          3HB       ALA  49  -6.571  -3.605  -4.305
  554   3HB   ALA  49          1HB       ALA  49  -5.934  -1.981  -4.097
  555    QB   ALA  49           QB       ALA  49  -5.862  -2.914  -4.507
  556    H    SER  50           HN       SER  50  -4.285  -5.722  -4.093
  557    HA   SER  50           HA       SER  50  -6.281  -7.358  -2.811
  558   1HB   SER  50          2HB       SER  50  -5.020  -9.232  -3.926
  559   2HB   SER  50          3HB       SER  50  -5.592  -7.941  -5.002
  560    HG   SER  50           HG       SER  50  -3.523  -7.099  -5.096
  561    QB   SER  50           QB       SER  50  -5.306  -8.587  -4.464
  562    H    ALA  51           HN       ALA  51  -2.748  -7.029  -2.333
  563    HA   ALA  51           HA       ALA  51  -2.319  -8.892  -0.311
  564   1HB   ALA  51          1HB       ALA  51  -1.080  -6.186  -0.904
  565   2HB   ALA  51          2HB       ALA  51  -0.512  -7.179   0.411
  566   3HB   ALA  51          3HB       ALA  51  -0.426  -7.798  -1.263
  567    QB   ALA  51           QB       ALA  51  -0.673  -7.054  -0.585
  568    H    LEU  52           HN       LEU  52  -3.305  -5.477   0.065
  569    HA   LEU  52           HA       LEU  52  -3.576  -5.678   2.971
  570   1HB   LEU  52          2HB       LEU  52  -4.217  -3.577   0.867
  571   2HB   LEU  52          3HB       LEU  52  -4.794  -3.422   2.511
  572    HG   LEU  52           HG       LEU  52  -1.870  -3.617   1.750
  573   1HD1  LEU  52          2HD1      LEU  52  -3.671  -1.276   2.472
  574   2HD1  LEU  52          3HD1      LEU  52  -1.903  -1.197   2.548
  575   3HD1  LEU  52          1HD1      LEU  52  -2.716  -1.501   1.004
  576   1HD2  LEU  52          2HD2      LEU  52  -3.283  -3.274   4.409
  577   2HD2  LEU  52          3HD2      LEU  52  -2.034  -4.460   3.986
  578   3HD2  LEU  52          1HD2      LEU  52  -1.606  -2.762   4.179
  579    QB   LEU  52           QB       LEU  52  -4.506  -3.499   1.689
  580    QD1  LEU  52           QD1      LEU  52  -2.763  -1.324   2.008
  581    QD2  LEU  52           QD2      LEU  52  -2.308  -3.498   4.192
  582    QQD  LEU  52           QQD      LEU  52  -2.536  -2.412   3.100
  583    H    GLY  53           HN       GLY  53  -5.784  -5.595   0.168
  584   1HA   GLY  53          1HA       GLY  53  -7.824  -6.780   0.050
  585   2HA   GLY  53          2HA       GLY  53  -7.981  -6.767   1.815
  586    QA   GLY  53           QA       GLY  53  -7.902  -6.774   0.933
  587    H    VAL  54           HN       VAL  54  -7.510  -4.406  -0.853
  588    HA   VAL  54           HA       VAL  54  -9.952  -2.935  -0.104
  589    HB   VAL  54           HB       VAL  54  -8.800  -0.769  -0.400
  590   1HG1  VAL  54          2HG1      VAL  54  -9.192  -1.635   1.865
  591   2HG1  VAL  54          3HG1      VAL  54  -7.599  -2.430   1.841
  592   3HG1  VAL  54          1HG1      VAL  54  -7.708  -0.663   1.777
  593   1HG2  VAL  54          2HG2      VAL  54  -6.840  -1.508  -1.710
  594   2HG2  VAL  54          3HG2      VAL  54  -6.336  -0.614  -0.276
  595   3HG2  VAL  54          1HG2      VAL  54  -6.211  -2.373  -0.277
  596    QG1  VAL  54           QG1      VAL  54  -8.166  -1.576   1.827
  597    QG2  VAL  54           QG2      VAL  54  -6.462  -1.499  -0.755
  598    QQG  VAL  54           QQG      VAL  54  -7.314  -1.538   0.537
  599    H    SER  55           HN       SER  55 -10.431  -1.294  -1.999
  600    HA   SER  55           HA       SER  55 -10.133  -2.810  -4.490
  601   1HB   SER  55          2HB       SER  55 -11.804  -1.000  -5.217
  602   2HB   SER  55          3HB       SER  55 -12.336  -2.156  -3.983
  603    HG   SER  55           HG       SER  55 -12.809   0.015  -3.386
  604    QB   SER  55           QB       SER  55 -12.070  -1.578  -4.600
  605    H    VAL  56           HN       VAL  56  -9.159  -2.022  -6.318
  606    HA   VAL  56           HA       VAL  56  -7.005  -0.204  -6.158
  607    HB   VAL  56           HB       VAL  56  -8.620  -1.448  -8.403
  608   1HG1  VAL  56          1HG1      VAL  56  -6.578   0.757  -8.672
  609   2HG1  VAL  56          2HG1      VAL  56  -6.703  -0.511  -9.908
  610   3HG1  VAL  56          3HG1      VAL  56  -8.100   0.517  -9.538
  611   1HG2  VAL  56          1HG2      VAL  56  -6.882  -2.707  -7.013
  612   2HG2  VAL  56          2HG2      VAL  56  -6.607  -2.699  -8.762
  613   3HG2  VAL  56          3HG2      VAL  56  -5.663  -1.619  -7.711
  614    QG1  VAL  56           QG1      VAL  56  -7.127   0.254  -9.373
  615    QG2  VAL  56           QG2      VAL  56  -6.384  -2.342  -7.829
  616    QQG  VAL  56           QQG      VAL  56  -6.755  -1.044  -8.600
  617    H    ASP  57           HN       ASP  57 -10.371   0.391  -7.329
  618    HA   ASP  57           HA       ASP  57 -10.143   3.112  -7.889
  619   1HB   ASP  57          2HB       ASP  57 -12.366   1.406  -6.721
  620   2HB   ASP  57          3HB       ASP  57 -12.553   3.161  -6.817
  621    QB   ASP  57           QB       ASP  57 -12.459   2.283  -6.769
  622    CH2  TRP  58           CH2      TRP  58  -7.378   2.563   2.157
  623    H    TRP  58           HN       TRP  58 -10.476   1.577  -4.658
  624    HA   TRP  58           HA       TRP  58 -10.648   4.159  -3.320
  625   1HB   TRP  58          2HB       TRP  58 -11.689   2.208  -2.353
  626   2HB   TRP  58          3HB       TRP  58 -10.128   1.380  -2.258
  627    HD1  TRP  58           HD1      TRP  58 -12.155   4.122  -0.548
  628    HE1  TRP  58           HE1      TRP  58 -11.116   4.642   1.730
  629    HE3  TRP  58           HE3      TRP  58  -7.858   1.407  -1.016
  630    HZ2  TRP  58           HZ2      TRP  58  -8.630   3.986   3.163
  631    HZ3  TRP  58           HZ3      TRP  58  -6.194   1.362   0.832
  632    HH2  TRP  58           HH2      TRP  58  -6.576   2.621   2.876
  633    QB   TRP  58           QB       TRP  58 -10.908   1.794  -2.306
  634    H    LEU  59           HN       LEU  59  -8.054   1.874  -4.265
  635    HA   LEU  59           HA       LEU  59  -6.075   3.534  -2.962
  636   1HB   LEU  59          2HB       LEU  59  -6.016   1.228  -4.863
  637   2HB   LEU  59          3HB       LEU  59  -4.619   2.243  -4.803
  638    HG   LEU  59           HG       LEU  59  -5.803   0.718  -2.499
  639   1HD1  LEU  59          3HD1      LEU  59  -4.416  -0.447  -4.311
  640   2HD1  LEU  59          1HD1      LEU  59  -3.038   0.495  -3.737
  641   3HD1  LEU  59          2HD1      LEU  59  -3.857  -0.644  -2.640
  642   1HD2  LEU  59          1HD2      LEU  59  -3.605   2.818  -2.551
  643   2HD2  LEU  59          2HD2      LEU  59  -4.910   2.608  -1.357
  644   3HD2  LEU  59          3HD2      LEU  59  -3.551   1.495  -1.373
  645    QB   LEU  59           QB       LEU  59  -5.317   1.735  -4.832
  646    QD1  LEU  59           QD1      LEU  59  -3.771  -0.198  -3.563
  647    QD2  LEU  59           QD2      LEU  59  -4.022   2.307  -1.760
  648    QQD  LEU  59           QQD      LEU  59  -3.896   1.054  -2.661
  649    H    LEU  60           HN       LEU  60  -7.716   3.902  -6.060
  650    HA   LEU  60           HA       LEU  60  -5.829   5.953  -6.960
  651   1HB   LEU  60          2HB       LEU  60  -8.561   5.122  -7.993
  652   2HB   LEU  60          3HB       LEU  60  -7.513   6.297  -8.785
  653    HG   LEU  60           HG       LEU  60  -6.603   3.456  -8.218
  654   1HD1  LEU  60          1HD1      LEU  60  -8.047   4.569 -10.647
  655   2HD1  LEU  60          2HD1      LEU  60  -7.155   3.031 -10.637
  656   3HD1  LEU  60          3HD1      LEU  60  -8.570   3.242  -9.593
  657   1HD2  LEU  60          3HD2      LEU  60  -4.863   5.267  -8.780
  658   2HD2  LEU  60          1HD2      LEU  60  -4.928   3.859  -9.844
  659   3HD2  LEU  60          2HD2      LEU  60  -5.680   5.384 -10.351
  660    QB   LEU  60           QB       LEU  60  -8.038   5.709  -8.389
  661    QD1  LEU  60           QD1      LEU  60  -7.924   3.613 -10.292
  662    QD2  LEU  60           QD2      LEU  60  -5.157   4.836  -9.658
  663    QQD  LEU  60           QQD      LEU  60  -6.540   4.225  -9.975
  664    H    ASN  61           HN       ASN  61  -9.293   6.111  -6.080
  665    HA   ASN  61           HA       ASN  61  -9.062   8.991  -5.473
  666   1HB   ASN  61          2HB       ASN  61 -11.450   8.836  -4.810
  667   2HB   ASN  61          3HB       ASN  61 -11.076   8.555  -6.509
  668   1HD2  ASN  61          2HD2      ASN  61 -12.485   5.336  -6.590
  669   2HD2  ASN  61          1HD2      ASN  61 -11.823   6.688  -7.468
  670    QB   ASN  61           QB       ASN  61 -11.263   8.697  -5.660
  671    QD2  ASN  61           QD2      ASN  61 -12.154   6.012  -7.029
  672    H    GLY  62           HN       GLY  62 -10.085   6.104  -3.427
  673   1HA   GLY  62          1HA       GLY  62  -9.581   5.752  -1.184
  674   2HA   GLY  62          2HA       GLY  62  -8.217   6.847  -1.422
  675    QA   GLY  62           QA       GLY  62  -8.899   6.300  -1.303
  676    H    THR  63           HN       THR  63 -11.491   6.467  -0.464
  677    HA   THR  63           HA       THR  63 -12.784   7.470   1.051
  678    HB   THR  63           HB       THR  63 -12.061   8.889   2.712
  679    HG1  THR  63          1HG       THR  63 -10.298   9.905   0.822
  680   1HG2  THR  63          3HG2      THR  63 -10.729   6.694   2.612
  681   2HG2  THR  63          1HG2      THR  63  -9.376   7.656   1.976
  682   3HG2  THR  63          2HG2      THR  63 -10.031   8.012   3.570
  683    QG2  THR  63           QG2      THR  63 -10.046   7.453   2.719
  684    H    SER  64           HN       SER  64 -14.487   8.307  -0.064
  685    HA   SER  64           HA       SER  64 -14.186  10.924  -1.416
  686   1HB   SER  64          2HB       SER  64 -13.939   9.128  -3.153
  687   2HB   SER  64          3HB       SER  64 -15.519   8.473  -2.667
  688    HG   SER  64           HG       SER  64 -16.477  10.395  -3.324
  689    QB   SER  64           QB       SER  64 -14.729   8.800  -2.910
  690    H    ASP  65           HN       ASP  65 -16.119  12.109  -1.320
  691    HA   ASP  65           HA       ASP  65 -17.855  11.504   0.860
  692   1HB   ASP  65          2HB       ASP  65 -17.260  13.810  -0.309
  693   2HB   ASP  65          3HB       ASP  65 -18.670  13.434  -1.310
  694    QB   ASP  65           QB       ASP  65 -17.965  13.623  -0.809
  695    H    SER  66           HN       SER  66 -20.323  11.651   0.380
  696    HA   SER  66           HA       SER  66 -22.154  10.381  -0.045
  697   1HB   SER  66          2HB       SER  66 -20.977   9.999  -2.828
  698   2HB   SER  66          3HB       SER  66 -22.659   9.781  -2.338
  699    HG   SER  66           HG       SER  66 -21.977  12.174  -1.488
  700    QB   SER  66           QB       SER  66 -21.818   9.889  -2.582
  701    H    ASN  67           HN       ASN  67 -21.989   8.685   1.350
  702    HA   ASN  67           HA       ASN  67 -21.514   6.059   0.279
  703   1HB   ASN  67          2HB       ASN  67 -19.680   5.478   1.938
  704   2HB   ASN  67          3HB       ASN  67 -19.190   6.412   0.526
  705   1HD2  ASN  67          2HD2      ASN  67 -18.066   9.194   2.445
  706   2HD2  ASN  67          1HD2      ASN  67 -18.132   8.485   0.860
  707    QB   ASN  67           QB       ASN  67 -19.435   5.945   1.232
  708    QD2  ASN  67           QD2      ASN  67 -18.099   8.839   1.652
  709    H    VAL  68           HN       VAL  68 -21.414   7.779   3.455
  710    HA   VAL  68           HA       VAL  68 -23.565   5.991   4.439
  711    HB   VAL  68           HB       VAL  68 -21.527   6.166   5.698
  712   1HG1  VAL  68          2HG1      VAL  68 -20.827   8.520   5.266
  713   2HG1  VAL  68          3HG1      VAL  68 -22.141   9.102   6.277
  714   3HG1  VAL  68          1HG1      VAL  68 -20.862   8.113   6.980
  715   1HG2  VAL  68          1HG2      VAL  68 -24.016   6.056   6.721
  716   2HG2  VAL  68          2HG2      VAL  68 -22.546   5.983   7.706
  717   3HG2  VAL  68          3HG2      VAL  68 -23.434   7.509   7.553
  718    QG1  VAL  68           QG1      VAL  68 -21.276   8.578   6.174
  719    QG2  VAL  68           QG2      VAL  68 -23.332   6.516   7.326
  720    QQG  VAL  68           QQG      VAL  68 -22.304   7.547   6.751
  721    NH1  ARG  69           NH2      ARG  69 -24.351  12.643   0.941
  722    NH2  ARG  69           NH1      ARG  69 -25.306  14.703   1.389
  723    H    ARG  69           HN       ARG  69 -24.950   7.177   2.739
  724    HA   ARG  69           HA       ARG  69 -26.219   9.578   3.972
  725   1HB   ARG  69          2HB       ARG  69 -25.074  10.098   1.813
  726   2HB   ARG  69          3HB       ARG  69 -26.083   8.872   1.015
  727   1HG   ARG  69          2HG       ARG  69 -28.108  10.065   1.568
  728   2HG   ARG  69          3HG       ARG  69 -27.247  11.221   2.579
  729   1HD   ARG  69          2HD       ARG  69 -26.276  11.095  -0.263
  730   2HD   ARG  69          3HD       ARG  69 -27.955  11.552  -0.072
  731    HE   ARG  69           HE       ARG  69 -27.461  13.521   0.912
  732   1HH1  ARG  69          2HH2      ARG  69 -24.475  11.673   0.701
  733   2HH1  ARG  69          1HH2      ARG  69 -23.418  12.993   1.117
  734   1HH2  ARG  69          2HH1      ARG  69 -26.117  15.299   1.480
  735   2HH2  ARG  69          1HH1      ARG  69 -24.396  15.103   1.568
  736    QB   ARG  69           QB       ARG  69 -25.579   9.486   1.414
  737    QG   ARG  69           QG       ARG  69 -27.677  10.643   2.074
  738    QD   ARG  69           QD       ARG  69 -27.116  11.324  -0.168
  739    QH1  ARG  69           QH2      ARG  69 -23.946  12.333   0.909
  740    QH2  ARG  69           QH1      ARG  69 -25.257  15.201   1.524
   
  Start of MODEL           4
 Raw file had 740 H/Q atoms
  Start of MODEL    4
    1    H    SER   1           HN       SER   1  -4.964  11.278   4.380
    2    HA   SER   1           HA       SER   1  -4.277  10.818   2.054
    3   1HB   SER   1          2HB       SER   1  -2.062  10.483   4.128
    4   2HB   SER   1          3HB       SER   1  -1.918  11.202   2.504
    5    HG   SER   1           HG       SER   1  -2.334  12.867   3.995
    6    QB   SER   1           QB       SER   1  -1.990  10.843   3.315
    7    H    ILE   2           HN       ILE   2  -2.674   9.473   0.766
    8    HA   ILE   2           HA       ILE   2  -3.453   6.750   0.732
    9    HB   ILE   2           HB       ILE   2  -2.807   7.522  -1.314
   10   1HG1  ILE   2          2HG1      ILE   2  -0.735   6.361  -2.022
   11   2HG1  ILE   2          3HG1      ILE   2  -0.340   6.018  -0.336
   12   1HG2  ILE   2          3HG2      ILE   2  -0.379   8.849  -0.077
   13   2HG2  ILE   2          1HG2      ILE   2  -0.586   8.619  -1.815
   14   3HG2  ILE   2          2HG2      ILE   2  -1.753   9.587  -0.936
   15   1HD1  ILE   2          2HD1      ILE   2  -2.640   4.831  -0.223
   16   2HD1  ILE   2          3HD1      ILE   2  -2.737   5.095  -1.967
   17   3HD1  ILE   2          1HD1      ILE   2  -1.437   4.093  -1.299
   18    QG1  ILE   2           QG1      ILE   2  -0.537   6.190  -1.180
   19    QG2  ILE   2           QG2      ILE   2  -0.906   9.018  -0.943
   20    QD1  ILE   2           QD1      ILE   2  -2.272   4.673  -1.163
   21    H    SER   3           HN       SER   3  -0.327   8.157   1.772
   22    HA   SER   3           HA       SER   3   0.908   6.036   2.958
   23   1HB   SER   3          2HB       SER   3   1.936   8.183   2.969
   24   2HB   SER   3          3HB       SER   3   0.622   8.931   3.875
   25    HG   SER   3           HG       SER   3   2.637   8.275   5.045
   26    QB   SER   3           QB       SER   3   1.279   8.557   3.422
   27    H    SER   4           HN       SER   4  -1.478   8.117   4.698
   28    HA   SER   4           HA       SER   4  -1.530   6.491   7.007
   29   1HB   SER   4          2HB       SER   4  -3.622   7.712   7.560
   30   2HB   SER   4          3HB       SER   4  -2.276   8.772   7.118
   31    HG   SER   4           HG       SER   4  -4.045   7.896   5.119
   32    QB   SER   4           QB       SER   4  -2.949   8.242   7.339
   33    NH1  ARG   5           NH2      ARG   5  -7.176   8.615   1.864
   34    NH2  ARG   5           NH1      ARG   5  -5.810   9.061   0.044
   35    H    ARG   5           HN       ARG   5  -3.428   6.236   3.944
   36    HA   ARG   5           HA       ARG   5  -5.336   4.344   5.022
   37   1HB   ARG   5          2HB       ARG   5  -4.396   4.941   2.190
   38   2HB   ARG   5          3HB       ARG   5  -5.391   3.648   2.527
   39   1HG   ARG   5          2HG       ARG   5  -7.082   5.177   3.549
   40   2HG   ARG   5          3HG       ARG   5  -5.985   6.537   3.385
   41   1HD   ARG   5          2HD       ARG   5  -6.714   4.897   0.931
   42   2HD   ARG   5          3HD       ARG   5  -7.865   6.052   1.559
   43    HE   ARG   5           HE       ARG   5  -5.462   6.563   0.053
   44   1HH1  ARG   5          2HH2      ARG   5  -7.627   7.912   2.437
   45   2HH1  ARG   5          1HH2      ARG   5  -7.579   9.539   1.844
   46   1HH2  ARG   5          2HH1      ARG   5  -5.278   8.719  -0.747
   47   2HH2  ARG   5          1HH1      ARG   5  -6.118  10.023   0.009
   48    QB   ARG   5           QB       ARG   5  -4.893   4.295   2.359
   49    QG   ARG   5           QG       ARG   5  -6.534   5.857   3.467
   50    QD   ARG   5           QD       ARG   5  -7.289   5.475   1.245
   51    QH1  ARG   5           QH2      ARG   5  -7.603   8.726   2.140
   52    QH2  ARG   5           QH1      ARG   5  -5.698   9.371  -0.369
   53    H    VAL   6           HN       VAL   6  -2.372   3.908   3.029
   54    HA   VAL   6           HA       VAL   6  -2.389   1.099   3.112
   55    HB   VAL   6           HB       VAL   6  -0.088   3.081   2.817
   56   1HG1  VAL   6          2HG1      VAL   6  -0.132   0.065   2.395
   57   2HG1  VAL   6          3HG1      VAL   6   1.104   1.156   1.714
   58   3HG1  VAL   6          1HG1      VAL   6   0.888   1.051   3.461
   59   1HG2  VAL   6          3HG2      VAL   6  -1.851   1.551   0.875
   60   2HG2  VAL   6          1HG2      VAL   6  -1.737   3.298   1.067
   61   3HG2  VAL   6          2HG2      VAL   6  -0.364   2.412   0.389
   62    QG1  VAL   6           QG1      VAL   6   0.619   0.757   2.523
   63    QG2  VAL   6           QG2      VAL   6  -1.318   2.420   0.777
   64    QQG  VAL   6           QQG      VAL   6  -0.349   1.589   1.650
   65    H    LYS   7           HN       LYS   7  -0.630   3.379   5.252
   66    HA   LYS   7           HA       LYS   7   0.434   1.372   6.925
   67   1HB   LYS   7          2HB       LYS   7   1.062   3.873   6.636
   68   2HB   LYS   7          3HB       LYS   7  -0.184   4.182   7.840
   69   1HG   LYS   7          2HG       LYS   7   1.261   2.202   9.117
   70   2HG   LYS   7          3HG       LYS   7   2.503   2.832   8.025
   71   1HD   LYS   7          2HD       LYS   7   2.809   4.117   9.942
   72   2HD   LYS   7          3HD       LYS   7   1.860   5.177   8.882
   73   1HE   LYS   7          2HE       LYS   7  -0.245   4.323  10.107
   74   2HE   LYS   7          3HE       LYS   7   0.835   3.424  11.183
   75   1HZ   LYS   7          1HZ       LYS   7   1.797   5.512  11.865
   76   2HZ   LYS   7          2HZ       LYS   7   0.759   6.347  10.893
   77   3HZ   LYS   7          3HZ       LYS   7   0.181   5.468  12.156
   78    QB   LYS   7           QB       LYS   7   0.438   4.028   7.238
   79    QG   LYS   7           QG       LYS   7   1.882   2.517   8.570
   80    QD   LYS   7           QD       LYS   7   2.335   4.647   9.412
   81    QE   LYS   7           QE       LYS   7   0.295   3.875  10.645
   82    QZ   LYS   7           QZ       LYS   7   0.913   5.776  11.638
   83    H    SER   8           HN       SER   8  -2.534   3.388   7.480
   84    HA   SER   8           HA       SER   8  -3.207   2.275   9.993
   85   1HB   SER   8          2HB       SER   8  -5.125   3.313   7.861
   86   2HB   SER   8          3HB       SER   8  -5.498   3.009   9.561
   87    HG   SER   8           HG       SER   8  -3.808   4.944   8.459
   88    QB   SER   8           QB       SER   8  -5.311   3.161   8.711
   89    H    LYS   9           HN       LYS   9  -4.111   1.285   6.662
   90    HA   LYS   9           HA       LYS   9  -5.858  -0.809   7.443
   91   1HB   LYS   9          2HB       LYS   9  -5.452   0.325   5.100
   92   2HB   LYS   9          3HB       LYS   9  -4.164  -0.849   4.933
   93   1HG   LYS   9          2HG       LYS   9  -6.084  -1.836   3.929
   94   2HG   LYS   9          3HG       LYS   9  -6.067  -2.597   5.521
   95   1HD   LYS   9          2HD       LYS   9  -7.520  -0.144   5.801
   96   2HD   LYS   9          3HD       LYS   9  -8.008  -0.784   4.229
   97   1HE   LYS   9          2HE       LYS   9  -8.744  -2.884   5.242
   98   2HE   LYS   9          3HE       LYS   9  -8.039  -2.430   6.807
   99   1HZ   LYS   9          1HZ       LYS   9  -9.604  -0.594   6.891
  100   2HZ   LYS   9          2HZ       LYS   9 -10.315  -1.100   5.497
  101   3HZ   LYS   9          3HZ       LYS   9 -10.361  -2.053   6.838
  102    QB   LYS   9           QB       LYS   9  -4.808  -0.262   5.016
  103    QG   LYS   9           QG       LYS   9  -6.076  -2.217   4.725
  104    QD   LYS   9           QD       LYS   9  -7.764  -0.465   5.016
  105    QE   LYS   9           QE       LYS   9  -8.392  -2.657   6.024
  106    QZ   LYS   9           QZ       LYS   9 -10.093  -1.248   6.409
  107    NH1  ARG  10           NH2      ARG  10   2.087  -1.001   4.335
  108    NH2  ARG  10           NH1      ARG  10   2.580   0.992   5.431
  109    H    ARG  10           HN       ARG  10  -2.344  -0.740   6.684
  110    HA   ARG  10           HA       ARG  10  -1.673  -3.397   7.127
  111   1HB   ARG  10          2HB       ARG  10  -0.261  -0.983   6.775
  112   2HB   ARG  10          3HB       ARG  10   0.261  -1.524   8.367
  113   1HG   ARG  10          2HG       ARG  10   0.641  -3.832   7.222
  114   2HG   ARG  10          3HG       ARG  10   0.440  -2.936   5.716
  115   1HD   ARG  10          2HD       ARG  10   2.512  -2.607   7.866
  116   2HD   ARG  10          3HD       ARG  10   2.773  -3.021   6.159
  117    HE   ARG  10           HE       ARG  10   2.875  -0.497   7.390
  118   1HH1  ARG  10          2HH2      ARG  10   1.896  -1.989   4.385
  119   2HH1  ARG  10          1HH2      ARG  10   2.056  -0.536   3.438
  120   1HH2  ARG  10          2HH1      ARG  10   2.735   1.515   6.276
  121   2HH2  ARG  10          1HH1      ARG  10   2.621   1.548   4.562
  122    QB   ARG  10           QB       ARG  10   0.000  -1.254   7.571
  123    QG   ARG  10           QG       ARG  10   0.540  -3.384   6.469
  124    QD   ARG  10           QD       ARG  10   2.643  -2.814   7.013
  125    QH1  ARG  10           QH2      ARG  10   1.977  -1.263   3.911
  126    QH2  ARG  10           QH1      ARG  10   2.678   1.532   5.419
  127    H    ILE  11           HN       ILE  11  -1.927  -0.764   9.493
  128    HA   ILE  11           HA       ILE  11  -1.262  -2.226  11.822
  129    HB   ILE  11           HB       ILE  11  -2.542   0.378  11.169
  130   1HG1  ILE  11          2HG1      ILE  11  -1.194   0.980  13.245
  131   2HG1  ILE  11          3HG1      ILE  11  -0.511  -0.643  13.174
  132   1HG2  ILE  11          1HG2      ILE  11  -3.295  -0.936  13.793
  133   2HG2  ILE  11          2HG2      ILE  11  -3.392   0.804  13.455
  134   3HG2  ILE  11          3HG2      ILE  11  -4.388  -0.297  12.536
  135   1HD1  ILE  11          1HD1      ILE  11  -0.441   1.499  11.002
  136   2HD1  ILE  11          2HD1      ILE  11   0.926   0.993  12.018
  137   3HD1  ILE  11          3HD1      ILE  11   0.255  -0.127  10.814
  138    QG1  ILE  11           QG1      ILE  11  -0.853   0.168  13.210
  139    QG2  ILE  11           QG2      ILE  11  -3.692  -0.143  13.262
  140    QD1  ILE  11           QD1      ILE  11   0.246   0.789  11.278
  141    H    GLN  12           HN       GLN  12  -4.508  -1.511  10.499
  142    HA   GLN  12           HA       GLN  12  -5.823  -3.069  12.425
  143   1HB   GLN  12          2HB       GLN  12  -6.669  -1.472  10.296
  144   2HB   GLN  12          3HB       GLN  12  -7.195  -3.075   9.789
  145   1HG   GLN  12          2HG       GLN  12  -7.949  -2.930  12.528
  146   2HG   GLN  12          3HG       GLN  12  -8.226  -1.303  11.915
  147   1HE2  GLN  12          2HE2      GLN  12 -10.810  -2.458   9.636
  148   2HE2  GLN  12          1HE2      GLN  12  -9.449  -1.320   9.680
  149    QB   GLN  12           QB       GLN  12  -6.932  -2.273  10.042
  150    QG   GLN  12           QG       GLN  12  -8.087  -2.117  12.221
  151    QE2  GLN  12           QE2      GLN  12 -10.130  -1.889   9.658
  152    H    LEU  13           HN       LEU  13  -4.519  -4.045   9.303
  153    HA   LEU  13           HA       LEU  13  -5.281  -6.820   9.342
  154   1HB   LEU  13          2HB       LEU  13  -3.181  -5.121   8.008
  155   2HB   LEU  13          3HB       LEU  13  -3.021  -6.859   7.912
  156    HG   LEU  13           HG       LEU  13  -5.707  -5.635   7.255
  157   1HD1  LEU  13          2HD1      LEU  13  -3.305  -5.630   5.402
  158   2HD1  LEU  13          3HD1      LEU  13  -4.993  -5.288   4.934
  159   3HD1  LEU  13          1HD1      LEU  13  -4.153  -4.220   6.053
  160   1HD2  LEU  13          3HD2      LEU  13  -4.498  -8.255   7.032
  161   2HD2  LEU  13          1HD2      LEU  13  -6.118  -7.743   6.544
  162   3HD2  LEU  13          2HD2      LEU  13  -4.780  -7.647   5.392
  163    QB   LEU  13           QB       LEU  13  -3.101  -5.991   7.960
  164    QD1  LEU  13           QD1      LEU  13  -4.150  -5.046   5.463
  165    QD2  LEU  13           QD2      LEU  13  -5.133  -7.882   6.323
  166    QQD  LEU  13           QQD      LEU  13  -4.641  -6.463   5.893
  167    H    GLY  14           HN       GLY  14  -2.563  -5.030  10.811
  168   1HA   GLY  14          1HA       GLY  14  -1.374  -5.639  12.706
  169   2HA   GLY  14          2HA       GLY  14  -2.053  -7.273  12.649
  170    QA   GLY  14           QA       GLY  14  -1.714  -6.456  12.677
  171    H    LEU  15           HN       LEU  15  -0.318  -5.336  10.157
  172    HA   LEU  15           HA       LEU  15   1.921  -7.327  10.133
  173   1HB   LEU  15          2HB       LEU  15   0.344  -6.243   7.773
  174   2HB   LEU  15          3HB       LEU  15   1.806  -7.223   7.624
  175    HG   LEU  15           HG       LEU  15  -0.685  -8.234   9.045
  176   1HD1  LEU  15          1HD1      LEU  15  -0.419  -7.719   6.239
  177   2HD1  LEU  15          2HD1      LEU  15  -0.407  -9.478   6.491
  178   3HD1  LEU  15          3HD1      LEU  15  -1.744  -8.514   7.119
  179   1HD2  LEU  15          2HD2      LEU  15   1.402  -9.483   9.526
  180   2HD2  LEU  15          3HD2      LEU  15   0.239 -10.448   8.613
  181   3HD2  LEU  15          1HD2      LEU  15   1.633  -9.736   7.781
  182    QB   LEU  15           QB       LEU  15   1.075  -6.733   7.698
  183    QD1  LEU  15           QD1      LEU  15  -0.857  -8.571   6.617
  184    QD2  LEU  15           QD2      LEU  15   1.091  -9.890   8.640
  185    QQD  LEU  15           QQD      LEU  15   0.117  -9.230   7.628
  186    H    ASN  16           HN       ASN  16   3.894  -6.428   9.341
  187    HA   ASN  16           HA       ASN  16   4.018  -3.450   9.629
  188   1HB   ASN  16          2HB       ASN  16   6.414  -3.674   9.801
  189   2HB   ASN  16          3HB       ASN  16   5.585  -4.651  11.018
  190   1HD2  ASN  16          2HD2      ASN  16   8.278  -6.805   9.692
  191   2HD2  ASN  16          1HD2      ASN  16   8.172  -5.362  10.683
  192    QB   ASN  16           QB       ASN  16   6.000  -4.162  10.409
  193    QD2  ASN  16           QD2      ASN  16   8.224  -6.084  10.187
  194    H    GLN  17           HN       GLN  17   5.548  -2.305   8.133
  195    HA   GLN  17           HA       GLN  17   4.700  -2.354   5.437
  196   1HB   GLN  17          2HB       GLN  17   7.069  -1.245   6.884
  197   2HB   GLN  17          3HB       GLN  17   6.972  -1.139   5.106
  198   1HG   GLN  17          2HG       GLN  17   5.028   0.204   5.227
  199   2HG   GLN  17          3HG       GLN  17   4.851  -0.077   6.986
  200   1HE2  GLN  17          2HE2      GLN  17   6.962   3.089   5.872
  201   2HE2  GLN  17          1HE2      GLN  17   5.665   2.387   4.931
  202    QB   GLN  17           QB       GLN  17   7.021  -1.192   5.995
  203    QG   GLN  17           QG       GLN  17   4.940   0.063   6.107
  204    QE2  GLN  17           QE2      GLN  17   6.313   2.738   5.402
  205    H    ALA  18           HN       ALA  18   7.317  -4.160   7.000
  206    HA   ALA  18           HA       ALA  18   8.540  -5.133   4.626
  207   1HB   ALA  18          3HB       ALA  18   9.436  -5.032   7.041
  208   2HB   ALA  18          1HB       ALA  18   8.555  -6.548   7.303
  209   3HB   ALA  18          2HB       ALA  18   9.832  -6.460   6.070
  210    QB   ALA  18           QB       ALA  18   9.274  -6.013   6.805
  211    H    GLU  19           HN       GLU  19   6.147  -6.715   6.860
  212    HA   GLU  19           HA       GLU  19   5.820  -9.086   5.299
  213   1HB   GLU  19          2HB       GLU  19   4.103  -7.653   7.355
  214   2HB   GLU  19          3HB       GLU  19   3.532  -9.091   6.502
  215   1HG   GLU  19          2HG       GLU  19   5.391 -10.423   7.316
  216   2HG   GLU  19          3HG       GLU  19   6.079  -9.021   8.158
  217    QB   GLU  19           QB       GLU  19   3.818  -8.371   6.929
  218    QG   GLU  19           QG       GLU  19   5.735  -9.723   7.737
  219    H    LEU  20           HN       LEU  20   4.081  -5.922   5.361
  220    HA   LEU  20           HA       LEU  20   2.194  -6.759   3.407
  221   1HB   LEU  20          2HB       LEU  20   1.987  -4.680   4.805
  222   2HB   LEU  20          3HB       LEU  20   3.142  -3.897   3.704
  223    HG   LEU  20           HG       LEU  20   1.290  -5.234   2.012
  224   1HD1  LEU  20          2HD1      LEU  20  -0.110  -5.444   4.178
  225   2HD1  LEU  20          3HD1      LEU  20  -0.434  -3.721   3.915
  226   3HD1  LEU  20          1HD1      LEU  20  -0.869  -4.901   2.670
  227   1HD2  LEU  20          3HD2      LEU  20   2.343  -2.862   1.829
  228   2HD2  LEU  20          1HD2      LEU  20   0.796  -3.266   1.087
  229   3HD2  LEU  20          2HD2      LEU  20   0.808  -2.337   2.579
  230    QB   LEU  20           QB       LEU  20   2.564  -4.289   4.255
  231    QD1  LEU  20           QD1      LEU  20  -0.471  -4.689   3.588
  232    QD2  LEU  20           QD2      LEU  20   1.316  -2.822   1.832
  233    QQD  LEU  20           QQD      LEU  20   0.422  -3.755   2.710
  234    H    ALA  21           HN       ALA  21   5.415  -5.153   3.060
  235    HA   ALA  21           HA       ALA  21   5.508  -5.005   0.259
  236   1HB   ALA  21          2HB       ALA  21   7.668  -5.456   2.343
  237   2HB   ALA  21          3HB       ALA  21   8.002  -5.334   0.623
  238   3HB   ALA  21          1HB       ALA  21   7.247  -3.977   1.484
  239    QB   ALA  21           QB       ALA  21   7.639  -4.921   1.484
  240    H    GLN  22           HN       GLN  22   6.512  -7.798   2.331
  241    HA   GLN  22           HA       GLN  22   7.174  -9.405   0.048
  242   1HB   GLN  22          2HB       GLN  22   6.550 -10.103   2.938
  243   2HB   GLN  22          3HB       GLN  22   6.865 -11.340   1.709
  244   1HG   GLN  22          2HG       GLN  22   9.019 -10.185   1.125
  245   2HG   GLN  22          3HG       GLN  22   8.777  -9.107   2.510
  246   1HE2  GLN  22          2HE2      GLN  22   9.264 -11.843   4.899
  247   2HE2  GLN  22          1HE2      GLN  22   8.232 -10.442   4.650
  248    QB   GLN  22           QB       GLN  22   6.707 -10.722   2.323
  249    QG   GLN  22           QG       GLN  22   8.898  -9.645   1.817
  250    QE2  GLN  22           QE2      GLN  22   8.748 -11.142   4.775
  251    H    LYS  23           HN       LYS  23   4.103  -9.156   1.912
  252    HA   LYS  23           HA       LYS  23   2.709 -11.176   0.486
  253   1HB   LYS  23          2HB       LYS  23   2.088 -10.303   2.689
  254   2HB   LYS  23          3HB       LYS  23   1.877  -8.695   2.001
  255   1HG   LYS  23          2HG       LYS  23   0.121 -10.177   0.459
  256   2HG   LYS  23          3HG       LYS  23   0.059 -11.093   1.959
  257   1HD   LYS  23          2HD       LYS  23  -0.140  -8.060   1.946
  258   2HD   LYS  23          3HD       LYS  23  -1.528  -9.073   1.478
  259   1HE   LYS  23          2HE       LYS  23  -1.423 -10.176   3.720
  260   2HE   LYS  23          3HE       LYS  23  -0.127  -9.037   4.169
  261   1HZ   LYS  23          2HZ       LYS  23  -2.840  -8.222   3.271
  262   2HZ   LYS  23          3HZ       LYS  23  -2.389  -8.337   4.855
  263   3HZ   LYS  23          1HZ       LYS  23  -1.684  -7.244   3.856
  264    QB   LYS  23           QB       LYS  23   1.982  -9.499   2.344
  265    QG   LYS  23           QG       LYS  23   0.090 -10.635   1.210
  266    QD   LYS  23           QD       LYS  23  -0.834  -8.567   1.712
  267    QE   LYS  23           QE       LYS  23  -0.775  -9.606   3.944
  268    QZ   LYS  23           QZ       LYS  23  -2.305  -7.934   3.993
  269    H    VAL  24           HN       VAL  24   3.335  -7.721  -0.185
  270    HA   VAL  24           HA       VAL  24   1.639  -7.634  -2.551
  271    HB   VAL  24           HB       VAL  24   3.730  -5.791  -1.311
  272   1HG1  VAL  24          1HG1      VAL  24   2.201  -5.296  -3.874
  273   2HG1  VAL  24          2HG1      VAL  24   3.179  -4.105  -3.002
  274   3HG1  VAL  24          3HG1      VAL  24   3.959  -5.488  -3.773
  275   1HG2  VAL  24          1HG2      VAL  24   0.747  -5.755  -1.834
  276   2HG2  VAL  24          2HG2      VAL  24   1.517  -5.768  -0.249
  277   3HG2  VAL  24          3HG2      VAL  24   1.633  -4.332  -1.268
  278    QG1  VAL  24           QG1      VAL  24   3.113  -4.963  -3.550
  279    QG2  VAL  24           QG2      VAL  24   1.299  -5.285  -1.117
  280    QQG  VAL  24           QQG      VAL  24   2.206  -5.124  -2.333
  281    H    GLY  25           HN       GLY  25   4.909  -8.675  -1.844
  282   1HA   GLY  25          1HA       GLY  25   6.287  -9.936  -3.221
  283   2HA   GLY  25          2HA       GLY  25   5.239  -9.637  -4.617
  284    QA   GLY  25           QA       GLY  25   5.763  -9.787  -3.919
  285    H    THR  26           HN       THR  26   6.553  -7.232  -2.337
  286    HA   THR  26           HA       THR  26   8.618  -6.373  -4.246
  287    HB   THR  26           HB       THR  26   6.567  -5.049  -4.774
  288    HG1  THR  26          1HG       THR  26   8.657  -4.225  -5.092
  289   1HG2  THR  26          2HG2      THR  26   5.661  -4.886  -2.412
  290   2HG2  THR  26          3HG2      THR  26   6.901  -3.700  -2.048
  291   3HG2  THR  26          1HG2      THR  26   5.711  -3.357  -3.305
  292    QG2  THR  26           QG2      THR  26   6.091  -3.980  -2.589
  293    H    THR  27           HN       THR  27   9.108  -4.022  -2.646
  294    HA   THR  27           HA       THR  27  10.178  -5.228  -0.108
  295    HB   THR  27           HB       THR  27  12.111  -3.550  -0.686
  296    HG1  THR  27          1HG       THR  27  12.313  -3.501  -3.059
  297   1HG2  THR  27          3HG2      THR  27  12.331  -6.041  -0.655
  298   2HG2  THR  27          1HG2      THR  27  11.706  -6.119  -2.313
  299   3HG2  THR  27          2HG2      THR  27  13.266  -5.333  -1.982
  300    QG2  THR  27           QG2      THR  27  12.434  -5.831  -1.651
  301    H    GLN  28           HN       GLN  28  10.510  -3.682   1.612
  302    HA   GLN  28           HA       GLN  28   8.455  -1.920   2.155
  303   1HB   GLN  28          2HB       GLN  28  10.036  -2.649   3.846
  304   2HB   GLN  28          3HB       GLN  28  11.362  -1.774   3.052
  305   1HG   GLN  28          2HG       GLN  28  10.311   0.383   3.555
  306   2HG   GLN  28          3HG       GLN  28   8.869  -0.424   4.174
  307   1HE2  GLN  28          2HE2      GLN  28  10.317  -0.281   7.408
  308   2HE2  GLN  28          1HE2      GLN  28   8.878  -0.085   6.436
  309    QB   GLN  28           QB       GLN  28  10.699  -2.212   3.449
  310    QG   GLN  28           QG       GLN  28   9.590  -0.020   3.865
  311    QE2  GLN  28           QE2      GLN  28   9.597  -0.183   6.921
  312    H    GLN  29           HN       GLN  29  11.482  -1.230   0.418
  313    HA   GLN  29           HA       GLN  29  11.376   1.492   0.217
  314   1HB   GLN  29          2HB       GLN  29  12.922  -0.512  -0.928
  315   2HB   GLN  29          3HB       GLN  29  12.059   0.081  -2.345
  316   1HG   GLN  29          2HG       GLN  29  14.178   1.279  -2.049
  317   2HG   GLN  29          3HG       GLN  29  12.812   2.388  -1.825
  318   1HE2  GLN  29          2HE2      GLN  29  14.431   3.428   1.162
  319   2HE2  GLN  29          1HE2      GLN  29  13.932   3.884  -0.456
  320    QB   GLN  29           QB       GLN  29  12.490  -0.216  -1.636
  321    QG   GLN  29           QG       GLN  29  13.496   1.834  -1.937
  322    QE2  GLN  29           QE2      GLN  29  14.181   3.656   0.352
  323    H    SER  30           HN       SER  30   9.456  -0.807  -1.709
  324    HA   SER  30           HA       SER  30   8.304   1.147  -3.497
  325   1HB   SER  30          2HB       SER  30   7.615  -1.656  -2.606
  326   2HB   SER  30          3HB       SER  30   6.502  -0.764  -3.591
  327    HG   SER  30           HG       SER  30   8.249  -2.047  -4.653
  328    QB   SER  30           QB       SER  30   7.059  -1.210  -3.098
  329    H    ILE  31           HN       ILE  31   7.142  -0.269  -0.360
  330    HA   ILE  31           HA       ILE  31   4.753   1.268  -0.316
  331    HB   ILE  31           HB       ILE  31   6.372  -0.102   1.888
  332   1HG1  ILE  31          2HG1      ILE  31   4.449  -1.655   1.818
  333   2HG1  ILE  31          3HG1      ILE  31   3.778  -0.752   0.432
  334   1HG2  ILE  31          1HG2      ILE  31   3.724   1.378   1.899
  335   2HG2  ILE  31          2HG2      ILE  31   4.154   0.192   3.132
  336   3HG2  ILE  31          3HG2      ILE  31   5.122   1.654   2.956
  337   1HD1  ILE  31          3HD1      ILE  31   6.444  -2.176   0.371
  338   2HD1  ILE  31          1HD1      ILE  31   4.892  -2.937  -0.061
  339   3HD1  ILE  31          2HD1      ILE  31   5.480  -1.589  -1.020
  340    QG1  ILE  31           QG1      ILE  31   4.113  -1.204   1.125
  341    QG2  ILE  31           QG2      ILE  31   4.333   1.074   2.663
  342    QD1  ILE  31           QD1      ILE  31   5.605  -2.234  -0.237
  343    H    GLU  32           HN       GLU  32   7.889   1.792   1.390
  344    HA   GLU  32           HA       GLU  32   7.411   4.280   2.506
  345   1HB   GLU  32          2HB       GLU  32   9.387   2.863   2.856
  346   2HB   GLU  32          3HB       GLU  32  10.008   3.333   1.272
  347   1HG   GLU  32          2HG       GLU  32  10.977   5.120   2.254
  348   2HG   GLU  32          3HG       GLU  32   9.383   5.789   2.613
  349    QB   GLU  32           QB       GLU  32   9.698   3.098   2.064
  350    QG   GLU  32           QG       GLU  32  10.180   5.455   2.433
  351    H    GLN  33           HN       GLN  33   8.539   3.571  -0.841
  352    HA   GLN  33           HA       GLN  33   8.726   6.157  -1.863
  353   1HB   GLN  33          2HB       GLN  33   9.481   4.679  -3.379
  354   2HB   GLN  33          3HB       GLN  33   8.280   3.457  -3.014
  355   1HG   GLN  33          2HG       GLN  33   6.615   4.387  -4.349
  356   2HG   GLN  33          3HG       GLN  33   7.459   5.931  -4.509
  357   1HE2  GLN  33          2HE2      GLN  33   9.092   4.917  -7.438
  358   2HE2  GLN  33          1HE2      GLN  33   8.575   6.226  -6.383
  359    QB   GLN  33           QB       GLN  33   8.880   4.067  -3.196
  360    QG   GLN  33           QG       GLN  33   7.037   5.159  -4.428
  361    QE2  GLN  33           QE2      GLN  33   8.834   5.572  -6.911
  362    H    LEU  34           HN       LEU  34   5.799   4.043  -1.883
  363    HA   LEU  34           HA       LEU  34   4.212   6.137  -3.031
  364   1HB   LEU  34          2HB       LEU  34   3.734   3.658  -3.138
  365   2HB   LEU  34          3HB       LEU  34   3.216   3.743  -1.447
  366    HG   LEU  34           HG       LEU  34   1.467   5.419  -2.111
  367   1HD1  LEU  34          2HD1      LEU  34   2.579   4.914  -4.901
  368   2HD1  LEU  34          3HD1      LEU  34   0.932   5.516  -4.624
  369   3HD1  LEU  34          1HD1      LEU  34   2.313   6.469  -4.093
  370   1HD2  LEU  34          1HD2      LEU  34   1.419   2.762  -3.596
  371   2HD2  LEU  34          2HD2      LEU  34   0.896   3.061  -1.933
  372   3HD2  LEU  34          3HD2      LEU  34   0.006   3.788  -3.283
  373    QB   LEU  34           QB       LEU  34   3.476   3.700  -2.292
  374    QD1  LEU  34           QD1      LEU  34   1.942   5.633  -4.540
  375    QD2  LEU  34           QD2      LEU  34   0.774   3.204  -2.937
  376    QQD  LEU  34           QQD      LEU  34   1.358   4.418  -3.738
  377    H    GLU  35           HN       GLU  35   4.769   5.079   0.291
  378    HA   GLU  35           HA       GLU  35   2.999   6.682   1.684
  379   1HB   GLU  35          2HB       GLU  35   5.467   5.181   2.254
  380   2HB   GLU  35          3HB       GLU  35   5.291   6.584   3.282
  381   1HG   GLU  35          2HG       GLU  35   4.438   4.651   4.389
  382   2HG   GLU  35          3HG       GLU  35   3.114   5.759   4.081
  383    QB   GLU  35           QB       GLU  35   5.379   5.882   2.768
  384    QG   GLU  35           QG       GLU  35   3.777   5.205   4.235
  385    H    ASN  36           HN       ASN  36   6.319   7.545   0.506
  386    HA   ASN  36           HA       ASN  36   6.017  10.277   1.471
  387   1HB   ASN  36          2HB       ASN  36   8.055  10.824   0.516
  388   2HB   ASN  36          3HB       ASN  36   8.232   9.213   1.214
  389   1HD2  ASN  36          2HD2      ASN  36   9.649   8.119  -1.818
  390   2HD2  ASN  36          1HD2      ASN  36   9.580   8.023  -0.071
  391    QB   ASN  36           QB       ASN  36   8.143  10.019   0.865
  392    QD2  ASN  36           QD2      ASN  36   9.615   8.071  -0.944
  393    H    GLY  37           HN       GLY  37   4.555   8.714  -1.139
  394   1HA   GLY  37          1HA       GLY  37   3.189   9.466  -2.762
  395   2HA   GLY  37          2HA       GLY  37   3.225  11.041  -1.964
  396    QA   GLY  37           QA       GLY  37   3.207  10.254  -2.362
  397    H    LYS  38           HN       LYS  38   5.962   9.333  -3.480
  398    HA   LYS  38           HA       LYS  38   6.439  11.610  -5.285
  399   1HB   LYS  38          2HB       LYS  38   8.433  10.388  -5.996
  400   2HB   LYS  38          3HB       LYS  38   8.354  10.627  -4.254
  401   1HG   LYS  38          2HG       LYS  38   7.544   8.302  -3.967
  402   2HG   LYS  38          3HG       LYS  38   7.573   8.045  -5.707
  403   1HD   LYS  38          2HD       LYS  38   9.985   8.738  -3.948
  404   2HD   LYS  38          3HD       LYS  38   9.495   7.104  -4.347
  405   1HE   LYS  38          2HE       LYS  38  11.017   7.301  -5.990
  406   2HE   LYS  38          3HE       LYS  38   9.669   8.003  -6.893
  407   1HZ   LYS  38          1HZ       LYS  38  11.369   9.759  -5.298
  408   2HZ   LYS  38          2HZ       LYS  38  11.947   9.176  -6.720
  409   3HZ   LYS  38          3HZ       LYS  38  10.565  10.071  -6.701
  410    QB   LYS  38           QB       LYS  38   8.393  10.508  -5.125
  411    QG   LYS  38           QG       LYS  38   7.559   8.174  -4.836
  412    QD   LYS  38           QD       LYS  38   9.740   7.921  -4.148
  413    QE   LYS  38           QE       LYS  38  10.344   7.652  -6.442
  414    QZ   LYS  38           QZ       LYS  38  11.294   9.669  -6.240
  415    H    THR  39           HN       THR  39   4.568   8.740  -5.577
  416    HA   THR  39           HA       THR  39   4.687   8.899  -8.558
  417    HB   THR  39           HB       THR  39   4.722   6.413  -6.800
  418    HG1  THR  39          1HG       THR  39   6.733   6.185  -7.588
  419   1HG2  THR  39          2HG2      THR  39   4.261   6.777  -9.792
  420   2HG2  THR  39          3HG2      THR  39   4.913   5.275  -9.121
  421   3HG2  THR  39          1HG2      THR  39   3.325   5.843  -8.609
  422    QG2  THR  39           QG2      THR  39   4.167   5.965  -9.174
  423    H    LYS  40           HN       LYS  40   2.785   8.901  -9.526
  424    HA   LYS  40           HA       LYS  40   0.369   9.262  -7.982
  425   1HB   LYS  40          2HB       LYS  40  -0.682   9.335 -10.287
  426   2HB   LYS  40          3HB       LYS  40   0.467  10.604  -9.880
  427   1HG   LYS  40          2HG       LYS  40   1.619   8.216 -11.295
  428   2HG   LYS  40          3HG       LYS  40   0.486   9.165 -12.212
  429   1HD   LYS  40          2HD       LYS  40   2.864  10.468 -10.776
  430   2HD   LYS  40          3HD       LYS  40   2.974   9.728 -12.377
  431   1HE   LYS  40          2HE       LYS  40   0.794  11.297 -12.806
  432   2HE   LYS  40          3HE       LYS  40   1.534  12.243 -11.510
  433   1HZ   LYS  40          1HZ       LYS  40   3.005  11.375 -13.915
  434   2HZ   LYS  40          2HZ       LYS  40   2.169  12.782 -13.850
  435   3HZ   LYS  40          3HZ       LYS  40   3.443  12.543 -12.840
  436    QB   LYS  40           QB       LYS  40  -0.107   9.969 -10.083
  437    QG   LYS  40           QG       LYS  40   1.052   8.691 -11.753
  438    QD   LYS  40           QD       LYS  40   2.919  10.098 -11.577
  439    QE   LYS  40           QE       LYS  40   1.164  11.770 -12.159
  440    QZ   LYS  40           QZ       LYS  40   2.872  12.233 -13.535
  441    NH1  ARG  41           NH2      ARG  41  -3.525   2.781 -14.547
  442    NH2  ARG  41           NH1      ARG  41  -1.548   1.807 -15.264
  443    H    ARG  41           HN       ARG  41   1.596   6.632 -10.131
  444    HA   ARG  41           HA       ARG  41  -0.293   4.782  -8.839
  445   1HB   ARG  41          2HB       ARG  41  -1.339   5.724 -10.949
  446   2HB   ARG  41          3HB       ARG  41  -0.075   4.884 -11.863
  447   1HG   ARG  41          2HG       ARG  41  -0.811   2.724 -10.677
  448   2HG   ARG  41          3HG       ARG  41  -2.091   3.682  -9.921
  449   1HD   ARG  41          2HD       ARG  41  -3.170   2.673 -11.705
  450   2HD   ARG  41          3HD       ARG  41  -2.843   4.322 -12.287
  451    HE   ARG  41           HE       ARG  41  -0.696   2.549 -12.999
  452   1HH1  ARG  41          2HH2      ARG  41  -4.045   3.265 -13.831
  453   2HH1  ARG  41          1HH2      ARG  41  -3.992   2.556 -15.412
  454   1HH2  ARG  41          2HH1      ARG  41  -0.591   1.532 -15.097
  455   2HH2  ARG  41          1HH1      ARG  41  -1.971   1.549 -16.143
  456    QB   ARG  41           QB       ARG  41  -0.708   5.304 -11.406
  457    QG   ARG  41           QG       ARG  41  -1.451   3.203 -10.299
  458    QD   ARG  41           QD       ARG  41  -3.006   3.498 -11.996
  459    QH1  ARG  41           QH2      ARG  41  -4.018   2.911 -14.621
  460    QH2  ARG  41           QH1      ARG  41  -1.281   1.541 -15.620
  461    HA   PRO  42           HA       PRO  42   3.859   2.862  -9.349
  462   1HB   PRO  42          2HB       PRO  42   3.585   0.998  -7.322
  463   2HB   PRO  42          3HB       PRO  42   4.116   2.677  -7.061
  464   1HG   PRO  42          2HG       PRO  42   1.463   1.410  -6.550
  465   2HG   PRO  42          3HG       PRO  42   2.264   2.728  -5.667
  466   1HD   PRO  42          2HD       PRO  42   0.232   3.037  -7.624
  467   2HD   PRO  42          3HD       PRO  42   1.256   4.331  -7.038
  468    QB   PRO  42           QB       PRO  42   3.850   1.837  -7.192
  469    QG   PRO  42           QG       PRO  42   1.863   2.069  -6.108
  470    QD   PRO  42           QD       PRO  42   0.743   3.684  -7.332
  471    NH1  ARG  43           NH2      ARG  43   6.808  -2.584 -15.662
  472    NH2  ARG  43           NH1      ARG  43   8.020  -0.630 -15.971
  473    H    ARG  43           HN       ARG  43   4.473   0.474  -9.554
  474    HA   ARG  43           HA       ARG  43   2.653  -0.847 -11.409
  475   1HB   ARG  43          2HB       ARG  43   5.263  -1.796 -10.130
  476   2HB   ARG  43          3HB       ARG  43   4.371  -2.608 -11.420
  477   1HG   ARG  43          2HG       ARG  43   4.663   0.040 -12.374
  478   2HG   ARG  43          3HG       ARG  43   6.198  -0.301 -11.553
  479   1HD   ARG  43          2HD       ARG  43   6.285  -2.484 -12.856
  480   2HD   ARG  43          3HD       ARG  43   4.840  -1.926 -13.745
  481    HE   ARG  43           HE       ARG  43   6.848   0.091 -13.854
  482   1HH1  ARG  43          2HH2      ARG  43   6.146  -3.116 -15.116
  483   2HH1  ARG  43          1HH2      ARG  43   7.188  -3.000 -16.499
  484   1HH2  ARG  43          2HH1      ARG  43   8.295   0.292 -15.665
  485   2HH2  ARG  43          1HH1      ARG  43   8.440  -0.997 -16.813
  486    QB   ARG  43           QB       ARG  43   4.817  -2.202 -10.775
  487    QG   ARG  43           QG       ARG  43   5.430  -0.130 -11.964
  488    QD   ARG  43           QD       ARG  43   5.562  -2.205 -13.300
  489    QH1  ARG  43           QH2      ARG  43   6.667  -3.058 -15.807
  490    QH2  ARG  43           QH1      ARG  43   8.367  -0.352 -16.239
  491    H    PHE  44           HN       PHE  44   3.585  -1.214  -8.010
  492    HA   PHE  44           HA       PHE  44   2.052  -3.719  -7.759
  493   1HB   PHE  44          2HB       PHE  44   2.946  -3.699  -5.467
  494   2HB   PHE  44          3HB       PHE  44   4.201  -3.646  -6.677
  495    HD1  PHE  44          1HD       PHE  44   2.431  -1.710  -4.050
  496    HD2  PHE  44          2HD       PHE  44   5.657  -1.661  -6.900
  497    HE1  PHE  44          1HE       PHE  44   3.116   0.525  -3.228
  498    HE2  PHE  44          2HE       PHE  44   6.327   0.591  -6.089
  499    HZ   PHE  44           HZ       PHE  44   5.065   1.662  -4.243
  500    QB   PHE  44           QB       PHE  44   3.573  -3.672  -6.072
  501    QR   PHE  44           QR       PHE  44   4.383  -0.564  -5.067
  502    H    LEU  45           HN       LEU  45   0.835  -0.889  -8.250
  503    HA   LEU  45           HA       LEU  45  -0.611  -0.243  -5.926
  504   1HB   LEU  45          2HB       LEU  45  -0.234   0.999  -8.149
  505   2HB   LEU  45          3HB       LEU  45  -1.652   0.190  -8.746
  506    HG   LEU  45           HG       LEU  45  -1.939   2.529  -7.903
  507   1HD1  LEU  45          2HD1      LEU  45  -3.739   0.953  -8.203
  508   2HD1  LEU  45          3HD1      LEU  45  -3.647   0.492  -6.486
  509   3HD1  LEU  45          1HD1      LEU  45  -4.083   2.153  -6.940
  510   1HD2  LEU  45          1HD2      LEU  45  -0.518   2.290  -5.745
  511   2HD2  LEU  45          2HD2      LEU  45  -2.074   3.109  -5.616
  512   3HD2  LEU  45          3HD2      LEU  45  -1.897   1.426  -5.085
  513    QB   LEU  45           QB       LEU  45  -0.943   0.595  -8.447
  514    QD1  LEU  45           QD1      LEU  45  -3.823   1.199  -7.210
  515    QD2  LEU  45           QD2      LEU  45  -1.496   2.275  -5.482
  516    QQD  LEU  45           QQD      LEU  45  -2.660   1.738  -6.346
  517    HA   PRO  46           HA       PRO  46  -4.089  -3.256  -7.341
  518   1HB   PRO  46          2HB       PRO  46  -3.410  -5.356  -9.009
  519   2HB   PRO  46          3HB       PRO  46  -4.168  -3.836  -9.539
  520   1HG   PRO  46          2HG       PRO  46  -1.347  -4.713  -9.859
  521   2HG   PRO  46          3HG       PRO  46  -2.289  -3.560 -10.838
  522   1HD   PRO  46          2HD       PRO  46  -0.389  -3.019  -8.838
  523   2HD   PRO  46          3HD       PRO  46  -1.437  -1.807  -9.622
  524    QB   PRO  46           QB       PRO  46  -3.789  -4.596  -9.274
  525    QG   PRO  46           QG       PRO  46  -1.817  -4.136 -10.349
  526    QD   PRO  46           QD       PRO  46  -0.913  -2.413  -9.230
  527    H    GLU  47           HN       GLU  47  -0.811  -4.631  -7.277
  528    HA   GLU  47           HA       GLU  47  -1.366  -6.930  -5.761
  529   1HB   GLU  47          2HB       GLU  47   1.146  -5.211  -5.781
  530   2HB   GLU  47          3HB       GLU  47   1.025  -6.910  -5.286
  531   1HG   GLU  47          2HG       GLU  47   0.306  -7.478  -7.620
  532   2HG   GLU  47          3HG       GLU  47   0.583  -5.795  -8.104
  533    QB   GLU  47           QB       GLU  47   1.086  -6.061  -5.534
  534    QG   GLU  47           QG       GLU  47   0.445  -6.636  -7.862
  535    H    LEU  48           HN       LEU  48  -0.527  -3.597  -4.721
  536    HA   LEU  48           HA       LEU  48  -0.634  -4.175  -1.916
  537   1HB   LEU  48          2HB       LEU  48   0.656  -2.406  -3.015
  538   2HB   LEU  48          3HB       LEU  48  -0.815  -1.457  -3.224
  539    HG   LEU  48           HG       LEU  48  -0.456  -2.432  -0.454
  540   1HD1  LEU  48          2HD1      LEU  48   1.736  -0.634  -1.610
  541   2HD1  LEU  48          3HD1      LEU  48   1.478  -0.956   0.111
  542   3HD1  LEU  48          1HD1      LEU  48   1.996  -2.256  -0.961
  543   1HD2  LEU  48          1HD2      LEU  48  -0.560   0.384  -1.588
  544   2HD2  LEU  48          2HD2      LEU  48  -1.933  -0.576  -0.969
  545   3HD2  LEU  48          3HD2      LEU  48  -0.639  -0.091   0.121
  546    QB   LEU  48           QB       LEU  48  -0.079  -1.932  -3.119
  547    QD1  LEU  48           QD1      LEU  48   1.737  -1.282  -0.820
  548    QD2  LEU  48           QD2      LEU  48  -1.044  -0.094  -0.812
  549    QQD  LEU  48           QQD      LEU  48   0.346  -0.688  -0.816
  550    H    ALA  49           HN       ALA  49  -3.016  -2.888  -4.231
  551    HA   ALA  49           HA       ALA  49  -5.113  -2.406  -2.388
  552   1HB   ALA  49          2HB       ALA  49  -4.848  -2.662  -5.286
  553   2HB   ALA  49          3HB       ALA  49  -6.344  -3.403  -4.732
  554   3HB   ALA  49          1HB       ALA  49  -5.999  -1.718  -4.330
  555    QB   ALA  49           QB       ALA  49  -5.730  -2.595  -4.782
  556    H    SER  50           HN       SER  50  -4.519  -5.392  -4.287
  557    HA   SER  50           HA       SER  50  -6.576  -6.878  -2.965
  558   1HB   SER  50          2HB       SER  50  -5.322  -8.869  -3.917
  559   2HB   SER  50          3HB       SER  50  -5.861  -7.650  -5.082
  560    HG   SER  50           HG       SER  50  -3.767  -6.852  -5.195
  561    QB   SER  50           QB       SER  50  -5.591  -8.260  -4.499
  562    H    ALA  51           HN       ALA  51  -3.035  -6.762  -2.400
  563    HA   ALA  51           HA       ALA  51  -2.789  -8.523  -0.298
  564   1HB   ALA  51          1HB       ALA  51  -1.478  -5.850  -0.845
  565   2HB   ALA  51          2HB       ALA  51  -0.938  -6.843   0.469
  566   3HB   ALA  51          3HB       ALA  51  -0.829  -7.475  -1.188
  567    QB   ALA  51           QB       ALA  51  -1.082  -6.723  -0.521
  568    H    LEU  52           HN       LEU  52  -3.732  -5.064  -0.073
  569    HA   LEU  52           HA       LEU  52  -4.169  -5.198   2.803
  570   1HB   LEU  52          2HB       LEU  52  -4.695  -3.175   0.608
  571   2HB   LEU  52          3HB       LEU  52  -5.352  -2.935   2.214
  572    HG   LEU  52           HG       LEU  52  -2.382  -3.301   1.609
  573   1HD1  LEU  52          3HD1      LEU  52  -3.358  -1.181   0.741
  574   2HD1  LEU  52          1HD1      LEU  52  -3.932  -0.790   2.375
  575   3HD1  LEU  52          2HD1      LEU  52  -2.188  -0.935   2.047
  576   1HD2  LEU  52          2HD2      LEU  52  -3.979  -2.870   4.148
  577   2HD2  LEU  52          3HD2      LEU  52  -2.673  -4.002   3.867
  578   3HD2  LEU  52          1HD2      LEU  52  -2.308  -2.279   4.043
  579    QB   LEU  52           QB       LEU  52  -5.024  -3.055   1.411
  580    QD1  LEU  52           QD1      LEU  52  -3.159  -0.968   1.721
  581    QD2  LEU  52           QD2      LEU  52  -2.986  -3.050   4.019
  582    QQD  LEU  52           QQD      LEU  52  -3.073  -2.009   2.871
  583    H    GLY  53           HN       GLY  53  -6.168  -5.541  -0.072
  584   1HA   GLY  53          1HA       GLY  53  -8.194  -6.706  -0.184
  585   2HA   GLY  53          2HA       GLY  53  -8.458  -6.505   1.555
  586    QA   GLY  53           QA       GLY  53  -8.325  -6.606   0.686
  587    H    VAL  54           HN       VAL  54  -7.622  -4.142  -1.032
  588    HA   VAL  54           HA       VAL  54 -10.261  -2.823  -0.803
  589    HB   VAL  54           HB       VAL  54  -9.203  -0.608  -0.731
  590   1HG1  VAL  54          2HG1      VAL  54  -9.853  -1.867   1.399
  591   2HG1  VAL  54          3HG1      VAL  54  -8.117  -2.162   1.634
  592   3HG1  VAL  54          1HG1      VAL  54  -8.741  -0.502   1.573
  593   1HG2  VAL  54          2HG2      VAL  54  -6.585  -2.154  -0.418
  594   2HG2  VAL  54          3HG2      VAL  54  -7.028  -1.033  -1.726
  595   3HG2  VAL  54          1HG2      VAL  54  -6.757  -0.437  -0.081
  596    QG1  VAL  54           QG1      VAL  54  -8.904  -1.510   1.536
  597    QG2  VAL  54           QG2      VAL  54  -6.790  -1.208  -0.742
  598    QQG  VAL  54           QQG      VAL  54  -7.847  -1.360   0.397
  599    H    SER  55           HN       SER  55 -10.390  -1.103  -2.694
  600    HA   SER  55           HA       SER  55  -9.604  -2.526  -5.123
  601   1HB   SER  55          2HB       SER  55 -11.052  -0.750  -6.166
  602   2HB   SER  55          3HB       SER  55 -11.874  -1.751  -4.954
  603    HG   SER  55           HG       SER  55 -12.161   0.593  -4.758
  604    QB   SER  55           QB       SER  55 -11.464  -1.251  -5.560
  605    H    VAL  56           HN       VAL  56  -8.450  -1.568  -6.810
  606    HA   VAL  56           HA       VAL  56  -6.197   0.117  -6.277
  607    HB   VAL  56           HB       VAL  56  -7.738  -0.873  -8.711
  608   1HG1  VAL  56          3HG1      VAL  56  -5.750   1.382  -8.772
  609   2HG1  VAL  56          1HG1      VAL  56  -5.721   0.159 -10.055
  610   3HG1  VAL  56          2HG1      VAL  56  -7.191   1.097  -9.745
  611   1HG2  VAL  56          1HG2      VAL  56  -6.094  -2.257  -7.379
  612   2HG2  VAL  56          2HG2      VAL  56  -5.768  -2.138  -9.114
  613   3HG2  VAL  56          3HG2      VAL  56  -4.817  -1.170  -7.968
  614    QG1  VAL  56           QG1      VAL  56  -6.220   0.879  -9.524
  615    QG2  VAL  56           QG2      VAL  56  -5.559  -1.855  -8.153
  616    QQG  VAL  56           QQG      VAL  56  -5.890  -0.488  -8.839
  617    H    ASP  57           HN       ASP  57  -9.451   0.763  -7.572
  618    HA   ASP  57           HA       ASP  57  -9.239   3.452  -8.150
  619   1HB   ASP  57          2HB       ASP  57 -11.683   2.192  -6.851
  620   2HB   ASP  57          3HB       ASP  57 -11.622   3.447  -8.089
  621    QB   ASP  57           QB       ASP  57 -11.653   2.820  -7.470
  622    CH2  TRP  58           CH2      TRP  58  -7.692   2.714   2.383
  623    H    TRP  58           HN       TRP  58  -9.767   1.815  -5.009
  624    HA   TRP  58           HA       TRP  58 -10.059   4.320  -3.555
  625   1HB   TRP  58          2HB       TRP  58 -11.119   2.247  -2.789
  626   2HB   TRP  58          3HB       TRP  58  -9.532   1.530  -2.513
  627    HD1  TRP  58           HD1      TRP  58 -11.751   4.383  -1.247
  628    HE1  TRP  58           HE1      TRP  58 -11.166   4.939   1.171
  629    HE3  TRP  58           HE3      TRP  58  -7.526   1.592  -0.836
  630    HZ2  TRP  58           HZ2      TRP  58  -9.183   4.074   3.139
  631    HZ3  TRP  58           HZ3      TRP  58  -6.234   1.565   1.292
  632    HH2  TRP  58           HH2      TRP  58  -7.077   2.768   3.270
  633    QB   TRP  58           QB       TRP  58 -10.326   1.888  -2.651
  634    H    LEU  59           HN       LEU  59  -7.367   1.922  -4.099
  635    HA   LEU  59           HA       LEU  59  -5.568   3.344  -2.448
  636   1HB   LEU  59          2HB       LEU  59  -5.340   1.334  -4.589
  637   2HB   LEU  59          3HB       LEU  59  -3.925   2.352  -4.477
  638    HG   LEU  59           HG       LEU  59  -5.207   0.876  -2.150
  639   1HD1  LEU  59          1HD1      LEU  59  -4.116  -0.529  -4.011
  640   2HD1  LEU  59          2HD1      LEU  59  -2.570   0.127  -3.475
  641   3HD1  LEU  59          3HD1      LEU  59  -3.576  -0.777  -2.338
  642   1HD2  LEU  59          3HD2      LEU  59  -3.707   2.942  -1.572
  643   2HD2  LEU  59          1HD2      LEU  59  -3.328   1.400  -0.821
  644   3HD2  LEU  59          2HD2      LEU  59  -2.365   1.986  -2.194
  645    QB   LEU  59           QB       LEU  59  -4.632   1.844  -4.533
  646    QD1  LEU  59           QD1      LEU  59  -3.421  -0.393  -3.275
  647    QD2  LEU  59           QD2      LEU  59  -3.133   2.109  -1.529
  648    QQD  LEU  59           QQD      LEU  59  -3.277   0.857  -2.402
  649    H    LEU  60           HN       LEU  60  -6.532   4.040  -5.774
  650    HA   LEU  60           HA       LEU  60  -4.697   6.288  -6.045
  651   1HB   LEU  60          2HB       LEU  60  -6.973   5.137  -7.659
  652   2HB   LEU  60          3HB       LEU  60  -6.324   6.727  -8.080
  653    HG   LEU  60           HG       LEU  60  -4.496   4.341  -7.696
  654   1HD1  LEU  60          2HD1      LEU  60  -6.127   3.710  -9.417
  655   2HD1  LEU  60          3HD1      LEU  60  -5.819   5.225 -10.292
  656   3HD1  LEU  60          1HD1      LEU  60  -4.534   4.006 -10.135
  657   1HD2  LEU  60          3HD2      LEU  60  -3.930   7.054  -8.027
  658   2HD2  LEU  60          1HD2      LEU  60  -2.843   5.705  -8.392
  659   3HD2  LEU  60          2HD2      LEU  60  -3.817   6.440  -9.679
  660    QB   LEU  60           QB       LEU  60  -6.649   5.932  -7.870
  661    QD1  LEU  60           QD1      LEU  60  -5.493   4.314  -9.948
  662    QD2  LEU  60           QD2      LEU  60  -3.530   6.400  -8.700
  663    QQD  LEU  60           QQD      LEU  60  -4.512   5.357  -9.323
  664    H    ASN  61           HN       ASN  61  -8.245   6.063  -5.468
  665    HA   ASN  61           HA       ASN  61  -8.479   8.969  -5.084
  666   1HB   ASN  61          2HB       ASN  61 -10.449   6.672  -4.650
  667   2HB   ASN  61          3HB       ASN  61 -10.794   8.351  -4.260
  668   1HD2  ASN  61          2HD2      ASN  61 -10.947   7.132  -8.145
  669   2HD2  ASN  61          1HD2      ASN  61 -10.253   6.091  -6.902
  670    QB   ASN  61           QB       ASN  61 -10.621   7.511  -4.455
  671    QD2  ASN  61           QD2      ASN  61 -10.599   6.612  -7.524
  672    H    GLY  62           HN       GLY  62  -9.011   6.131  -2.957
  673   1HA   GLY  62          1HA       GLY  62  -8.276   5.929  -0.755
  674   2HA   GLY  62          2HA       GLY  62  -8.103   7.691  -0.677
  675    QA   GLY  62           QA       GLY  62  -8.190   6.810  -0.717
  676    H    THR  63           HN       THR  63 -11.064   7.210  -2.002
  677    HA   THR  63           HA       THR  63 -12.534   6.971   0.540
  678    HB   THR  63           HB       THR  63 -13.518   9.173   0.168
  679    HG1  THR  63          1HG       THR  63 -12.721   9.199  -2.114
  680   1HG2  THR  63          3HG2      THR  63 -11.599   8.982   1.772
  681   2HG2  THR  63          1HG2      THR  63 -10.527   9.572   0.471
  682   3HG2  THR  63          2HG2      THR  63 -11.836  10.593   1.075
  683    QG2  THR  63           QG2      THR  63 -11.321   9.715   1.106
  684    H    SER  64           HN       SER  64 -13.707   5.317  -0.274
  685    HA   SER  64           HA       SER  64 -15.202   4.141  -1.435
  686   1HB   SER  64          2HB       SER  64 -16.576   6.270  -1.297
  687   2HB   SER  64          3HB       SER  64 -15.977   6.659  -2.936
  688    HG   SER  64           HG       SER  64 -17.689   5.553  -3.463
  689    QB   SER  64           QB       SER  64 -16.276   6.465  -2.116
  690    H    ASP  65           HN       ASP  65 -16.058   3.873  -3.795
  691    HA   ASP  65           HA       ASP  65 -13.767   3.411  -5.635
  692   1HB   ASP  65          2HB       ASP  65 -15.249   1.497  -5.364
  693   2HB   ASP  65          3HB       ASP  65 -16.685   2.509  -5.635
  694    QB   ASP  65           QB       ASP  65 -15.967   2.003  -5.499
  695    H    SER  66           HN       SER  66 -13.338   5.395  -6.526
  696    HA   SER  66           HA       SER  66 -13.554   7.269  -7.790
  697   1HB   SER  66          2HB       SER  66 -15.787   5.643  -9.085
  698   2HB   SER  66          3HB       SER  66 -14.885   6.992  -9.799
  699    HG   SER  66           HG       SER  66 -13.943   4.412  -9.092
  700    QB   SER  66           QB       SER  66 -15.336   6.318  -9.442
  701    H    ASN  67           HN       ASN  67 -14.197   8.736  -6.180
  702    HA   ASN  67           HA       ASN  67 -15.348  10.562  -5.571
  703   1HB   ASN  67          2HB       ASN  67 -17.892   9.626  -6.963
  704   2HB   ASN  67          3HB       ASN  67 -17.531  11.197  -6.292
  705   1HD2  ASN  67          2HD2      ASN  67 -16.218  10.239 -10.058
  706   2HD2  ASN  67          1HD2      ASN  67 -16.839   9.003  -8.950
  707    QB   ASN  67           QB       ASN  67 -17.712  10.411  -6.627
  708    QD2  ASN  67           QD2      ASN  67 -16.528   9.622  -9.504
  709    H    VAL  68           HN       VAL  68 -16.243  10.845  -3.555
  710    HA   VAL  68           HA       VAL  68 -16.755   8.588  -1.951
  711    HB   VAL  68           HB       VAL  68 -17.539  11.483  -1.442
  712   1HG1  VAL  68          2HG1      VAL  68 -17.260   9.123   0.477
  713   2HG1  VAL  68          3HG1      VAL  68 -17.462  10.825   0.951
  714   3HG1  VAL  68          1HG1      VAL  68 -18.753  10.005   0.082
  715   1HG2  VAL  68          1HG2      VAL  68 -15.006   9.895  -1.237
  716   2HG2  VAL  68          2HG2      VAL  68 -15.228  11.605  -1.622
  717   3HG2  VAL  68          3HG2      VAL  68 -15.328  11.061   0.060
  718    QG1  VAL  68           QG1      VAL  68 -17.825   9.984   0.504
  719    QG2  VAL  68           QG2      VAL  68 -15.187  10.854  -0.933
  720    QQG  VAL  68           QQG      VAL  68 -16.506  10.419  -0.215
  721    NH1  ARG  69           NH2      ARG  69 -23.332   4.028  -4.203
  722    NH2  ARG  69           NH1      ARG  69 -25.037   5.053  -3.012
  723    H    ARG  69           HN       ARG  69 -18.575   7.511  -1.309
  724    HA   ARG  69           HA       ARG  69 -20.858   7.491  -3.056
  725   1HB   ARG  69          2HB       ARG  69 -19.941   6.048  -0.560
  726   2HB   ARG  69          3HB       ARG  69 -21.662   6.180  -0.792
  727   1HG   ARG  69          2HG       ARG  69 -20.922   5.310  -3.308
  728   2HG   ARG  69          3HG       ARG  69 -19.681   4.557  -2.302
  729   1HD   ARG  69          2HD       ARG  69 -21.570   3.011  -2.430
  730   2HD   ARG  69          3HD       ARG  69 -21.483   3.670  -0.806
  731    HE   ARG  69           HE       ARG  69 -23.443   4.846  -1.085
  732   1HH1  ARG  69          2HH2      ARG  69 -22.388   3.672  -4.223
  733   2HH1  ARG  69          1HH2      ARG  69 -23.858   4.060  -5.061
  734   1HH2  ARG  69          2HH1      ARG  69 -25.372   5.484  -2.162
  735   2HH2  ARG  69          1HH1      ARG  69 -25.611   5.115  -3.840
  736    QB   ARG  69           QB       ARG  69 -20.802   6.114  -0.675
  737    QG   ARG  69           QG       ARG  69 -20.301   4.934  -2.805
  738    QD   ARG  69           QD       ARG  69 -21.526   3.341  -1.618
  739    QH1  ARG  69           QH2      ARG  69 -23.123   3.866  -4.641
  740    QH2  ARG  69           QH1      ARG  69 -25.491   5.300  -3.001
   
  Start of MODEL           5
 Raw file had 740 H/Q atoms
  Start of MODEL    5
    1    H    SER   1           HN       SER   1  -4.839  11.528   4.860
    2    HA   SER   1           HA       SER   1  -4.579  11.567   2.128
    3   1HB   SER   1          2HB       SER   1  -2.247  10.926   3.972
    4   2HB   SER   1          3HB       SER   1  -2.318  12.057   2.600
    5    HG   SER   1           HG       SER   1  -2.652  13.363   4.350
    6    QB   SER   1           QB       SER   1  -2.283  11.491   3.287
    7    H    ILE   2           HN       ILE   2  -2.863  10.158   0.871
    8    HA   ILE   2           HA       ILE   2  -3.965   7.578   0.514
    9    HB   ILE   2           HB       ILE   2  -1.252   8.597  -0.383
   10   1HG1  ILE   2          2HG1      ILE   2  -2.705  10.263  -1.177
   11   2HG1  ILE   2          3HG1      ILE   2  -2.568   9.143  -2.533
   12   1HG2  ILE   2          3HG2      ILE   2  -2.343   6.036  -0.706
   13   2HG2  ILE   2          1HG2      ILE   2  -2.733   6.844  -2.223
   14   3HG2  ILE   2          2HG2      ILE   2  -1.057   6.775  -1.668
   15   1HD1  ILE   2          3HD1      ILE   2  -4.733   8.076  -1.742
   16   2HD1  ILE   2          1HD1      ILE   2  -4.855   9.384  -0.555
   17   3HD1  ILE   2          2HD1      ILE   2  -4.876   9.788  -2.261
   18    QG1  ILE   2           QG1      ILE   2  -2.636   9.702  -1.856
   19    QG2  ILE   2           QG2      ILE   2  -2.044   6.552  -1.533
   20    QD1  ILE   2           QD1      ILE   2  -4.821   9.083  -1.519
   21    H    SER   3           HN       SER   3  -0.821   8.547   1.882
   22    HA   SER   3           HA       SER   3   0.208   6.155   2.847
   23   1HB   SER   3          2HB       SER   3   1.223   7.767   4.548
   24   2HB   SER   3          3HB       SER   3   1.394   8.230   2.841
   25    HG   SER   3           HG       SER   3   0.341   9.729   4.653
   26    QB   SER   3           QB       SER   3   1.309   7.998   3.694
   27    H    SER   4           HN       SER   4  -2.070   8.423   4.429
   28    HA   SER   4           HA       SER   4  -2.339   6.920   6.842
   29   1HB   SER   4          2HB       SER   4  -3.169   9.083   7.013
   30   2HB   SER   4          3HB       SER   4  -4.089   8.951   5.513
   31    HG   SER   4           HG       SER   4  -4.725   7.593   7.907
   32    QB   SER   4           QB       SER   4  -3.629   9.017   6.263
   33    NH1  ARG   5           NH2      ARG   5  -7.320   9.211   1.948
   34    NH2  ARG   5           NH1      ARG   5  -7.306   9.635  -0.310
   35    H    ARG   5           HN       ARG   5  -4.175   6.621   3.721
   36    HA   ARG   5           HA       ARG   5  -5.930   4.601   4.809
   37   1HB   ARG   5          2HB       ARG   5  -5.306   4.522   1.876
   38   2HB   ARG   5          3HB       ARG   5  -6.799   4.345   2.788
   39   1HG   ARG   5          2HG       ARG   5  -6.514   6.874   3.320
   40   2HG   ARG   5          3HG       ARG   5  -5.472   6.816   1.872
   41   1HD   ARG   5          2HD       ARG   5  -7.638   5.436   0.949
   42   2HD   ARG   5          3HD       ARG   5  -8.434   6.478   2.116
   43    HE   ARG   5           HE       ARG   5  -7.691   7.137  -0.499
   44   1HH1  ARG   5          2HH2      ARG   5  -7.306   8.541   2.702
   45   2HH1  ARG   5          1HH2      ARG   5  -7.407  10.193   2.141
   46   1HH2  ARG   5          2HH1      ARG   5  -7.138   9.300  -1.245
   47   2HH2  ARG   5          1HH1      ARG   5  -7.297  10.634  -0.166
   48    QB   ARG   5           QB       ARG   5  -6.052   4.434   2.332
   49    QG   ARG   5           QG       ARG   5  -5.993   6.844   2.596
   50    QD   ARG   5           QD       ARG   5  -8.036   5.957   1.532
   51    QH1  ARG   5           QH2      ARG   5  -7.356   9.367   2.422
   52    QH2  ARG   5           QH1      ARG   5  -7.217   9.967  -0.706
   53    H    VAL   6           HN       VAL   6  -2.991   4.461   2.832
   54    HA   VAL   6           HA       VAL   6  -2.768   1.710   2.503
   55    HB   VAL   6           HB       VAL   6  -0.618   3.843   2.673
   56   1HG1  VAL   6          2HG1      VAL   6  -0.532   1.011   1.537
   57   2HG1  VAL   6          3HG1      VAL   6   0.731   2.248   1.287
   58   3HG1  VAL   6          1HG1      VAL   6   0.351   1.680   2.921
   59   1HG2  VAL   6          2HG2      VAL   6  -2.557   3.872   0.784
   60   2HG2  VAL   6          3HG2      VAL   6  -0.862   4.256   0.430
   61   3HG2  VAL   6          1HG2      VAL   6  -1.490   2.653   0.073
   62    QG1  VAL   6           QG1      VAL   6   0.183   1.646   1.916
   63    QG2  VAL   6           QG2      VAL   6  -1.636   3.594   0.429
   64    QQG  VAL   6           QQG      VAL   6  -0.726   2.619   1.172
   65    H    LYS   7           HN       LYS   7  -1.117   3.760   4.946
   66    HA   LYS   7           HA       LYS   7  -0.079   1.662   6.449
   67   1HB   LYS   7          2HB       LYS   7   0.413   4.258   6.517
   68   2HB   LYS   7          3HB       LYS   7  -0.794   4.240   7.813
   69   1HG   LYS   7          2HG       LYS   7   0.704   2.132   8.609
   70   2HG   LYS   7          3HG       LYS   7   1.927   2.916   7.606
   71   1HD   LYS   7          2HD       LYS   7   0.373   4.182   9.914
   72   2HD   LYS   7          3HD       LYS   7   2.003   3.540  10.049
   73   1HE   LYS   7          2HE       LYS   7   1.106   5.932   8.353
   74   2HE   LYS   7          3HE       LYS   7   2.040   5.970   9.851
   75   1HZ   LYS   7          1HZ       LYS   7   3.781   4.700   8.617
   76   2HZ   LYS   7          2HZ       LYS   7   2.963   4.975   7.212
   77   3HZ   LYS   7          3HZ       LYS   7   3.528   6.230   8.082
   78    QB   LYS   7           QB       LYS   7  -0.190   4.249   7.165
   79    QG   LYS   7           QG       LYS   7   1.316   2.525   8.108
   80    QD   LYS   7           QD       LYS   7   1.188   3.861   9.981
   81    QE   LYS   7           QE       LYS   7   1.573   5.951   9.102
   82    QZ   LYS   7           QZ       LYS   7   3.424   5.302   7.970
   83    H    SER   8           HN       SER   8  -3.164   3.519   6.995
   84    HA   SER   8           HA       SER   8  -4.120   2.313   9.318
   85   1HB   SER   8          2HB       SER   8  -5.677   3.078   6.818
   86   2HB   SER   8          3HB       SER   8  -6.416   2.531   8.327
   87    HG   SER   8           HG       SER   8  -4.809   4.813   7.938
   88    QB   SER   8           QB       SER   8  -6.047   2.804   7.573
   89    H    LYS   9           HN       LYS   9  -4.321   1.047   5.941
   90    HA   LYS   9           HA       LYS   9  -5.702  -1.303   6.736
   91   1HB   LYS   9          2HB       LYS   9  -4.996  -0.157   4.331
   92   2HB   LYS   9          3HB       LYS   9  -3.887  -1.533   4.414
   93   1HG   LYS   9          2HG       LYS   9  -5.798  -2.391   3.388
   94   2HG   LYS   9          3HG       LYS   9  -5.959  -2.951   5.050
   95   1HD   LYS   9          2HD       LYS   9  -7.485  -0.911   5.432
   96   2HD   LYS   9          3HD       LYS   9  -7.342  -0.553   3.696
   97   1HE   LYS   9          2HE       LYS   9  -8.350  -2.664   3.114
   98   2HE   LYS   9          3HE       LYS   9  -8.341  -3.244   4.781
   99   1HZ   LYS   9          3HZ       LYS   9  -9.926  -0.865   3.911
  100   2HZ   LYS   9          1HZ       LYS   9 -10.562  -2.354   4.079
  101   3HZ   LYS   9          2HZ       LYS   9  -9.968  -1.600   5.366
  102    QB   LYS   9           QB       LYS   9  -4.442  -0.845   4.372
  103    QG   LYS   9           QG       LYS   9  -5.879  -2.671   4.219
  104    QD   LYS   9           QD       LYS   9  -7.413  -0.732   4.564
  105    QE   LYS   9           QE       LYS   9  -8.346  -2.954   3.947
  106    QZ   LYS   9           QZ       LYS   9 -10.152  -1.606   4.452
  107    NH1  ARG  10           NH2      ARG  10   1.561  -0.479   3.273
  108    NH2  ARG  10           NH1      ARG  10   2.441   1.378   4.349
  109    H    ARG  10           HN       ARG  10  -2.208  -0.630   6.338
  110    HA   ARG  10           HA       ARG  10  -1.099  -3.121   6.909
  111   1HB   ARG  10          2HB       ARG  10  -0.119  -0.583   6.624
  112   2HB   ARG  10          3HB       ARG  10   0.088  -0.774   8.360
  113   1HG   ARG  10          2HG       ARG  10   2.052  -1.753   7.870
  114   2HG   ARG  10          3HG       ARG  10   1.103  -3.172   7.399
  115   1HD   ARG  10          2HD       ARG  10   2.515  -2.683   5.562
  116   2HD   ARG  10          3HD       ARG  10   0.866  -2.189   5.134
  117    HE   ARG  10           HE       ARG  10   2.796  -0.203   6.238
  118   1HH1  ARG  10          2HH2      ARG  10   1.269  -1.442   3.307
  119   2HH1  ARG  10          1HH2      ARG  10   1.490   0.020   2.399
  120   1HH2  ARG  10          2HH1      ARG  10   2.779   1.830   5.182
  121   2HH2  ARG  10          1HH1      ARG  10   2.125   2.054   3.653
  122    QB   ARG  10           QB       ARG  10  -0.016  -0.678   7.492
  123    QG   ARG  10           QG       ARG  10   1.577  -2.463   7.634
  124    QD   ARG  10           QD       ARG  10   1.691  -2.437   5.348
  125    QH1  ARG  10           QH2      ARG  10   1.380  -0.711   2.853
  126    QH2  ARG  10           QH1      ARG  10   2.452   1.941   4.418
  127    H    ILE  11           HN       ILE  11  -2.187  -0.627   9.252
  128    HA   ILE  11           HA       ILE  11  -1.660  -2.171  11.609
  129    HB   ILE  11           HB       ILE  11  -3.657   0.090  11.187
  130   1HG1  ILE  11          2HG1      ILE  11  -1.944   1.146  12.823
  131   2HG1  ILE  11          3HG1      ILE  11  -0.809  -0.093  12.292
  132   1HG2  ILE  11          1HG2      ILE  11  -4.376  -1.349  13.095
  133   2HG2  ILE  11          2HG2      ILE  11  -2.737  -1.222  13.774
  134   3HG2  ILE  11          3HG2      ILE  11  -3.780   0.207  13.635
  135   1HD1  ILE  11          1HD1      ILE  11  -2.234   1.741  10.348
  136   2HD1  ILE  11          2HD1      ILE  11  -0.793   2.274  11.207
  137   3HD1  ILE  11          3HD1      ILE  11  -0.682   0.866  10.144
  138    QG1  ILE  11           QG1      ILE  11  -1.377   0.527  12.557
  139    QG2  ILE  11           QG2      ILE  11  -3.631  -0.788  13.502
  140    QD1  ILE  11           QD1      ILE  11  -1.236   1.627  10.566
  141    H    GLN  12           HN       GLN  12  -4.777  -1.666   9.866
  142    HA   GLN  12           HA       GLN  12  -6.252  -3.493  11.450
  143   1HB   GLN  12          2HB       GLN  12  -6.645  -2.619   8.569
  144   2HB   GLN  12          3HB       GLN  12  -7.820  -3.611   9.441
  145   1HG   GLN  12          2HG       GLN  12  -6.886  -0.889  10.451
  146   2HG   GLN  12          3HG       GLN  12  -8.301  -1.117   9.424
  147   1HE2  GLN  12          2HE2      GLN  12 -10.368  -2.359  12.035
  148   2HE2  GLN  12          1HE2      GLN  12 -10.218  -2.126  10.303
  149    QB   GLN  12           QB       GLN  12  -7.233  -3.115   9.005
  150    QG   GLN  12           QG       GLN  12  -7.594  -1.003   9.937
  151    QE2  GLN  12           QE2      GLN  12 -10.294  -2.243  11.169
  152    H    LEU  13           HN       LEU  13  -4.199  -4.199   8.682
  153    HA   LEU  13           HA       LEU  13  -4.819  -7.010   8.426
  154   1HB   LEU  13          2HB       LEU  13  -2.532  -5.195   7.606
  155   2HB   LEU  13          3HB       LEU  13  -2.420  -6.927   7.359
  156    HG   LEU  13           HG       LEU  13  -4.942  -5.619   6.421
  157   1HD1  LEU  13          1HD1      LEU  13  -2.864  -4.174   5.645
  158   2HD1  LEU  13          2HD1      LEU  13  -2.576  -5.521   4.546
  159   3HD1  LEU  13          3HD1      LEU  13  -4.136  -4.666   4.535
  160   1HD2  LEU  13          3HD2      LEU  13  -4.462  -8.102   6.243
  161   2HD2  LEU  13          1HD2      LEU  13  -4.763  -7.327   4.674
  162   3HD2  LEU  13          2HD2      LEU  13  -3.107  -7.720   5.168
  163    QB   LEU  13           QB       LEU  13  -2.476  -6.061   7.483
  164    QD1  LEU  13           QD1      LEU  13  -3.191  -4.787   4.909
  165    QD2  LEU  13           QD2      LEU  13  -4.110  -7.716   5.362
  166    QQD  LEU  13           QQD      LEU  13  -3.651  -6.252   5.135
  167    H    GLY  14           HN       GLY  14  -2.768  -5.098  10.572
  168   1HA   GLY  14          1HA       GLY  14  -1.823  -5.718  12.564
  169   2HA   GLY  14          2HA       GLY  14  -2.262  -7.410  12.275
  170    QA   GLY  14           QA       GLY  14  -2.043  -6.564  12.420
  171    H    LEU  15           HN       LEU  15  -0.423  -5.249  10.067
  172    HA   LEU  15           HA       LEU  15   2.058  -6.833  10.510
  173   1HB   LEU  15          2HB       LEU  15   0.585  -6.464   7.869
  174   2HB   LEU  15          3HB       LEU  15   2.228  -7.088   8.003
  175    HG   LEU  15           HG       LEU  15  -0.108  -8.470   9.393
  176   1HD1  LEU  15          3HD1      LEU  15   0.899  -8.867   6.563
  177   2HD1  LEU  15          1HD1      LEU  15  -0.124 -10.025   7.456
  178   3HD1  LEU  15          2HD1      LEU  15  -0.733  -8.409   7.088
  179   1HD2  LEU  15          2HD2      LEU  15   2.331  -9.038  10.026
  180   2HD2  LEU  15          3HD2      LEU  15   1.328 -10.381   9.462
  181   3HD2  LEU  15          1HD2      LEU  15   2.493  -9.633   8.370
  182    QB   LEU  15           QB       LEU  15   1.407  -6.776   7.936
  183    QD1  LEU  15           QD1      LEU  15   0.014  -9.101   7.035
  184    QD2  LEU  15           QD2      LEU  15   2.051  -9.684   9.286
  185    QQD  LEU  15           QQD      LEU  15   1.032  -9.392   8.161
  186    H    ASN  16           HN       ASN  16   3.857  -5.827   9.185
  187    HA   ASN  16           HA       ASN  16   3.674  -2.851   9.419
  188   1HB   ASN  16          2HB       ASN  16   5.981  -2.789   9.872
  189   2HB   ASN  16          3HB       ASN  16   5.328  -4.061  10.903
  190   1HD2  ASN  16          2HD2      ASN  16   7.060  -6.707   9.198
  191   2HD2  ASN  16          1HD2      ASN  16   5.775  -6.286  10.310
  192    QB   ASN  16           QB       ASN  16   5.655  -3.425  10.388
  193    QD2  ASN  16           QD2      ASN  16   6.418  -6.496   9.754
  194    H    GLN  17           HN       GLN  17   5.539  -1.906   7.979
  195    HA   GLN  17           HA       GLN  17   4.623  -1.965   5.282
  196   1HB   GLN  17          2HB       GLN  17   7.008  -0.770   6.684
  197   2HB   GLN  17          3HB       GLN  17   6.870  -0.702   4.917
  198   1HG   GLN  17          2HG       GLN  17   4.675   0.395   5.155
  199   2HG   GLN  17          3HG       GLN  17   4.839   0.372   6.922
  200   1HE2  GLN  17          2HE2      GLN  17   7.048   3.010   4.631
  201   2HE2  GLN  17          1HE2      GLN  17   6.456   1.548   3.880
  202    QB   GLN  17           QB       GLN  17   6.939  -0.736   5.800
  203    QG   GLN  17           QG       GLN  17   4.757   0.383   6.038
  204    QE2  GLN  17           QE2      GLN  17   6.752   2.279   4.256
  205    H    ALA  18           HN       ALA  18   7.532  -3.506   6.739
  206    HA   ALA  18           HA       ALA  18   8.559  -4.426   4.215
  207   1HB   ALA  18          2HB       ALA  18   9.901  -4.099   6.347
  208   2HB   ALA  18          3HB       ALA  18   9.129  -5.563   6.985
  209   3HB   ALA  18          1HB       ALA  18  10.144  -5.659   5.536
  210    QB   ALA  18           QB       ALA  18   9.725  -5.107   6.289
  211    H    GLU  19           HN       GLU  19   6.707  -5.999   6.840
  212    HA   GLU  19           HA       GLU  19   6.319  -8.537   5.651
  213   1HB   GLU  19          2HB       GLU  19   4.838  -6.842   7.641
  214   2HB   GLU  19          3HB       GLU  19   3.876  -8.065   6.819
  215   1HG   GLU  19          2HG       GLU  19   6.491  -8.746   8.180
  216   2HG   GLU  19          3HG       GLU  19   4.907  -8.883   8.956
  217    QB   GLU  19           QB       GLU  19   4.357  -7.454   7.230
  218    QG   GLU  19           QG       GLU  19   5.699  -8.815   8.568
  219    H    LEU  20           HN       LEU  20   4.212  -5.620   5.388
  220    HA   LEU  20           HA       LEU  20   2.472  -6.798   3.523
  221   1HB   LEU  20          2HB       LEU  20   2.049  -4.775   4.800
  222   2HB   LEU  20          3HB       LEU  20   3.208  -3.878   3.803
  223    HG   LEU  20           HG       LEU  20   1.192  -5.401   2.227
  224   1HD1  LEU  20          3HD1      LEU  20  -0.084  -4.543   4.402
  225   2HD1  LEU  20          1HD1      LEU  20  -0.132  -3.040   3.451
  226   3HD1  LEU  20          2HD1      LEU  20  -0.774  -4.542   2.788
  227   1HD2  LEU  20          1HD2      LEU  20   2.438  -2.656   2.191
  228   2HD2  LEU  20          2HD2      LEU  20   2.350  -3.883   0.941
  229   3HD2  LEU  20          3HD2      LEU  20   0.905  -2.931   1.353
  230    QB   LEU  20           QB       LEU  20   2.629  -4.326   4.302
  231    QD1  LEU  20           QD1      LEU  20  -0.330  -4.042   3.547
  232    QD2  LEU  20           QD2      LEU  20   1.897  -3.157   1.495
  233    QQD  LEU  20           QQD      LEU  20   0.784  -3.599   2.521
  234    H    ALA  21           HN       ALA  21   5.551  -5.007   2.948
  235    HA   ALA  21           HA       ALA  21   5.502  -5.005   0.144
  236   1HB   ALA  21          3HB       ALA  21   7.298  -4.091   1.880
  237   2HB   ALA  21          1HB       ALA  21   8.097  -5.633   1.540
  238   3HB   ALA  21          2HB       ALA  21   7.740  -4.517   0.215
  239    QB   ALA  21           QB       ALA  21   7.711  -4.747   1.212
  240    H    GLN  22           HN       GLN  22   6.584  -7.605   2.389
  241    HA   GLN  22           HA       GLN  22   7.297  -9.455   0.308
  242   1HB   GLN  22          2HB       GLN  22   6.406 -10.073   3.165
  243   2HB   GLN  22          3HB       GLN  22   7.113 -11.194   1.995
  244   1HG   GLN  22          2HG       GLN  22   9.070  -9.464   1.848
  245   2HG   GLN  22          3HG       GLN  22   8.436  -8.852   3.384
  246   1HE2  GLN  22          2HE2      GLN  22  11.064 -11.511   3.967
  247   2HE2  GLN  22          1HE2      GLN  22  11.052 -10.018   3.043
  248    QB   GLN  22           QB       GLN  22   6.760 -10.633   2.580
  249    QG   GLN  22           QG       GLN  22   8.754  -9.158   2.616
  250    QE2  GLN  22           QE2      GLN  22  11.058 -10.764   3.505
  251    H    LYS  23           HN       LYS  23   4.225  -8.963   2.102
  252    HA   LYS  23           HA       LYS  23   2.825 -11.091   0.763
  253   1HB   LYS  23          2HB       LYS  23   1.706  -8.539   1.987
  254   2HB   LYS  23          3HB       LYS  23   0.773  -9.975   1.571
  255   1HG   LYS  23          2HG       LYS  23   2.986  -9.875   3.680
  256   2HG   LYS  23          3HG       LYS  23   1.249  -9.801   3.977
  257   1HD   LYS  23          2HD       LYS  23   1.003 -12.091   2.996
  258   2HD   LYS  23          3HD       LYS  23   2.734 -12.130   2.657
  259   1HE   LYS  23          2HE       LYS  23   2.213 -13.414   4.669
  260   2HE   LYS  23          3HE       LYS  23   3.352 -12.100   4.975
  261   1HZ   LYS  23          1HZ       LYS  23   0.491 -11.769   5.495
  262   2HZ   LYS  23          2HZ       LYS  23   1.518 -12.436   6.599
  263   3HZ   LYS  23          3HZ       LYS  23   1.798 -10.913   6.089
  264    QB   LYS  23           QB       LYS  23   1.239  -9.258   1.779
  265    QG   LYS  23           QG       LYS  23   2.118  -9.839   3.829
  266    QD   LYS  23           QD       LYS  23   1.869 -12.110   2.827
  267    QE   LYS  23           QE       LYS  23   2.782 -12.757   4.822
  268    QZ   LYS  23           QZ       LYS  23   1.269 -11.706   6.061
  269    H    VAL  24           HN       VAL  24   3.378  -7.736  -0.154
  270    HA   VAL  24           HA       VAL  24   1.757  -7.841  -2.563
  271    HB   VAL  24           HB       VAL  24   3.948  -5.994  -1.532
  272   1HG1  VAL  24          1HG1      VAL  24   2.306  -5.762  -4.068
  273   2HG1  VAL  24          2HG1      VAL  24   3.223  -4.427  -3.356
  274   3HG1  VAL  24          3HG1      VAL  24   4.074  -5.852  -3.981
  275   1HG2  VAL  24          2HG2      VAL  24   1.718  -5.917  -0.384
  276   2HG2  VAL  24          3HG2      VAL  24   2.076  -4.450  -1.309
  277   3HG2  VAL  24          1HG2      VAL  24   0.954  -5.669  -1.955
  278    QG1  VAL  24           QG1      VAL  24   3.200  -5.347  -3.802
  279    QG2  VAL  24           QG2      VAL  24   1.583  -5.346  -1.215
  280    QQG  VAL  24           QQG      VAL  24   2.391  -5.347  -2.509
  281    H    GLY  25           HN       GLY  25   5.087  -8.729  -1.705
  282   1HA   GLY  25          1HA       GLY  25   6.520 -10.109  -2.901
  283   2HA   GLY  25          2HA       GLY  25   5.433 -10.091  -4.300
  284    QA   GLY  25           QA       GLY  25   5.976 -10.101  -3.601
  285    H    THR  26           HN       THR  26   6.689  -7.332  -2.440
  286    HA   THR  26           HA       THR  26   8.492  -6.537  -4.669
  287    HB   THR  26           HB       THR  26   6.367  -5.284  -4.886
  288    HG1  THR  26          1HG       THR  26   7.391  -3.338  -5.144
  289   1HG2  THR  26          3HG2      THR  26   6.006  -5.143  -2.279
  290   2HG2  THR  26          1HG2      THR  26   7.058  -3.723  -2.373
  291   3HG2  THR  26          2HG2      THR  26   5.555  -3.763  -3.293
  292    QG2  THR  26           QG2      THR  26   6.207  -4.209  -2.648
  293    H    THR  27           HN       THR  27   9.186  -4.181  -3.304
  294    HA   THR  27           HA       THR  27  10.859  -5.243  -1.040
  295    HB   THR  27           HB       THR  27  12.427  -3.398  -1.938
  296    HG1  THR  27          1HG       THR  27  10.439  -2.717  -3.317
  297   1HG2  THR  27          1HG2      THR  27  11.786  -5.826  -3.673
  298   2HG2  THR  27          2HG2      THR  27  13.236  -4.817  -3.834
  299   3HG2  THR  27          3HG2      THR  27  12.954  -5.731  -2.339
  300    QG2  THR  27           QG2      THR  27  12.658  -5.458  -3.282
  301    H    GLN  28           HN       GLN  28  10.889  -4.045   0.819
  302    HA   GLN  28           HA       GLN  28   8.827  -2.369   1.514
  303   1HB   GLN  28          2HB       GLN  28  10.395  -3.569   3.031
  304   2HB   GLN  28          3HB       GLN  28  11.610  -2.332   2.742
  305   1HG   GLN  28          2HG       GLN  28   8.915  -1.282   3.555
  306   2HG   GLN  28          3HG       GLN  28   9.647  -2.354   4.745
  307   1HE2  GLN  28          2HE2      GLN  28  10.646   1.125   5.578
  308   2HE2  GLN  28          1HE2      GLN  28   9.087   0.377   5.295
  309    QB   GLN  28           QB       GLN  28  11.002  -2.951   2.886
  310    QG   GLN  28           QG       GLN  28   9.281  -1.817   4.150
  311    QE2  GLN  28           QE2      GLN  28   9.866   0.751   5.437
  312    H    GLN  29           HN       GLN  29  11.932  -1.382   0.081
  313    HA   GLN  29           HA       GLN  29  11.863   1.363   0.358
  314   1HB   GLN  29          2HB       GLN  29  13.180   1.465  -1.611
  315   2HB   GLN  29          3HB       GLN  29  13.597  -0.040  -0.771
  316   1HG   GLN  29          2HG       GLN  29  12.059  -1.222  -2.384
  317   2HG   GLN  29          3HG       GLN  29  11.953   0.279  -3.318
  318   1HE2  GLN  29          2HE2      GLN  29  15.303   0.140  -4.535
  319   2HE2  GLN  29          1HE2      GLN  29  14.052   1.269  -4.047
  320    QB   GLN  29           QB       GLN  29  13.388   0.713  -1.191
  321    QG   GLN  29           QG       GLN  29  12.006  -0.472  -2.851
  322    QE2  GLN  29           QE2      GLN  29  14.677   0.704  -4.291
  323    H    SER  30           HN       SER  30  10.061  -0.615  -1.948
  324    HA   SER  30           HA       SER  30   8.933   1.578  -3.464
  325   1HB   SER  30          2HB       SER  30   7.997  -1.314  -3.174
  326   2HB   SER  30          3HB       SER  30   7.372  -0.128  -4.317
  327    HG   SER  30           HG       SER  30  10.119  -0.826  -4.201
  328    QB   SER  30           QB       SER  30   7.685  -0.721  -3.746
  329    H    ILE  31           HN       ILE  31   7.895  -0.293  -0.637
  330    HA   ILE  31           HA       ILE  31   5.239   0.819  -0.464
  331    HB   ILE  31           HB       ILE  31   6.983  -0.411   1.696
  332   1HG1  ILE  31          2HG1      ILE  31   6.811  -2.069  -0.050
  333   2HG1  ILE  31          3HG1      ILE  31   5.761  -2.497   1.299
  334   1HG2  ILE  31          3HG2      ILE  31   4.537   0.859   2.072
  335   2HG2  ILE  31          1HG2      ILE  31   4.100  -0.850   1.959
  336   3HG2  ILE  31          2HG2      ILE  31   5.310  -0.342   3.121
  337   1HD1  ILE  31          3HD1      ILE  31   3.926  -1.204  -0.236
  338   2HD1  ILE  31          1HD1      ILE  31   5.041  -1.743  -1.500
  339   3HD1  ILE  31          2HD1      ILE  31   4.304  -2.923  -0.406
  340    QG1  ILE  31           QG1      ILE  31   6.286  -2.283   0.624
  341    QG2  ILE  31           QG2      ILE  31   4.649  -0.111   2.384
  342    QD1  ILE  31           QD1      ILE  31   4.424  -1.956  -0.715
  343    H    GLU  32           HN       GLU  32   8.369   1.560   1.144
  344    HA   GLU  32           HA       GLU  32   7.530   3.789   2.683
  345   1HB   GLU  32          2HB       GLU  32   9.569   2.657   3.131
  346   2HB   GLU  32          3HB       GLU  32  10.191   2.932   1.513
  347   1HG   GLU  32          2HG       GLU  32   9.510   5.423   3.039
  348   2HG   GLU  32          3HG       GLU  32  10.781   4.438   3.757
  349    QB   GLU  32           QB       GLU  32   9.881   2.795   2.322
  350    QG   GLU  32           QG       GLU  32  10.146   4.931   3.397
  351    H    GLN  33           HN       GLN  33   9.130   3.765  -0.532
  352    HA   GLN  33           HA       GLN  33   8.897   6.441  -1.199
  353   1HB   GLN  33          2HB       GLN  33  10.116   5.242  -2.693
  354   2HB   GLN  33          3HB       GLN  33   8.997   3.876  -2.748
  355   1HG   GLN  33          2HG       GLN  33   7.588   4.791  -4.228
  356   2HG   GLN  33          3HG       GLN  33   8.058   6.471  -3.879
  357   1HE2  GLN  33          2HE2      GLN  33  10.209   4.363  -6.651
  358   2HE2  GLN  33          1HE2      GLN  33   9.148   3.497  -5.552
  359    QB   GLN  33           QB       GLN  33   9.556   4.559  -2.720
  360    QG   GLN  33           QG       GLN  33   7.823   5.631  -4.054
  361    QE2  GLN  33           QE2      GLN  33   9.679   3.931  -6.101
  362    H    LEU  34           HN       LEU  34   6.386   3.920  -1.857
  363    HA   LEU  34           HA       LEU  34   4.547   5.822  -2.871
  364   1HB   LEU  34          2HB       LEU  34   4.442   3.385  -3.271
  365   2HB   LEU  34          3HB       LEU  34   3.939   3.151  -1.592
  366    HG   LEU  34           HG       LEU  34   1.901   4.590  -2.072
  367   1HD1  LEU  34          1HD1      LEU  34   3.014   4.455  -4.902
  368   2HD1  LEU  34          2HD1      LEU  34   1.311   4.812  -4.551
  369   3HD1  LEU  34          3HD1      LEU  34   2.566   5.916  -3.986
  370   1HD2  LEU  34          3HD2      LEU  34   1.929   2.112  -2.164
  371   2HD2  LEU  34          1HD2      LEU  34   0.713   2.838  -3.238
  372   3HD2  LEU  34          2HD2      LEU  34   2.225   2.200  -3.916
  373    QB   LEU  34           QB       LEU  34   4.191   3.268  -2.431
  374    QD1  LEU  34           QD1      LEU  34   2.297   5.061  -4.479
  375    QD2  LEU  34           QD2      LEU  34   1.622   2.384  -3.106
  376    QQD  LEU  34           QQD      LEU  34   1.960   3.722  -3.792
  377    H    GLU  35           HN       GLU  35   4.963   4.601   0.493
  378    HA   GLU  35           HA       GLU  35   2.843   6.021   1.742
  379   1HB   GLU  35          2HB       GLU  35   5.541   5.048   2.683
  380   2HB   GLU  35          3HB       GLU  35   4.547   6.020   3.754
  381   1HG   GLU  35          2HG       GLU  35   3.263   3.646   2.451
  382   2HG   GLU  35          3HG       GLU  35   4.475   3.340   3.697
  383    QB   GLU  35           QB       GLU  35   5.044   5.534   3.219
  384    QG   GLU  35           QG       GLU  35   3.869   3.493   3.074
  385    H    ASN  36           HN       ASN  36   6.135   7.099   0.786
  386    HA   ASN  36           HA       ASN  36   5.825   9.730   1.965
  387   1HB   ASN  36          2HB       ASN  36   7.568   8.873  -0.345
  388   2HB   ASN  36          3HB       ASN  36   7.728  10.376   0.571
  389   1HD2  ASN  36          2HD2      ASN  36  10.128   7.550   1.674
  390   2HD2  ASN  36          1HD2      ASN  36   9.512   7.914   0.102
  391    QB   ASN  36           QB       ASN  36   7.649   9.624   0.113
  392    QD2  ASN  36           QD2      ASN  36   9.820   7.732   0.887
  393    H    GLY  37           HN       GLY  37   4.165   8.347  -0.682
  394   1HA   GLY  37          1HA       GLY  37   2.777   9.224  -2.234
  395   2HA   GLY  37          2HA       GLY  37   2.833  10.741  -1.324
  396    QA   GLY  37           QA       GLY  37   2.805   9.982  -1.779
  397    H    LYS  38           HN       LYS  38   5.687   9.220  -2.770
  398    HA   LYS  38           HA       LYS  38   5.987  11.576  -4.577
  399   1HB   LYS  38          2HB       LYS  38   8.296  11.112  -4.679
  400   2HB   LYS  38          3HB       LYS  38   7.753  11.108  -2.985
  401   1HG   LYS  38          2HG       LYS  38   7.780   8.653  -2.967
  402   2HG   LYS  38          3HG       LYS  38   8.205   8.621  -4.684
  403   1HD   LYS  38          2HD       LYS  38  10.105   8.090  -3.345
  404   2HD   LYS  38          3HD       LYS  38  10.403   9.571  -4.238
  405   1HE   LYS  38          2HE       LYS  38   9.386   9.603  -1.359
  406   2HE   LYS  38          3HE       LYS  38  11.099   9.354  -1.688
  407   1HZ   LYS  38          2HZ       LYS  38   9.619  11.684  -2.686
  408   2HZ   LYS  38          3HZ       LYS  38  10.422  11.663  -1.252
  409   3HZ   LYS  38          1HZ       LYS  38  11.248  11.456  -2.658
  410    QB   LYS  38           QB       LYS  38   8.024  11.110  -3.832
  411    QG   LYS  38           QG       LYS  38   7.992   8.636  -3.826
  412    QD   LYS  38           QD       LYS  38  10.254   8.831  -3.791
  413    QE   LYS  38           QE       LYS  38  10.243   9.479  -1.523
  414    QZ   LYS  38           QZ       LYS  38  10.430  11.600  -2.198
  415    H    THR  39           HN       THR  39   5.116   8.245  -4.735
  416    HA   THR  39           HA       THR  39   5.920   7.838  -7.524
  417    HB   THR  39           HB       THR  39   4.094   6.260  -5.706
  418    HG1  THR  39          1HG       THR  39   6.669   6.720  -5.570
  419   1HG2  THR  39          3HG2      THR  39   4.234   5.719  -8.350
  420   2HG2  THR  39          1HG2      THR  39   5.745   4.941  -7.854
  421   3HG2  THR  39          2HG2      THR  39   4.207   4.451  -7.131
  422    QG2  THR  39           QG2      THR  39   4.729   5.037  -7.778
  423    H    LYS  40           HN       LYS  40   4.603   7.929  -9.262
  424    HA   LYS  40           HA       LYS  40   2.005   9.312  -9.059
  425   1HB   LYS  40          2HB       LYS  40   3.878   8.564 -11.331
  426   2HB   LYS  40          3HB       LYS  40   2.260   9.197 -11.628
  427   1HG   LYS  40          2HG       LYS  40   4.349  10.620  -9.915
  428   2HG   LYS  40          3HG       LYS  40   4.111  10.905 -11.640
  429   1HD   LYS  40          2HD       LYS  40   2.517  12.420 -11.182
  430   2HD   LYS  40          3HD       LYS  40   1.505  11.113 -10.613
  431   1HE   LYS  40          2HE       LYS  40   1.538  12.794  -8.921
  432   2HE   LYS  40          3HE       LYS  40   2.423  11.406  -8.284
  433   1HZ   LYS  40          1HZ       LYS  40   3.672  13.801  -9.466
  434   2HZ   LYS  40          2HZ       LYS  40   3.499  13.517  -7.858
  435   3HZ   LYS  40          3HZ       LYS  40   4.465  12.543  -8.755
  436    QB   LYS  40           QB       LYS  40   3.068   8.880 -11.480
  437    QG   LYS  40           QG       LYS  40   4.230  10.763 -10.777
  438    QD   LYS  40           QD       LYS  40   2.011  11.766 -10.897
  439    QE   LYS  40           QE       LYS  40   1.981  12.100  -8.602
  440    QZ   LYS  40           QZ       LYS  40   3.879  13.287  -8.693
  441    NH1  ARG  41           NH2      ARG  41  -3.101   3.512 -13.968
  442    NH2  ARG  41           NH1      ARG  41  -2.129   3.282 -16.057
  443    H    ARG  41           HN       ARG  41   3.215   6.267 -10.645
  444    HA   ARG  41           HA       ARG  41   0.651   5.027  -9.910
  445   1HB   ARG  41          2HB       ARG  41   0.645   6.291 -12.220
  446   2HB   ARG  41          3HB       ARG  41   1.444   4.852 -12.830
  447   1HG   ARG  41          2HG       ARG  41  -1.059   4.565 -11.124
  448   2HG   ARG  41          3HG       ARG  41  -1.224   5.217 -12.739
  449   1HD   ARG  41          2HD       ARG  41   0.382   2.677 -12.465
  450   2HD   ARG  41          3HD       ARG  41  -1.341   2.553 -12.212
  451    HE   ARG  41           HE       ARG  41   0.005   3.011 -14.724
  452   1HH1  ARG  41          2HH2      ARG  41  -3.002   3.568 -12.966
  453   2HH1  ARG  41          1HH2      ARG  41  -4.022   3.623 -14.368
  454   1HH2  ARG  41          2HH1      ARG  41  -1.317   3.144 -16.642
  455   2HH2  ARG  41          1HH1      ARG  41  -3.024   3.406 -16.506
  456    QB   ARG  41           QB       ARG  41   1.045   5.571 -12.526
  457    QG   ARG  41           QG       ARG  41  -1.141   4.891 -11.932
  458    QD   ARG  41           QD       ARG  41  -0.479   2.615 -12.339
  459    QH1  ARG  41           QH2      ARG  41  -3.512   3.596 -13.667
  460    QH2  ARG  41           QH1      ARG  41  -2.170   3.275 -16.573
  461    HA   PRO  42           HA       PRO  42   4.143   2.141  -9.452
  462   1HB   PRO  42          2HB       PRO  42   3.009   0.569  -7.447
  463   2HB   PRO  42          3HB       PRO  42   3.978   2.037  -7.189
  464   1HG   PRO  42          2HG       PRO  42   1.041   1.662  -6.997
  465   2HG   PRO  42          3HG       PRO  42   2.055   2.837  -6.162
  466   1HD   PRO  42          2HD       PRO  42   0.441   3.390  -8.400
  467   2HD   PRO  42          3HD       PRO  42   1.763   4.425  -7.811
  468    QB   PRO  42           QB       PRO  42   3.493   1.303  -7.318
  469    QG   PRO  42           QG       PRO  42   1.547   2.250  -6.580
  470    QD   PRO  42           QD       PRO  42   1.102   3.908  -8.106
  471    NH1  ARG  43           NH2      ARG  43   4.735  -0.332 -15.888
  472    NH2  ARG  43           NH1      ARG  43   6.932  -1.057 -15.752
  473    H    ARG  43           HN       ARG  43   4.425  -0.097  -9.968
  474    HA   ARG  43           HA       ARG  43   2.451  -1.147 -11.814
  475   1HB   ARG  43          2HB       ARG  43   5.079  -1.429 -11.854
  476   2HB   ARG  43          3HB       ARG  43   4.785  -2.724 -10.689
  477   1HG   ARG  43          2HG       ARG  43   4.703  -3.911 -12.701
  478   2HG   ARG  43          3HG       ARG  43   2.996  -3.558 -12.454
  479   1HD   ARG  43          2HD       ARG  43   3.422  -2.996 -14.721
  480   2HD   ARG  43          3HD       ARG  43   3.357  -1.445 -13.865
  481    HE   ARG  43           HE       ARG  43   6.014  -2.698 -14.100
  482   1HH1  ARG  43          2HH2      ARG  43   3.770  -0.432 -15.614
  483   2HH1  ARG  43          1HH2      ARG  43   4.980   0.386 -16.553
  484   1HH2  ARG  43          2HH1      ARG  43   7.628  -1.686 -15.380
  485   2HH2  ARG  43          1HH1      ARG  43   7.227  -0.369 -16.429
  486    QB   ARG  43           QB       ARG  43   4.932  -2.077 -11.272
  487    QG   ARG  43           QG       ARG  43   3.849  -3.735 -12.577
  488    QD   ARG  43           QD       ARG  43   3.390  -2.220 -14.294
  489    QH1  ARG  43           QH2      ARG  43   4.375  -0.023 -16.083
  490    QH2  ARG  43           QH1      ARG  43   7.427  -1.027 -15.905
  491    H    PHE  44           HN       PHE  44   3.458  -1.756  -8.485
  492    HA   PHE  44           HA       PHE  44   1.797  -4.149  -8.179
  493   1HB   PHE  44          2HB       PHE  44   2.666  -4.035  -5.837
  494   2HB   PHE  44          3HB       PHE  44   3.895  -4.169  -7.071
  495    HD1  PHE  44          1HD       PHE  44   2.336  -1.907  -4.572
  496    HD2  PHE  44          2HD       PHE  44   5.523  -2.361  -7.434
  497    HE1  PHE  44          1HE       PHE  44   3.342   0.207  -3.781
  498    HE2  PHE  44          2HE       PHE  44   6.460  -0.175  -6.728
  499    HZ   PHE  44           HZ       PHE  44   5.337   1.141  -4.927
  500    QB   PHE  44           QB       PHE  44   3.280  -4.102  -6.454
  501    QR   PHE  44           QR       PHE  44   4.415  -1.060  -5.628
  502    H    LEU  45           HN       LEU  45   0.425  -1.534  -8.875
  503    HA   LEU  45           HA       LEU  45  -1.014  -0.667  -6.604
  504   1HB   LEU  45          2HB       LEU  45  -1.419  -0.555  -9.564
  505   2HB   LEU  45          3HB       LEU  45  -2.918  -0.528  -8.628
  506    HG   LEU  45           HG       LEU  45  -0.587   1.332  -8.291
  507   1HD1  LEU  45          1HD1      LEU  45  -1.922   1.631 -10.344
  508   2HD1  LEU  45          2HD1      LEU  45  -3.353   1.965  -9.363
  509   3HD1  LEU  45          3HD1      LEU  45  -1.951   3.044  -9.268
  510   1HD2  LEU  45          2HD2      LEU  45  -2.738   0.693  -6.424
  511   2HD2  LEU  45          3HD2      LEU  45  -1.444   1.901  -6.250
  512   3HD2  LEU  45          1HD2      LEU  45  -2.976   2.316  -7.017
  513    QB   LEU  45           QB       LEU  45  -2.168  -0.541  -9.096
  514    QD1  LEU  45           QD1      LEU  45  -2.409   2.213  -9.658
  515    QD2  LEU  45           QD2      LEU  45  -2.386   1.636  -6.564
  516    QQD  LEU  45           QQD      LEU  45  -2.398   1.925  -8.111
  517    HA   PRO  46           HA       PRO  46  -4.360  -3.919  -7.425
  518   1HB   PRO  46          2HB       PRO  46  -3.759  -6.213  -8.859
  519   2HB   PRO  46          3HB       PRO  46  -4.516  -4.747  -9.533
  520   1HG   PRO  46          2HG       PRO  46  -1.667  -5.642  -9.753
  521   2HG   PRO  46          3HG       PRO  46  -2.660  -4.762 -10.945
  522   1HD   PRO  46          2HD       PRO  46  -0.765  -3.651  -9.269
  523   2HD   PRO  46          3HD       PRO  46  -2.084  -2.714 -10.018
  524    QB   PRO  46           QB       PRO  46  -4.137  -5.480  -9.196
  525    QG   PRO  46           QG       PRO  46  -2.163  -5.202 -10.349
  526    QD   PRO  46           QD       PRO  46  -1.425  -3.183  -9.644
  527    H    GLU  47           HN       GLU  47  -0.987  -5.146  -7.270
  528    HA   GLU  47           HA       GLU  47  -1.540  -7.251  -5.461
  529   1HB   GLU  47          2HB       GLU  47   1.063  -5.734  -5.857
  530   2HB   GLU  47          3HB       GLU  47   0.846  -7.366  -5.184
  531   1HG   GLU  47          2HG       GLU  47  -0.331  -7.863  -7.495
  532   2HG   GLU  47          3HG       GLU  47   0.517  -6.403  -8.038
  533    QB   GLU  47           QB       GLU  47   0.955  -6.550  -5.520
  534    QG   GLU  47           QG       GLU  47   0.093  -7.132  -7.766
  535    H    LEU  48           HN       LEU  48  -0.567  -3.836  -4.933
  536    HA   LEU  48           HA       LEU  48  -0.487  -3.969  -2.090
  537   1HB   LEU  48          2HB       LEU  48   0.371  -2.086  -3.626
  538   2HB   LEU  48          3HB       LEU  48  -1.298  -1.534  -3.715
  539    HG   LEU  48           HG       LEU  48  -1.195  -1.463  -1.101
  540   1HD1  LEU  48          1HD1      LEU  48   1.783  -1.680  -1.790
  541   2HD1  LEU  48          2HD1      LEU  48   1.144  -1.142  -0.226
  542   3HD1  LEU  48          3HD1      LEU  48   0.828  -2.789  -0.792
  543   1HD2  LEU  48          3HD2      LEU  48  -1.075   0.589  -2.544
  544   2HD2  LEU  48          1HD2      LEU  48  -0.073   0.722  -1.096
  545   3HD2  LEU  48          2HD2      LEU  48   0.667   0.341  -2.673
  546    QB   LEU  48           QB       LEU  48  -0.463  -1.811  -3.670
  547    QD1  LEU  48           QD1      LEU  48   1.252  -1.871  -0.936
  548    QD2  LEU  48           QD2      LEU  48  -0.160   0.551  -2.105
  549    QQD  LEU  48           QQD      LEU  48   0.546  -0.659  -1.520
  550    H    ALA  49           HN       ALA  49  -3.097  -3.057  -4.376
  551    HA   ALA  49           HA       ALA  49  -5.086  -2.528  -2.456
  552   1HB   ALA  49          3HB       ALA  49  -5.095  -2.070  -4.968
  553   2HB   ALA  49          1HB       ALA  49  -5.639  -3.747  -5.177
  554   3HB   ALA  49          2HB       ALA  49  -6.615  -2.586  -4.248
  555    QB   ALA  49           QB       ALA  49  -5.783  -2.801  -4.797
  556    H    SER  50           HN       SER  50  -4.180  -5.606  -4.007
  557    HA   SER  50           HA       SER  50  -6.148  -7.259  -2.789
  558   1HB   SER  50          2HB       SER  50  -3.335  -7.974  -3.751
  559   2HB   SER  50          3HB       SER  50  -4.623  -9.115  -3.353
  560    HG   SER  50           HG       SER  50  -4.630  -7.143  -5.398
  561    QB   SER  50           QB       SER  50  -3.979  -8.544  -3.552
  562    H    ALA  51           HN       ALA  51  -2.680  -6.729  -1.846
  563    HA   ALA  51           HA       ALA  51  -2.804  -8.205   0.571
  564   1HB   ALA  51          3HB       ALA  51  -1.039  -5.867  -0.256
  565   2HB   ALA  51          1HB       ALA  51  -0.778  -6.867   1.189
  566   3HB   ALA  51          2HB       ALA  51  -0.685  -7.602  -0.422
  567    QB   ALA  51           QB       ALA  51  -0.834  -6.778   0.171
  568    H    LEU  52           HN       LEU  52  -3.708  -4.874  -0.161
  569    HA   LEU  52           HA       LEU  52  -4.264  -4.064   2.541
  570   1HB   LEU  52          2HB       LEU  52  -4.956  -2.999  -0.187
  571   2HB   LEU  52          3HB       LEU  52  -5.645  -2.319   1.252
  572    HG   LEU  52           HG       LEU  52  -3.237  -1.637   0.011
  573   1HD1  LEU  52          2HD1      LEU  52  -4.906  -0.588   2.138
  574   2HD1  LEU  52          3HD1      LEU  52  -3.193  -0.405   2.529
  575   3HD1  LEU  52          1HD1      LEU  52  -3.848   0.227   1.018
  576   1HD2  LEU  52          1HD2      LEU  52  -1.989  -3.398   1.183
  577   2HD2  LEU  52          2HD2      LEU  52  -1.500  -1.779   1.670
  578   3HD2  LEU  52          3HD2      LEU  52  -2.525  -2.729   2.752
  579    QB   LEU  52           QB       LEU  52  -5.300  -2.659   0.532
  580    QD1  LEU  52           QD1      LEU  52  -3.983  -0.255   1.895
  581    QD2  LEU  52           QD2      LEU  52  -2.005  -2.635   1.868
  582    QQD  LEU  52           QQD      LEU  52  -2.994  -1.445   1.881
  583    H    GLY  53           HN       GLY  53  -6.236  -5.494  -0.077
  584   1HA   GLY  53          1HA       GLY  53  -8.166  -6.761   0.143
  585   2HA   GLY  53          2HA       GLY  53  -8.310  -6.314   1.849
  586    QA   GLY  53           QA       GLY  53  -8.238  -6.538   0.996
  587    H    VAL  54           HN       VAL  54  -7.955  -4.226  -1.046
  588    HA   VAL  54           HA       VAL  54 -10.689  -3.165  -0.904
  589    HB   VAL  54           HB       VAL  54  -9.717  -0.766  -0.860
  590   1HG1  VAL  54          1HG1      VAL  54  -9.858  -2.402   1.642
  591   2HG1  VAL  54          2HG1      VAL  54  -9.682  -0.631   1.601
  592   3HG1  VAL  54          3HG1      VAL  54 -11.096  -1.414   0.882
  593   1HG2  VAL  54          2HG2      VAL  54  -7.248  -2.286  -0.130
  594   2HG2  VAL  54          3HG2      VAL  54  -7.456  -0.830  -1.082
  595   3HG2  VAL  54          1HG2      VAL  54  -7.570  -0.774   0.691
  596    QG1  VAL  54           QG1      VAL  54 -10.213  -1.482   1.375
  597    QG2  VAL  54           QG2      VAL  54  -7.425  -1.296  -0.174
  598    QQG  VAL  54           QQG      VAL  54  -8.818  -1.390   0.601
  599    H    SER  55           HN       SER  55 -10.641  -1.202  -2.687
  600    HA   SER  55           HA       SER  55  -9.584  -2.450  -5.111
  601   1HB   SER  55          2HB       SER  55 -11.166  -0.659  -6.078
  602   2HB   SER  55          3HB       SER  55 -11.894  -1.937  -5.067
  603    HG   SER  55           HG       SER  55 -11.834   0.691  -4.638
  604    QB   SER  55           QB       SER  55 -11.530  -1.298  -5.572
  605    H    VAL  56           HN       VAL  56  -8.502  -1.230  -6.698
  606    HA   VAL  56           HA       VAL  56  -6.308   0.278  -5.711
  607    HB   VAL  56           HB       VAL  56  -7.408  -0.311  -8.497
  608   1HG1  VAL  56          2HG1      VAL  56  -4.906   1.218  -7.748
  609   2HG1  VAL  56          3HG1      VAL  56  -5.168   0.474  -9.344
  610   3HG1  VAL  56          1HG1      VAL  56  -6.231   1.773  -8.796
  611   1HG2  VAL  56          3HG2      VAL  56  -6.392  -2.204  -7.181
  612   2HG2  VAL  56          1HG2      VAL  56  -5.495  -1.823  -8.657
  613   3HG2  VAL  56          2HG2      VAL  56  -4.882  -1.261  -7.092
  614    QG1  VAL  56           QG1      VAL  56  -5.435   1.155  -8.629
  615    QG2  VAL  56           QG2      VAL  56  -5.589  -1.763  -7.644
  616    QQG  VAL  56           QQG      VAL  56  -5.512  -0.304  -8.136
  617    H    ASP  57           HN       ASP  57  -9.180   1.263  -7.521
  618    HA   ASP  57           HA       ASP  57  -8.825   4.028  -7.718
  619   1HB   ASP  57          2HB       ASP  57 -11.379   4.058  -7.418
  620   2HB   ASP  57          3HB       ASP  57 -10.725   3.068  -8.716
  621    QB   ASP  57           QB       ASP  57 -11.052   3.563  -8.067
  622    CH2  TRP  58           CH2      TRP  58  -7.955   2.214   2.478
  623    H    TRP  58           HN       TRP  58  -9.960   2.138  -4.901
  624    HA   TRP  58           HA       TRP  58 -10.282   4.455  -3.344
  625   1HB   TRP  58          2HB       TRP  58 -11.537   2.508  -2.710
  626   2HB   TRP  58          3HB       TRP  58 -10.064   1.570  -2.454
  627    HD1  TRP  58           HD1      TRP  58 -12.320   4.120  -0.624
  628    HE1  TRP  58           HE1      TRP  58 -11.543   4.510   1.631
  629    HE3  TRP  58           HE3      TRP  58  -7.888   1.506  -0.855
  630    HZ2  TRP  58           HZ2      TRP  58  -9.481   3.380   3.469
  631    HZ3  TRP  58           HZ3      TRP  58  -6.490   1.311   1.186
  632    HH2  TRP  58           HH2      TRP  58  -7.364   2.061   3.369
  633    QB   TRP  58           QB       TRP  58 -10.801   2.039  -2.582
  634    H    LEU  59           HN       LEU  59  -7.631   2.135  -3.512
  635    HA   LEU  59           HA       LEU  59  -5.908   3.275  -1.590
  636   1HB   LEU  59          2HB       LEU  59  -5.665   1.551  -3.987
  637   2HB   LEU  59          3HB       LEU  59  -4.245   2.555  -3.761
  638    HG   LEU  59           HG       LEU  59  -5.453   0.693  -1.661
  639   1HD1  LEU  59          3HD1      LEU  59  -3.023   0.529  -3.490
  640   2HD1  LEU  59          1HD1      LEU  59  -3.353  -0.600  -2.148
  641   3HD1  LEU  59          2HD1      LEU  59  -4.459  -0.486  -3.527
  642   1HD2  LEU  59          3HD2      LEU  59  -3.201   2.717  -1.625
  643   2HD2  LEU  59          1HD2      LEU  59  -4.352   2.293  -0.340
  644   3HD2  LEU  59          2HD2      LEU  59  -3.011   1.205  -0.727
  645    QB   LEU  59           QB       LEU  59  -4.955   2.053  -3.874
  646    QD1  LEU  59           QD1      LEU  59  -3.612  -0.186  -3.055
  647    QD2  LEU  59           QD2      LEU  59  -3.521   2.072  -0.897
  648    QQD  LEU  59           QQD      LEU  59  -3.566   0.943  -1.977
  649    H    LEU  60           HN       LEU  60  -6.412   4.186  -5.005
  650    HA   LEU  60           HA       LEU  60  -4.659   6.471  -4.945
  651   1HB   LEU  60          2HB       LEU  60  -6.943   5.579  -6.705
  652   2HB   LEU  60          3HB       LEU  60  -6.324   7.215  -6.854
  653    HG   LEU  60           HG       LEU  60  -5.436   5.145  -8.306
  654   1HD1  LEU  60          2HD1      LEU  60  -3.969   7.638  -7.416
  655   2HD1  LEU  60          3HD1      LEU  60  -3.299   6.536  -8.634
  656   3HD1  LEU  60          1HD1      LEU  60  -4.854   7.325  -8.927
  657   1HD2  LEU  60          1HD2      LEU  60  -4.432   3.930  -6.392
  658   2HD2  LEU  60          2HD2      LEU  60  -3.279   4.390  -7.658
  659   3HD2  LEU  60          3HD2      LEU  60  -3.298   5.283  -6.143
  660    QB   LEU  60           QB       LEU  60  -6.634   6.397  -6.779
  661    QD1  LEU  60           QD1      LEU  60  -4.040   7.166  -8.326
  662    QD2  LEU  60           QD2      LEU  60  -3.670   4.534  -6.731
  663    QQD  LEU  60           QQD      LEU  60  -3.856   5.850  -7.529
  664    H    ASN  61           HN       ASN  61  -8.299   6.385  -4.451
  665    HA   ASN  61           HA       ASN  61  -7.973   8.718  -2.728
  666   1HB   ASN  61          2HB       ASN  61  -9.035  10.366  -4.047
  667   2HB   ASN  61          3HB       ASN  61  -7.589   9.800  -4.861
  668   1HD2  ASN  61          2HD2      ASN  61  -9.598   8.113  -7.479
  669   2HD2  ASN  61          1HD2      ASN  61  -8.352   7.610  -6.357
  670    QB   ASN  61           QB       ASN  61  -8.312  10.083  -4.455
  671    QD2  ASN  61           QD2      ASN  61  -8.975   7.862  -6.918
  672    H    GLY  62           HN       GLY  62  -9.321   6.234  -2.267
  673   1HA   GLY  62          1HA       GLY  62 -12.114   6.769  -2.778
  674   2HA   GLY  62          2HA       GLY  62 -11.473   5.376  -2.013
  675    QA   GLY  62           QA       GLY  62 -11.793   6.073  -2.396
  676    H    THR  63           HN       THR  63 -10.146   6.661   0.091
  677    HA   THR  63           HA       THR  63 -10.446   7.410   2.219
  678    HB   THR  63           HB       THR  63 -11.391   9.415   2.513
  679    HG1  THR  63          1HG       THR  63 -13.406   8.559   0.860
  680   1HG2  THR  63          1HG2      THR  63  -9.811   9.305   0.502
  681   2HG2  THR  63          2HG2      THR  63 -11.233   9.428  -0.542
  682   3HG2  THR  63          3HG2      THR  63 -10.850  10.746   0.564
  683    QG2  THR  63           QG2      THR  63 -10.632   9.826   0.174
  684    H    SER  64           HN       SER  64 -11.091   5.803   3.560
  685    HA   SER  64           HA       SER  64 -12.352   4.396   4.753
  686   1HB   SER  64          2HB       SER  64 -14.616   6.353   4.158
  687   2HB   SER  64          3HB       SER  64 -14.847   4.847   5.036
  688    HG   SER  64           HG       SER  64 -12.932   6.836   5.711
  689    QB   SER  64           QB       SER  64 -14.732   5.600   4.597
  690    H    ASP  65           HN       ASP  65 -12.923   2.355   4.286
  691    HA   ASP  65           HA       ASP  65 -14.165   1.813   1.625
  692   1HB   ASP  65          2HB       ASP  65 -13.544  -0.568   2.099
  693   2HB   ASP  65          3HB       ASP  65 -12.285   0.590   1.647
  694    QB   ASP  65           QB       ASP  65 -12.915   0.010   1.873
  695    H    SER  66           HN       SER  66 -16.246   2.052   1.795
  696    HA   SER  66           HA       SER  66 -17.869   1.539   4.111
  697   1HB   SER  66          2HB       SER  66 -18.720   3.022   2.410
  698   2HB   SER  66          3HB       SER  66 -18.544   1.774   1.150
  699    HG   SER  66           HG       SER  66 -20.108   0.563   2.157
  700    QB   SER  66           QB       SER  66 -18.632   2.398   1.780
  701    H    ASN  67           HN       ASN  67 -16.968  -0.507   4.744
  702    HA   ASN  67           HA       ASN  67 -16.997  -2.892   3.460
  703   1HB   ASN  67          2HB       ASN  67 -16.493  -2.192   5.980
  704   2HB   ASN  67          3HB       ASN  67 -18.102  -2.860   6.271
  705   1HD2  ASN  67          2HD2      ASN  67 -14.920  -5.309   5.718
  706   2HD2  ASN  67          1HD2      ASN  67 -14.747  -3.561   5.799
  707    QB   ASN  67           QB       ASN  67 -17.297  -2.526   6.125
  708    QD2  ASN  67           QD2      ASN  67 -14.833  -4.435   5.759
  709    H    VAL  68           HN       VAL  68 -19.861  -1.162   4.477
  710    HA   VAL  68           HA       VAL  68 -22.064  -1.554   4.399
  711    HB   VAL  68           HB       VAL  68 -21.578  -0.994   2.138
  712   1HG1  VAL  68          1HG1      VAL  68 -21.283  -3.964   1.552
  713   2HG1  VAL  68          2HG1      VAL  68 -21.542  -2.720   0.321
  714   3HG1  VAL  68          3HG1      VAL  68 -20.081  -2.679   1.304
  715   1HG2  VAL  68          2HG2      VAL  68 -23.940  -1.656   2.906
  716   2HG2  VAL  68          3HG2      VAL  68 -23.619  -1.529   1.168
  717   3HG2  VAL  68          1HG2      VAL  68 -23.710  -3.119   1.924
  718    QG1  VAL  68           QG1      VAL  68 -20.969  -3.121   1.059
  719    QG2  VAL  68           QG2      VAL  68 -23.756  -2.102   1.999
  720    QQG  VAL  68           QQG      VAL  68 -22.363  -2.611   1.529
  721    NH1  ARG  69           NH2      ARG  69 -27.565  -6.708   5.724
  722    NH2  ARG  69           NH1      ARG  69 -28.120  -7.451   7.851
  723    H    ARG  69           HN       ARG  69 -21.107  -3.142   6.095
  724    HA   ARG  69           HA       ARG  69 -21.224  -4.916   7.321
  725   1HB   ARG  69          2HB       ARG  69 -23.291  -5.675   8.013
  726   2HB   ARG  69          3HB       ARG  69 -23.477  -4.007   7.498
  727   1HG   ARG  69          2HG       ARG  69 -25.373  -4.847   6.567
  728   2HG   ARG  69          3HG       ARG  69 -24.290  -5.137   5.219
  729   1HD   ARG  69          2HD       ARG  69 -24.983  -7.299   5.310
  730   2HD   ARG  69          3HD       ARG  69 -23.908  -7.452   6.666
  731    HE   ARG  69           HE       ARG  69 -25.611  -7.540   8.160
  732   1HH1  ARG  69          2HH2      ARG  69 -26.844  -6.440   5.069
  733   2HH1  ARG  69          1HH2      ARG  69 -28.532  -6.640   5.443
  734   1HH2  ARG  69          2HH1      ARG  69 -27.838  -7.759   8.771
  735   2HH2  ARG  69          1HH1      ARG  69 -29.105  -7.384   7.647
  736    QB   ARG  69           QB       ARG  69 -23.384  -4.840   7.756
  737    QG   ARG  69           QG       ARG  69 -24.831  -4.991   5.894
  738    QD   ARG  69           QD       ARG  69 -24.446  -7.375   5.988
  739    QH1  ARG  69           QH2      ARG  69 -27.687  -6.540   5.255
  740    QH2  ARG  69           QH1      ARG  69 -28.471  -7.571   8.208
   
  Start of MODEL           6
 Raw file had 740 H/Q atoms
  Start of MODEL    6
    1    H    SER   1           HN       SER   1  -5.159  10.504   4.457
    2    HA   SER   1           HA       SER   1  -3.773  11.643   2.811
    3   1HB   SER   1          2HB       SER   1  -2.118  12.530   4.500
    4   2HB   SER   1          3HB       SER   1  -1.457  10.884   4.651
    5    HG   SER   1           HG       SER   1  -0.337  12.185   3.102
    6    QB   SER   1           QB       SER   1  -1.788  11.707   4.576
    7    H    ILE   2           HN       ILE   2  -1.918  10.412   1.560
    8    HA   ILE   2           HA       ILE   2  -2.904   7.847   0.770
    9    HB   ILE   2           HB       ILE   2  -1.751   9.332  -0.717
   10   1HG1  ILE   2          2HG1      ILE   2   0.208   7.270  -1.004
   11   2HG1  ILE   2          3HG1      ILE   2  -1.265   6.504  -0.414
   12   1HG2  ILE   2          1HG2      ILE   2   0.011  10.242   0.853
   13   2HG2  ILE   2          2HG2      ILE   2   0.919   8.735   0.601
   14   3HG2  ILE   2          3HG2      ILE   2   0.563   9.791  -0.763
   15   1HD1  ILE   2          2HD1      ILE   2  -2.478   7.852  -2.299
   16   2HD1  ILE   2          3HD1      ILE   2  -0.838   8.046  -2.972
   17   3HD1  ILE   2          1HD1      ILE   2  -1.533   6.431  -2.739
   18    QG1  ILE   2           QG1      ILE   2  -0.528   6.887  -0.708
   19    QG2  ILE   2           QG2      ILE   2   0.498   9.589   0.231
   20    QD1  ILE   2           QD1      ILE   2  -1.616   7.443  -2.670
   21    H    SER   3           HN       SER   3   0.128   8.712   2.508
   22    HA   SER   3           HA       SER   3   0.793   6.117   3.223
   23   1HB   SER   3          2HB       SER   3   2.429   7.888   3.532
   24   2HB   SER   3          3HB       SER   3   1.376   8.785   4.595
   25    HG   SER   3           HG       SER   3   2.593   6.256   5.171
   26    QB   SER   3           QB       SER   3   1.902   8.337   4.063
   27    H    SER   4           HN       SER   4  -1.366   8.399   4.979
   28    HA   SER   4           HA       SER   4  -1.842   6.805   7.205
   29   1HB   SER   4          2HB       SER   4  -4.222   8.160   5.999
   30   2HB   SER   4          3HB       SER   4  -3.616   8.161   7.644
   31    HG   SER   4           HG       SER   4  -2.120   9.670   7.114
   32    QB   SER   4           QB       SER   4  -3.919   8.160   6.822
   33    NH1  ARG   5           NH2      ARG   5  -5.677   9.296   0.957
   34    NH2  ARG   5           NH1      ARG   5  -5.256   8.960  -1.298
   35    H    ARG   5           HN       ARG   5  -3.273   6.510   3.873
   36    HA   ARG   5           HA       ARG   5  -5.326   4.677   4.770
   37   1HB   ARG   5          2HB       ARG   5  -4.323   4.601   1.922
   38   2HB   ARG   5          3HB       ARG   5  -5.916   4.383   2.614
   39   1HG   ARG   5          2HG       ARG   5  -5.745   6.882   3.324
   40   2HG   ARG   5          3HG       ARG   5  -4.439   6.915   2.108
   41   1HD   ARG   5          2HD       ARG   5  -6.801   5.590   1.048
   42   2HD   ARG   5          3HD       ARG   5  -7.243   7.163   1.677
   43    HE   ARG   5           HE       ARG   5  -5.778   6.554  -0.735
   44   1HH1  ARG   5          2HH2      ARG   5  -5.903   8.885   1.851
   45   2HH1  ARG   5          1HH2      ARG   5  -5.591  10.296   0.861
   46   1HH2  ARG   5          2HH1      ARG   5  -5.266   8.358  -2.112
   47   2HH2  ARG   5          1HH1      ARG   5  -5.059   9.940  -1.437
   48    QB   ARG   5           QB       ARG   5  -5.119   4.492   2.268
   49    QG   ARG   5           QG       ARG   5  -5.092   6.898   2.716
   50    QD   ARG   5           QD       ARG   5  -7.022   6.377   1.363
   51    QH1  ARG   5           QH2      ARG   5  -5.747   9.591   1.356
   52    QH2  ARG   5           QH1      ARG   5  -5.162   9.149  -1.774
   53    H    VAL   6           HN       VAL   6  -2.216   4.277   3.119
   54    HA   VAL   6           HA       VAL   6  -2.244   1.455   2.890
   55    HB   VAL   6           HB       VAL   6   0.170   3.257   3.230
   56   1HG1  VAL   6          2HG1      VAL   6   0.135   0.483   2.969
   57   2HG1  VAL   6          3HG1      VAL   6   0.325   0.996   1.307
   58   3HG1  VAL   6          1HG1      VAL   6   1.483   1.551   2.499
   59   1HG2  VAL   6          3HG2      VAL   6  -1.540   3.941   1.304
   60   2HG2  VAL   6          1HG2      VAL   6   0.191   3.851   0.994
   61   3HG2  VAL   6          2HG2      VAL   6  -0.889   2.547   0.477
   62    QG1  VAL   6           QG1      VAL   6   0.647   1.010   2.258
   63    QG2  VAL   6           QG2      VAL   6  -0.746   3.447   0.925
   64    QQG  VAL   6           QQG      VAL   6  -0.049   2.228   1.592
   65    H    LYS   7           HN       LYS   7  -0.827   3.599   5.430
   66    HA   LYS   7           HA       LYS   7   0.072   1.463   7.125
   67   1HB   LYS   7          2HB       LYS   7   0.909   3.818   7.112
   68   2HB   LYS   7          3HB       LYS   7  -0.573   4.324   7.935
   69   1HG   LYS   7          2HG       LYS   7  -0.054   2.851   9.838
   70   2HG   LYS   7          3HG       LYS   7   1.331   2.171   8.970
   71   1HD   LYS   7          2HD       LYS   7   2.281   4.546   8.851
   72   2HD   LYS   7          3HD       LYS   7   1.039   5.031  10.005
   73   1HE   LYS   7          2HE       LYS   7   3.159   2.849  10.439
   74   2HE   LYS   7          3HE       LYS   7   3.293   4.508  11.023
   75   1HZ   LYS   7          2HZ       LYS   7   1.161   2.654  11.839
   76   2HZ   LYS   7          3HZ       LYS   7   2.522   2.961  12.703
   77   3HZ   LYS   7          1HZ       LYS   7   1.431   4.159  12.439
   78    QB   LYS   7           QB       LYS   7   0.168   4.070   7.523
   79    QG   LYS   7           QG       LYS   7   0.639   2.511   9.404
   80    QD   LYS   7           QD       LYS   7   1.660   4.789   9.427
   81    QE   LYS   7           QE       LYS   7   3.226   3.679  10.732
   82    QZ   LYS   7           QZ       LYS   7   1.704   3.258  12.327
   83    H    SER   8           HN       SER   8  -2.892   3.522   7.329
   84    HA   SER   8           HA       SER   8  -4.020   2.453   9.646
   85   1HB   SER   8          2HB       SER   8  -5.428   3.339   7.090
   86   2HB   SER   8          3HB       SER   8  -6.259   2.932   8.595
   87    HG   SER   8           HG       SER   8  -4.378   4.996   8.165
   88    QB   SER   8           QB       SER   8  -5.844   3.136   7.843
   89    H    LYS   9           HN       LYS   9  -4.305   1.161   6.232
   90    HA   LYS   9           HA       LYS   9  -6.012  -0.941   7.151
   91   1HB   LYS   9          2HB       LYS   9  -5.765   0.052   4.773
   92   2HB   LYS   9          3HB       LYS   9  -4.328  -0.953   4.676
   93   1HG   LYS   9          2HG       LYS   9  -6.039  -2.403   3.801
   94   2HG   LYS   9          3HG       LYS   9  -6.028  -2.855   5.515
   95   1HD   LYS   9          2HD       LYS   9  -7.869  -1.012   5.712
   96   2HD   LYS   9          3HD       LYS   9  -7.993  -1.117   3.966
   97   1HE   LYS   9          2HE       LYS   9  -8.204  -3.530   5.866
   98   2HE   LYS   9          3HE       LYS   9  -9.598  -2.583   5.344
   99   1HZ   LYS   9          2HZ       LYS   9  -7.849  -4.180   3.524
  100   2HZ   LYS   9          3HZ       LYS   9  -9.330  -4.578   4.066
  101   3HZ   LYS   9          1HZ       LYS   9  -9.180  -3.301   3.084
  102    QB   LYS   9           QB       LYS   9  -5.047  -0.450   4.724
  103    QG   LYS   9           QG       LYS   9  -6.034  -2.629   4.659
  104    QD   LYS   9           QD       LYS   9  -7.931  -1.064   4.839
  105    QE   LYS   9           QE       LYS   9  -8.901  -3.057   5.605
  106    QZ   LYS   9           QZ       LYS   9  -8.787  -4.020   3.558
  107    NH1  ARG  10           NH2      ARG  10   1.729   1.121   5.090
  108    NH2  ARG  10           NH1      ARG  10   3.056   1.804   6.832
  109    H    ARG  10           HN       ARG  10  -2.479  -0.626   6.588
  110    HA   ARG  10           HA       ARG  10  -1.606  -3.211   7.165
  111   1HB   ARG  10          2HB       ARG  10  -0.434  -0.812   6.679
  112   2HB   ARG  10          3HB       ARG  10  -0.072  -0.917   8.390
  113   1HG   ARG  10          2HG       ARG  10   1.473  -2.565   8.054
  114   2HG   ARG  10          3HG       ARG  10   0.589  -3.319   6.727
  115   1HD   ARG  10          2HD       ARG  10   2.601  -2.323   5.888
  116   2HD   ARG  10          3HD       ARG  10   1.234  -1.460   5.230
  117    HE   ARG  10           HE       ARG  10   3.012  -0.558   7.504
  118   1HH1  ARG  10          2HH2      ARG  10   1.144   0.426   4.656
  119   2HH1  ARG  10          1HH2      ARG  10   1.766   2.062   4.714
  120   1HH2  ARG  10          2HH1      ARG  10   3.595   1.649   7.666
  121   2HH2  ARG  10          1HH1      ARG  10   3.127   2.724   6.382
  122    QB   ARG  10           QB       ARG  10  -0.253  -0.864   7.535
  123    QG   ARG  10           QG       ARG  10   1.032  -2.942   7.391
  124    QD   ARG  10           QD       ARG  10   1.917  -1.891   5.558
  125    QH1  ARG  10           QH2      ARG  10   1.455   1.244   4.686
  126    QH2  ARG  10           QH1      ARG  10   3.361   2.186   7.024
  127    H    ILE  11           HN       ILE  11  -2.395  -0.583   9.458
  128    HA   ILE  11           HA       ILE  11  -1.758  -1.993  11.855
  129    HB   ILE  11           HB       ILE  11  -3.680   0.316  11.476
  130   1HG1  ILE  11          2HG1      ILE  11  -1.709   1.322  10.830
  131   2HG1  ILE  11          3HG1      ILE  11  -1.623   1.500  12.557
  132   1HG2  ILE  11          1HG2      ILE  11  -3.921  -0.933  13.670
  133   2HG2  ILE  11          2HG2      ILE  11  -2.228  -0.525  14.004
  134   3HG2  ILE  11          3HG2      ILE  11  -3.442   0.755  13.808
  135   1HD1  ILE  11          1HD1      ILE  11  -0.127  -0.510  12.695
  136   2HD1  ILE  11          2HD1      ILE  11  -0.109  -0.573  10.916
  137   3HD1  ILE  11          3HD1      ILE  11   0.554   0.820  11.749
  138    QG1  ILE  11           QG1      ILE  11  -1.667   1.412  11.693
  139    QG2  ILE  11           QG2      ILE  11  -3.197  -0.234  13.827
  140    QD1  ILE  11           QD1      ILE  11   0.106  -0.087  11.787
  141    H    GLN  12           HN       GLN  12  -4.976  -1.386  10.281
  142    HA   GLN  12           HA       GLN  12  -6.339  -2.991  12.172
  143   1HB   GLN  12          2HB       GLN  12  -8.243  -2.740  10.984
  144   2HB   GLN  12          3HB       GLN  12  -7.309  -1.367  10.387
  145   1HG   GLN  12          2HG       GLN  12  -6.732  -2.715   8.368
  146   2HG   GLN  12          3HG       GLN  12  -7.696  -4.061   8.982
  147   1HE2  GLN  12          2HE2      GLN  12 -10.722  -2.746   7.771
  148   2HE2  GLN  12          1HE2      GLN  12  -9.873  -4.101   8.490
  149    QB   GLN  12           QB       GLN  12  -7.776  -2.053  10.685
  150    QG   GLN  12           QG       GLN  12  -7.214  -3.388   8.675
  151    QE2  GLN  12           QE2      GLN  12 -10.298  -3.424   8.131
  152    H    LEU  13           HN       LEU  13  -4.660  -3.938   9.201
  153    HA   LEU  13           HA       LEU  13  -5.314  -6.764   9.290
  154   1HB   LEU  13          2HB       LEU  13  -3.333  -4.972   7.902
  155   2HB   LEU  13          3HB       LEU  13  -2.889  -6.638   8.032
  156    HG   LEU  13           HG       LEU  13  -4.144  -5.777   5.945
  157   1HD1  LEU  13          1HD1      LEU  13  -4.138  -8.374   7.303
  158   2HD1  LEU  13          2HD1      LEU  13  -5.481  -8.193   6.162
  159   3HD1  LEU  13          3HD1      LEU  13  -3.814  -7.943   5.615
  160   1HD2  LEU  13          3HD2      LEU  13  -6.104  -4.828   7.195
  161   2HD2  LEU  13          1HD2      LEU  13  -6.506  -5.947   5.878
  162   3HD2  LEU  13          2HD2      LEU  13  -6.614  -6.495   7.556
  163    QB   LEU  13           QB       LEU  13  -3.111  -5.805   7.967
  164    QD1  LEU  13           QD1      LEU  13  -4.478  -8.171   6.360
  165    QD2  LEU  13           QD2      LEU  13  -6.409  -5.757   6.876
  166    QQD  LEU  13           QQD      LEU  13  -5.443  -6.963   6.618
  167    H    GLY  14           HN       GLY  14  -2.949  -4.756  10.957
  168   1HA   GLY  14          1HA       GLY  14  -1.848  -5.262  12.924
  169   2HA   GLY  14          2HA       GLY  14  -2.318  -6.963  12.787
  170    QA   GLY  14           QA       GLY  14  -2.082  -6.113  12.856
  171    H    LEU  15           HN       LEU  15  -0.855  -5.291  10.040
  172    HA   LEU  15           HA       LEU  15   1.632  -6.947  10.403
  173   1HB   LEU  15          2HB       LEU  15   0.343  -6.074   7.793
  174   2HB   LEU  15          3HB       LEU  15   1.783  -7.074   7.994
  175    HG   LEU  15           HG       LEU  15  -1.099  -7.815   8.612
  176   1HD1  LEU  15          1HD1      LEU  15  -0.249  -7.997   6.259
  177   2HD1  LEU  15          2HD1      LEU  15   1.043  -9.068   6.860
  178   3HD1  LEU  15          3HD1      LEU  15  -0.655  -9.576   6.975
  179   1HD2  LEU  15          1HD2      LEU  15   1.431  -9.366   9.322
  180   2HD2  LEU  15          2HD2      LEU  15   0.176  -8.813  10.448
  181   3HD2  LEU  15          3HD2      LEU  15  -0.195 -10.070   9.273
  182    QB   LEU  15           QB       LEU  15   1.063  -6.574   7.893
  183    QD1  LEU  15           QD1      LEU  15   0.047  -8.880   6.698
  184    QD2  LEU  15           QD2      LEU  15   0.471  -9.416   9.681
  185    QQD  LEU  15           QQD      LEU  15   0.259  -9.148   8.190
  186    H    ASN  16           HN       ASN  16   3.463  -6.000   9.132
  187    HA   ASN  16           HA       ASN  16   3.520  -3.003   9.400
  188   1HB   ASN  16          2HB       ASN  16   5.702  -3.068  10.081
  189   2HB   ASN  16          3HB       ASN  16   5.023  -4.473  10.896
  190   1HD2  ASN  16          2HD2      ASN  16   6.936  -6.820   8.908
  191   2HD2  ASN  16          1HD2      ASN  16   5.372  -6.657   9.673
  192    QB   ASN  16           QB       ASN  16   5.362  -3.771  10.488
  193    QD2  ASN  16           QD2      ASN  16   6.154  -6.738   9.290
  194    H    GLN  17           HN       GLN  17   5.461  -2.086   8.066
  195    HA   GLN  17           HA       GLN  17   4.664  -1.976   5.343
  196   1HB   GLN  17          2HB       GLN  17   7.187  -1.200   6.783
  197   2HB   GLN  17          3HB       GLN  17   6.885  -0.820   5.067
  198   1HG   GLN  17          2HG       GLN  17   5.073   0.598   5.597
  199   2HG   GLN  17          3HG       GLN  17   5.053   0.047   7.299
  200   1HE2  GLN  17          2HE2      GLN  17   7.414   3.160   6.343
  201   2HE2  GLN  17          1HE2      GLN  17   6.142   2.583   5.289
  202    QB   GLN  17           QB       GLN  17   7.036  -1.010   5.926
  203    QG   GLN  17           QG       GLN  17   5.063   0.323   6.449
  204    QE2  GLN  17           QE2      GLN  17   6.778   2.872   5.816
  205    H    ALA  18           HN       ALA  18   7.407  -3.801   6.842
  206    HA   ALA  18           HA       ALA  18   8.456  -4.668   4.320
  207   1HB   ALA  18          3HB       ALA  18   9.797  -4.548   6.372
  208   2HB   ALA  18          1HB       ALA  18   8.834  -5.856   7.095
  209   3HB   ALA  18          2HB       ALA  18   9.832  -6.173   5.661
  210    QB   ALA  18           QB       ALA  18   9.487  -5.526   6.377
  211    H    GLU  19           HN       GLU  19   6.343  -6.254   6.747
  212    HA   GLU  19           HA       GLU  19   5.863  -8.727   5.421
  213   1HB   GLU  19          2HB       GLU  19   4.293  -6.938   7.286
  214   2HB   GLU  19          3HB       GLU  19   3.507  -8.347   6.582
  215   1HG   GLU  19          2HG       GLU  19   5.034  -9.880   7.547
  216   2HG   GLU  19          3HG       GLU  19   6.116  -8.605   8.109
  217    QB   GLU  19           QB       GLU  19   3.900  -7.643   6.934
  218    QG   GLU  19           QG       GLU  19   5.575  -9.243   7.828
  219    H    LEU  20           HN       LEU  20   4.136  -5.585   5.260
  220    HA   LEU  20           HA       LEU  20   2.211  -6.386   3.404
  221   1HB   LEU  20          2HB       LEU  20   2.494  -4.163   4.757
  222   2HB   LEU  20          3HB       LEU  20   3.402  -3.611   3.344
  223    HG   LEU  20           HG       LEU  20   1.201  -4.715   2.145
  224   1HD1  LEU  20          3HD1      LEU  20   0.440  -5.195   4.656
  225   2HD1  LEU  20          1HD1      LEU  20  -0.145  -3.526   4.567
  226   3HD1  LEU  20          2HD1      LEU  20  -0.714  -4.752   3.414
  227   1HD2  LEU  20          1HD2      LEU  20   2.119  -2.062   2.595
  228   2HD2  LEU  20          2HD2      LEU  20   0.975  -2.678   1.403
  229   3HD2  LEU  20          3HD2      LEU  20   0.403  -2.044   2.951
  230    QB   LEU  20           QB       LEU  20   2.949  -3.888   4.051
  231    QD1  LEU  20           QD1      LEU  20  -0.140  -4.491   4.212
  232    QD2  LEU  20           QD2      LEU  20   1.166  -2.261   2.316
  233    QQD  LEU  20           QQD      LEU  20   0.514  -3.376   3.264
  234    H    ALA  21           HN       ALA  21   5.406  -4.843   2.789
  235    HA   ALA  21           HA       ALA  21   5.488  -4.928  -0.004
  236   1HB   ALA  21          3HB       ALA  21   7.490  -4.856   2.181
  237   2HB   ALA  21          1HB       ALA  21   8.074  -5.512   0.645
  238   3HB   ALA  21          2HB       ALA  21   7.334  -3.908   0.702
  239    QB   ALA  21           QB       ALA  21   7.633  -4.759   1.176
  240    H    GLN  22           HN       GLN  22   6.397  -7.578   2.252
  241    HA   GLN  22           HA       GLN  22   7.009  -9.468   0.218
  242   1HB   GLN  22          2HB       GLN  22   6.148  -9.652   3.107
  243   2HB   GLN  22          3HB       GLN  22   6.064 -11.113   2.132
  244   1HG   GLN  22          2HG       GLN  22   8.537  -9.354   2.389
  245   2HG   GLN  22          3HG       GLN  22   8.228 -10.799   3.370
  246   1HE2  GLN  22          2HE2      GLN  22  10.331 -11.653   0.306
  247   2HE2  GLN  22          1HE2      GLN  22  10.493 -10.378   1.502
  248    QB   GLN  22           QB       GLN  22   6.107 -10.382   2.620
  249    QG   GLN  22           QG       GLN  22   8.383 -10.077   2.879
  250    QE2  GLN  22           QE2      GLN  22  10.412 -11.015   0.903
  251    H    LYS  23           HN       LYS  23   3.842  -8.810   1.794
  252    HA   LYS  23           HA       LYS  23   2.426 -10.752   0.203
  253   1HB   LYS  23          2HB       LYS  23   1.439  -8.288   1.661
  254   2HB   LYS  23          3HB       LYS  23   0.392  -9.549   0.974
  255   1HG   LYS  23          2HG       LYS  23   1.414 -11.245   2.474
  256   2HG   LYS  23          3HG       LYS  23   2.553 -10.050   3.063
  257   1HD   LYS  23          2HD       LYS  23   1.165  -9.708   4.720
  258   2HD   LYS  23          3HD       LYS  23   0.253  -8.690   3.617
  259   1HE   LYS  23          2HE       LYS  23  -0.261 -11.629   4.313
  260   2HE   LYS  23          3HE       LYS  23  -1.220 -10.243   4.842
  261   1HZ   LYS  23          2HZ       LYS  23  -1.856  -9.844   2.565
  262   2HZ   LYS  23          3HZ       LYS  23  -0.969 -11.146   2.059
  263   3HZ   LYS  23          1HZ       LYS  23  -2.269 -11.361   3.042
  264    QB   LYS  23           QB       LYS  23   0.915  -8.919   1.317
  265    QG   LYS  23           QG       LYS  23   1.983 -10.647   2.768
  266    QD   LYS  23           QD       LYS  23   0.709  -9.200   4.169
  267    QE   LYS  23           QE       LYS  23  -0.741 -10.936   4.578
  268    QZ   LYS  23           QZ       LYS  23  -1.698 -10.784   2.556
  269    H    VAL  24           HN       VAL  24   3.284  -7.390  -0.386
  270    HA   VAL  24           HA       VAL  24   1.733  -7.040  -2.809
  271    HB   VAL  24           HB       VAL  24   4.200  -5.645  -1.747
  272   1HG1  VAL  24          1HG1      VAL  24   3.901  -5.137  -4.156
  273   2HG1  VAL  24          2HG1      VAL  24   2.226  -4.653  -3.832
  274   3HG1  VAL  24          3HG1      VAL  24   3.583  -3.739  -3.131
  275   1HG2  VAL  24          3HG2      VAL  24   1.597  -5.554  -0.641
  276   2HG2  VAL  24          1HG2      VAL  24   2.968  -4.474  -0.310
  277   3HG2  VAL  24          2HG2      VAL  24   1.809  -4.055  -1.546
  278    QG1  VAL  24           QG1      VAL  24   3.237  -4.509  -3.706
  279    QG2  VAL  24           QG2      VAL  24   2.125  -4.695  -0.832
  280    QQG  VAL  24           QQG      VAL  24   2.681  -4.602  -2.269
  281    H    GLY  25           HN       GLY  25   4.785  -8.633  -1.981
  282   1HA   GLY  25          1HA       GLY  25   6.189  -9.886  -3.285
  283   2HA   GLY  25          2HA       GLY  25   5.126  -9.647  -4.685
  284    QA   GLY  25           QA       GLY  25   5.657  -9.766  -3.985
  285    H    THR  26           HN       THR  26   6.686  -7.233  -2.552
  286    HA   THR  26           HA       THR  26   8.721  -6.595  -4.556
  287    HB   THR  26           HB       THR  26   6.809  -5.158  -5.221
  288    HG1  THR  26          1HG       THR  26   8.137  -3.114  -4.834
  289   1HG2  THR  26          1HG2      THR  26   5.853  -4.861  -2.916
  290   2HG2  THR  26          2HG2      THR  26   7.159  -3.746  -2.538
  291   3HG2  THR  26          3HG2      THR  26   6.013  -3.354  -3.836
  292    QG2  THR  26           QG2      THR  26   6.342  -3.987  -3.096
  293    H    THR  27           HN       THR  27   9.508  -4.237  -3.265
  294    HA   THR  27           HA       THR  27  10.534  -5.261  -0.641
  295    HB   THR  27           HB       THR  27  12.287  -3.441  -1.165
  296    HG1  THR  27          1HG       THR  27  11.344  -2.275  -2.766
  297   1HG2  THR  27          3HG2      THR  27  12.048  -6.158  -2.047
  298   2HG2  THR  27          1HG2      THR  27  12.657  -5.252  -3.435
  299   3HG2  THR  27          2HG2      THR  27  13.530  -5.202  -1.892
  300    QG2  THR  27           QG2      THR  27  12.745  -5.538  -2.458
  301    H    GLN  28           HN       GLN  28  10.550  -3.913   1.160
  302    HA   GLN  28           HA       GLN  28   8.454  -2.289   1.848
  303   1HB   GLN  28          2HB       GLN  28  10.146  -3.078   3.436
  304   2HB   GLN  28          3HB       GLN  28  11.365  -2.008   2.714
  305   1HG   GLN  28          2HG       GLN  28  10.052  -0.014   3.401
  306   2HG   GLN  28          3HG       GLN  28   8.780  -1.080   4.013
  307   1HE2  GLN  28          2HE2      GLN  28  10.526  -0.217   7.059
  308   2HE2  GLN  28          1HE2      GLN  28   9.255   0.359   6.004
  309    QB   GLN  28           QB       GLN  28  10.755  -2.543   3.074
  310    QG   GLN  28           QG       GLN  28   9.415  -0.547   3.707
  311    QE2  GLN  28           QE2      GLN  28   9.891   0.071   6.531
  312    H    GLN  29           HN       GLN  29  11.498  -1.262   0.347
  313    HA   GLN  29           HA       GLN  29  11.198   1.432   0.351
  314   1HB   GLN  29          2HB       GLN  29  12.962  -0.363  -0.840
  315   2HB   GLN  29          3HB       GLN  29  12.206   0.348  -2.266
  316   1HG   GLN  29          2HG       GLN  29  14.271   1.541  -1.585
  317   2HG   GLN  29          3HG       GLN  29  12.857   2.605  -1.472
  318   1HE2  GLN  29          2HE2      GLN  29  13.125   3.147   1.997
  319   2HE2  GLN  29          1HE2      GLN  29  12.731   3.777   0.435
  320    QB   GLN  29           QB       GLN  29  12.584  -0.007  -1.553
  321    QG   GLN  29           QG       GLN  29  13.564   2.074  -1.528
  322    QE2  GLN  29           QE2      GLN  29  12.928   3.462   1.217
  323    H    SER  30           HN       SER  30   9.393  -0.776  -1.703
  324    HA   SER  30           HA       SER  30   8.332   1.199  -3.521
  325   1HB   SER  30          2HB       SER  30   7.077  -1.411  -2.584
  326   2HB   SER  30          3HB       SER  30   6.683  -0.507  -4.048
  327    HG   SER  30           HG       SER  30   9.100  -1.836  -3.398
  328    QB   SER  30           QB       SER  30   6.880  -0.958  -3.316
  329    H    ILE  31           HN       ILE  31   7.045  -0.260  -0.434
  330    HA   ILE  31           HA       ILE  31   4.690   1.329  -0.391
  331    HB   ILE  31           HB       ILE  31   6.185  -0.306   1.717
  332   1HG1  ILE  31          2HG1      ILE  31   4.220  -1.761   1.464
  333   2HG1  ILE  31          3HG1      ILE  31   3.613  -0.686   0.171
  334   1HG2  ILE  31          2HG2      ILE  31   3.690   1.394   1.921
  335   2HG2  ILE  31          3HG2      ILE  31   3.858  -0.069   2.911
  336   3HG2  ILE  31          1HG2      ILE  31   5.051   1.218   3.050
  337   1HD1  ILE  31          2HD1      ILE  31   6.249  -2.140  -0.026
  338   2HD1  ILE  31          3HD1      ILE  31   4.701  -2.892  -0.481
  339   3HD1  ILE  31          1HD1      ILE  31   5.239  -1.458  -1.338
  340    QG1  ILE  31           QG1      ILE  31   3.917  -1.224   0.818
  341    QG2  ILE  31           QG2      ILE  31   4.200   0.848   2.627
  342    QD1  ILE  31           QD1      ILE  31   5.396  -2.163  -0.615
  343    H    GLU  32           HN       GLU  32   7.838   1.608   1.328
  344    HA   GLU  32           HA       GLU  32   7.321   3.993   2.731
  345   1HB   GLU  32          2HB       GLU  32   9.380   2.627   3.004
  346   2HB   GLU  32          3HB       GLU  32   9.926   3.132   1.398
  347   1HG   GLU  32          2HG       GLU  32   9.789   5.558   2.284
  348   2HG   GLU  32          3HG       GLU  32   9.598   4.850   3.891
  349    QB   GLU  32           QB       GLU  32   9.652   2.880   2.201
  350    QG   GLU  32           QG       GLU  32   9.693   5.204   3.088
  351    H    GLN  33           HN       GLN  33   8.685   3.611  -0.601
  352    HA   GLN  33           HA       GLN  33   8.703   6.342  -1.292
  353   1HB   GLN  33          2HB       GLN  33   8.436   3.787  -2.894
  354   2HB   GLN  33          3HB       GLN  33   8.278   5.330  -3.695
  355   1HG   GLN  33          2HG       GLN  33  10.449   6.091  -2.898
  356   2HG   GLN  33          3HG       GLN  33  10.661   4.651  -1.913
  357   1HE2  GLN  33          2HE2      GLN  33  11.581   2.544  -4.638
  358   2HE2  GLN  33          1HE2      GLN  33  10.801   2.590  -3.046
  359    QB   GLN  33           QB       GLN  33   8.357   4.559  -3.295
  360    QG   GLN  33           QG       GLN  33  10.555   5.371  -2.406
  361    QE2  GLN  33           QE2      GLN  33  11.192   2.567  -3.842
  362    H    LEU  34           HN       LEU  34   5.983   3.969  -1.555
  363    HA   LEU  34           HA       LEU  34   4.299   5.819  -2.843
  364   1HB   LEU  34          2HB       LEU  34   4.047   3.271  -2.533
  365   2HB   LEU  34          3HB       LEU  34   3.308   3.632  -0.977
  366    HG   LEU  34           HG       LEU  34   1.584   3.278  -2.569
  367   1HD1  LEU  34          2HD1      LEU  34   1.342   5.338  -1.071
  368   2HD1  LEU  34          3HD1      LEU  34   1.701   6.301  -2.544
  369   3HD1  LEU  34          1HD1      LEU  34   0.302   5.226  -2.523
  370   1HD2  LEU  34          1HD2      LEU  34   2.917   3.634  -4.637
  371   2HD2  LEU  34          2HD2      LEU  34   1.350   4.479  -4.670
  372   3HD2  LEU  34          3HD2      LEU  34   2.832   5.389  -4.402
  373    QB   LEU  34           QB       LEU  34   3.677   3.452  -1.755
  374    QD1  LEU  34           QD1      LEU  34   1.115   5.622  -2.046
  375    QD2  LEU  34           QD2      LEU  34   2.367   4.501  -4.570
  376    QQD  LEU  34           QQD      LEU  34   1.741   5.061  -3.307
  377    H    GLU  35           HN       GLU  35   4.646   5.021   0.590
  378    HA   GLU  35           HA       GLU  35   2.759   6.709   1.698
  379   1HB   GLU  35          2HB       GLU  35   5.424   5.615   2.685
  380   2HB   GLU  35          3HB       GLU  35   4.414   6.612   3.727
  381   1HG   GLU  35          2HG       GLU  35   2.518   5.044   3.372
  382   2HG   GLU  35          3HG       GLU  35   3.492   4.048   2.307
  383    QB   GLU  35           QB       GLU  35   4.919   6.113   3.207
  384    QG   GLU  35           QG       GLU  35   3.005   4.546   2.840
  385    H    ASN  36           HN       ASN  36   6.238   7.479   1.030
  386    HA   ASN  36           HA       ASN  36   5.724  10.291   1.739
  387   1HB   ASN  36          2HB       ASN  36   7.992  10.728   1.297
  388   2HB   ASN  36          3HB       ASN  36   7.870   9.232   2.223
  389   1HD2  ASN  36          2HD2      ASN  36  10.010   7.656  -0.097
  390   2HD2  ASN  36          1HD2      ASN  36   9.562   7.925   1.564
  391    QB   ASN  36           QB       ASN  36   7.931   9.980   1.760
  392    QD2  ASN  36           QD2      ASN  36   9.787   7.790   0.733
  393    H    GLY  37           HN       GLY  37   4.644   8.653  -0.884
  394   1HA   GLY  37          1HA       GLY  37   3.906   9.254  -2.934
  395   2HA   GLY  37          2HA       GLY  37   4.061  10.944  -2.436
  396    QA   GLY  37           QA       GLY  37   3.983  10.099  -2.685
  397    H    LYS  38           HN       LYS  38   6.356   8.280  -3.093
  398    HA   LYS  38           HA       LYS  38   8.109  10.036  -4.720
  399   1HB   LYS  38          2HB       LYS  38   8.338   7.473  -3.297
  400   2HB   LYS  38          3HB       LYS  38   9.176   7.455  -4.831
  401   1HG   LYS  38          2HG       LYS  38   9.628   9.865  -3.113
  402   2HG   LYS  38          3HG       LYS  38  10.190   8.347  -2.437
  403   1HD   LYS  38          2HD       LYS  38  11.853   8.017  -4.002
  404   2HD   LYS  38          3HD       LYS  38  10.919   8.754  -5.296
  405   1HE   LYS  38          2HE       LYS  38  12.648  10.266  -5.028
  406   2HE   LYS  38          3HE       LYS  38  11.294  11.027  -4.192
  407   1HZ   LYS  38          2HZ       LYS  38  12.265  10.215  -2.106
  408   2HZ   LYS  38          3HZ       LYS  38  13.535   9.569  -2.938
  409   3HZ   LYS  38          1HZ       LYS  38  13.298  11.192  -2.931
  410    QB   LYS  38           QB       LYS  38   8.757   7.463  -4.064
  411    QG   LYS  38           QG       LYS  38   9.909   9.106  -2.775
  412    QD   LYS  38           QD       LYS  38  11.386   8.385  -4.649
  413    QE   LYS  38           QE       LYS  38  11.971  10.646  -4.610
  414    QZ   LYS  38           QZ       LYS  38  13.033  10.325  -2.658
  415    H    THR  39           HN       THR  39   5.373   8.066  -5.417
  416    HA   THR  39           HA       THR  39   6.042   8.424  -8.256
  417    HB   THR  39           HB       THR  39   6.718   6.101  -7.784
  418    HG1  THR  39          1HG       THR  39   6.003   6.268  -9.786
  419   1HG2  THR  39          1HG2      THR  39   5.157   5.599  -5.901
  420   2HG2  THR  39          2HG2      THR  39   3.801   5.595  -7.054
  421   3HG2  THR  39          3HG2      THR  39   5.115   4.408  -7.204
  422    QG2  THR  39           QG2      THR  39   4.691   5.201  -6.720
  423    H    LYS  40           HN       LYS  40   4.170   8.370  -9.576
  424    HA   LYS  40           HA       LYS  40   1.746   9.442  -8.205
  425   1HB   LYS  40          2HB       LYS  40   2.976   9.718 -10.941
  426   2HB   LYS  40          3HB       LYS  40   1.250   9.953 -10.769
  427   1HG   LYS  40          2HG       LYS  40   3.001  11.406  -8.775
  428   2HG   LYS  40          3HG       LYS  40   3.143  11.895 -10.450
  429   1HD   LYS  40          2HD       LYS  40   1.353  13.152 -10.325
  430   2HD   LYS  40          3HD       LYS  40   0.326  11.764 -10.052
  431   1HE   LYS  40          2HE       LYS  40   1.710  13.431  -7.883
  432   2HE   LYS  40          3HE       LYS  40   0.021  13.547  -8.392
  433   1HZ   LYS  40          3HZ       LYS  40  -0.143  11.141  -7.742
  434   2HZ   LYS  40          1HZ       LYS  40   1.290  11.333  -6.953
  435   3HZ   LYS  40          2HZ       LYS  40  -0.013  12.238  -6.525
  436    QB   LYS  40           QB       LYS  40   2.114   9.836 -10.855
  437    QG   LYS  40           QG       LYS  40   3.071  11.651  -9.613
  438    QD   LYS  40           QD       LYS  40   0.839  12.457 -10.189
  439    QE   LYS  40           QE       LYS  40   0.866  13.489  -8.138
  440    QZ   LYS  40           QZ       LYS  40   0.378  11.570  -7.074
  441    NH1  ARG  41           NH2      ARG  41  -2.894   4.294 -14.721
  442    NH2  ARG  41           NH1      ARG  41  -4.713   3.595 -13.470
  443    H    ARG  41           HN       ARG  41   2.691   7.124 -10.797
  444    HA   ARG  41           HA       ARG  41   0.227   5.567 -10.187
  445   1HB   ARG  41          2HB       ARG  41   0.622   7.038 -12.486
  446   2HB   ARG  41          3HB       ARG  41   1.123   5.435 -13.002
  447   1HG   ARG  41          2HG       ARG  41  -1.500   6.054 -11.560
  448   2HG   ARG  41          3HG       ARG  41  -1.308   6.054 -13.310
  449   1HD   ARG  41          2HD       ARG  41  -0.648   3.636 -13.256
  450   2HD   ARG  41          3HD       ARG  41  -0.776   3.642 -11.507
  451    HE   ARG  41           HE       ARG  41  -3.026   3.436 -11.611
  452   1HH1  ARG  41          2HH2      ARG  41  -1.910   4.511 -14.771
  453   2HH1  ARG  41          1HH2      ARG  41  -3.457   4.392 -15.552
  454   1HH2  ARG  41          2HH1      ARG  41  -5.118   3.288 -12.596
  455   2HH2  ARG  41          1HH1      ARG  41  -5.324   3.682 -14.269
  456    QB   ARG  41           QB       ARG  41   0.872   6.237 -12.744
  457    QG   ARG  41           QG       ARG  41  -1.404   6.053 -12.435
  458    QD   ARG  41           QD       ARG  41  -0.712   3.638 -12.381
  459    QH1  ARG  41           QH2      ARG  41  -2.684   4.452 -15.161
  460    QH2  ARG  41           QH1      ARG  41  -5.221   3.484 -13.432
  461    HA   PRO  42           HA       PRO  42   3.903   2.845  -9.753
  462   1HB   PRO  42          2HB       PRO  42   2.907   1.223  -7.759
  463   2HB   PRO  42          3HB       PRO  42   3.653   2.803  -7.433
  464   1HG   PRO  42          2HG       PRO  42   0.773   2.061  -7.568
  465   2HG   PRO  42          3HG       PRO  42   1.552   3.193  -6.454
  466   1HD   PRO  42          2HD       PRO  42   0.128   3.921  -8.733
  467   2HD   PRO  42          3HD       PRO  42   1.381   4.958  -7.988
  468    QB   PRO  42           QB       PRO  42   3.280   2.012  -7.597
  469    QG   PRO  42           QG       PRO  42   1.163   2.627  -7.011
  470    QD   PRO  42           QD       PRO  42   0.754   4.439  -8.360
  471    NH1  ARG  43           NH2      ARG  43   7.749  -5.079 -12.064
  472    NH2  ARG  43           NH1      ARG  43   8.301  -5.193  -9.812
  473    H    ARG  43           HN       ARG  43   4.106   0.528 -10.137
  474    HA   ARG  43           HA       ARG  43   1.973  -0.566 -11.850
  475   1HB   ARG  43          2HB       ARG  43   3.516  -2.329 -12.348
  476   2HB   ARG  43          3HB       ARG  43   4.313  -0.769 -12.586
  477   1HG   ARG  43          2HG       ARG  43   5.616  -1.024 -10.553
  478   2HG   ARG  43          3HG       ARG  43   4.642  -2.411 -10.029
  479   1HD   ARG  43          2HD       ARG  43   5.372  -3.659 -12.052
  480   2HD   ARG  43          3HD       ARG  43   6.582  -2.375 -12.329
  481    HE   ARG  43           HE       ARG  43   6.800  -3.187  -9.633
  482   1HH1  ARG  43          2HH2      ARG  43   7.241  -4.623 -12.808
  483   2HH1  ARG  43          1HH2      ARG  43   8.322  -5.879 -12.286
  484   1HH2  ARG  43          2HH1      ARG  43   8.203  -4.860  -8.863
  485   2HH2  ARG  43          1HH1      ARG  43   8.886  -6.001  -9.970
  486    QB   ARG  43           QB       ARG  43   3.914  -1.549 -12.467
  487    QG   ARG  43           QG       ARG  43   5.129  -1.717 -10.291
  488    QD   ARG  43           QD       ARG  43   5.977  -3.017 -12.191
  489    QH1  ARG  43           QH2      ARG  43   7.781  -5.251 -12.546
  490    QH2  ARG  43           QH1      ARG  43   8.545  -5.431  -9.416
  491    H    PHE  44           HN       PHE  44   3.265  -0.994  -8.606
  492    HA   PHE  44           HA       PHE  44   1.997  -3.605  -8.264
  493   1HB   PHE  44          2HB       PHE  44   3.132  -3.676  -6.168
  494   2HB   PHE  44          3HB       PHE  44   4.254  -3.217  -7.427
  495    HD1  PHE  44          1HD       PHE  44   5.200  -0.876  -7.486
  496    HD2  PHE  44          2HD       PHE  44   2.478  -2.141  -4.396
  497    HE1  PHE  44          1HE       PHE  44   5.623   1.226  -6.236
  498    HE2  PHE  44          2HE       PHE  44   3.010  -0.107  -3.090
  499    HZ   PHE  44           HZ       PHE  44   4.562   1.591  -4.023
  500    QB   PHE  44           QB       PHE  44   3.693  -3.447  -6.798
  501    QR   PHE  44           QR       PHE  44   4.078  -0.474  -5.302
  502    H    LEU  45           HN       LEU  45   0.541  -0.815  -8.488
  503    HA   LEU  45           HA       LEU  45  -0.757  -0.310  -6.058
  504   1HB   LEU  45          2HB       LEU  45  -0.834   0.943  -8.424
  505   2HB   LEU  45          3HB       LEU  45  -2.215  -0.093  -8.687
  506    HG   LEU  45           HG       LEU  45  -3.114   0.759  -6.445
  507   1HD1  LEU  45          2HD1      LEU  45  -0.970   1.958  -5.702
  508   2HD1  LEU  45          3HD1      LEU  45  -1.216   3.079  -7.053
  509   3HD1  LEU  45          1HD1      LEU  45  -2.386   3.017  -5.749
  510   1HD2  LEU  45          3HD2      LEU  45  -3.921   1.328  -8.731
  511   2HD2  LEU  45          1HD2      LEU  45  -4.228   2.550  -7.476
  512   3HD2  LEU  45          2HD2      LEU  45  -2.931   2.796  -8.672
  513    QB   LEU  45           QB       LEU  45  -1.524   0.425  -8.555
  514    QD1  LEU  45           QD1      LEU  45  -1.524   2.685  -6.168
  515    QD2  LEU  45           QD2      LEU  45  -3.693   2.225  -8.293
  516    QQD  LEU  45           QQD      LEU  45  -2.608   2.455  -7.231
  517    HA   PRO  46           HA       PRO  46  -4.142  -3.496  -7.196
  518   1HB   PRO  46          2HB       PRO  46  -3.483  -5.579  -8.912
  519   2HB   PRO  46          3HB       PRO  46  -4.412  -4.119  -9.342
  520   1HG   PRO  46          2HG       PRO  46  -1.620  -4.800 -10.029
  521   2HG   PRO  46          3HG       PRO  46  -2.723  -3.654 -10.822
  522   1HD   PRO  46          2HD       PRO  46  -0.617  -3.140  -8.988
  523   2HD   PRO  46          3HD       PRO  46  -1.723  -1.933  -9.685
  524    QB   PRO  46           QB       PRO  46  -3.947  -4.848  -9.128
  525    QG   PRO  46           QG       PRO  46  -2.172  -4.227 -10.425
  526    QD   PRO  46           QD       PRO  46  -1.169  -2.537  -9.336
  527    H    GLU  47           HN       GLU  47  -0.747  -4.721  -7.376
  528    HA   GLU  47           HA       GLU  47  -1.124  -7.011  -5.807
  529   1HB   GLU  47          2HB       GLU  47   1.266  -5.184  -6.221
  530   2HB   GLU  47          3HB       GLU  47   1.332  -6.639  -5.223
  531   1HG   GLU  47          2HG       GLU  47   2.121  -7.035  -7.543
  532   2HG   GLU  47          3HG       GLU  47   0.756  -8.064  -7.085
  533    QB   GLU  47           QB       GLU  47   1.299  -5.911  -5.722
  534    QG   GLU  47           QG       GLU  47   1.439  -7.549  -7.314
  535    H    LEU  48           HN       LEU  48  -0.293  -3.668  -4.733
  536    HA   LEU  48           HA       LEU  48  -0.270  -4.403  -1.946
  537   1HB   LEU  48          2HB       LEU  48   0.879  -2.446  -2.877
  538   2HB   LEU  48          3HB       LEU  48  -0.653  -1.670  -3.254
  539    HG   LEU  48           HG       LEU  48  -0.333  -2.587  -0.412
  540   1HD1  LEU  48          2HD1      LEU  48   1.974  -1.845  -0.927
  541   2HD1  LEU  48          3HD1      LEU  48   1.339  -0.279  -1.490
  542   3HD1  LEU  48          1HD1      LEU  48   1.177  -0.754   0.209
  543   1HD2  LEU  48          3HD2      LEU  48  -1.216  -0.017  -1.762
  544   2HD2  LEU  48          1HD2      LEU  48  -2.264  -1.228  -0.983
  545   3HD2  LEU  48          2HD2      LEU  48  -1.180  -0.227  -0.008
  546    QB   LEU  48           QB       LEU  48   0.113  -2.058  -3.066
  547    QD1  LEU  48           QD1      LEU  48   1.497  -0.959  -0.736
  548    QD2  LEU  48           QD2      LEU  48  -1.554  -0.490  -0.918
  549    QQD  LEU  48           QQD      LEU  48  -0.029  -0.725  -0.827
  550    H    ALA  49           HN       ALA  49  -2.781  -2.982  -4.065
  551    HA   ALA  49           HA       ALA  49  -4.752  -2.704  -2.096
  552   1HB   ALA  49          1HB       ALA  49  -4.744  -2.994  -5.079
  553   2HB   ALA  49          2HB       ALA  49  -6.273  -3.331  -4.288
  554   3HB   ALA  49          3HB       ALA  49  -5.511  -1.764  -4.057
  555    QB   ALA  49           QB       ALA  49  -5.510  -2.696  -4.475
  556    H    SER  50           HN       SER  50  -3.987  -5.519  -4.115
  557    HA   SER  50           HA       SER  50  -5.914  -7.328  -3.106
  558   1HB   SER  50          2HB       SER  50  -4.581  -7.629  -5.198
  559   2HB   SER  50          3HB       SER  50  -3.130  -7.905  -4.229
  560    HG   SER  50           HG       SER  50  -5.455  -9.500  -4.439
  561    QB   SER  50           QB       SER  50  -3.856  -7.766  -4.713
  562    H    ALA  51           HN       ALA  51  -2.453  -6.882  -2.183
  563    HA   ALA  51           HA       ALA  51  -2.271  -8.722  -0.124
  564   1HB   ALA  51          1HB       ALA  51  -0.983  -5.966  -0.295
  565   2HB   ALA  51          2HB       ALA  51  -0.465  -7.274   0.766
  566   3HB   ALA  51          3HB       ALA  51  -0.355  -7.473  -0.997
  567    QB   ALA  51           QB       ALA  51  -0.601  -6.904  -0.176
  568    H    LEU  52           HN       LEU  52  -3.494  -5.380   0.038
  569    HA   LEU  52           HA       LEU  52  -4.123  -5.566   2.865
  570   1HB   LEU  52          2HB       LEU  52  -4.157  -3.458   0.744
  571   2HB   LEU  52          3HB       LEU  52  -5.481  -3.353   1.859
  572    HG   LEU  52           HG       LEU  52  -4.112  -2.010   2.887
  573   1HD1  LEU  52          3HD1      LEU  52  -4.487  -4.025   4.493
  574   2HD1  LEU  52          1HD1      LEU  52  -2.814  -4.474   4.148
  575   3HD1  LEU  52          2HD1      LEU  52  -3.149  -2.928   4.893
  576   1HD2  LEU  52          3HD2      LEU  52  -1.756  -3.545   1.941
  577   2HD2  LEU  52          1HD2      LEU  52  -2.345  -1.934   1.459
  578   3HD2  LEU  52          2HD2      LEU  52  -1.723  -2.174   3.108
  579    QB   LEU  52           QB       LEU  52  -4.819  -3.406   1.301
  580    QD1  LEU  52           QD1      LEU  52  -3.484  -3.809   4.511
  581    QD2  LEU  52           QD2      LEU  52  -1.941  -2.551   2.170
  582    QQD  LEU  52           QQD      LEU  52  -2.712  -3.180   3.340
  583    H    GLY  53           HN       GLY  53  -5.846  -6.309  -0.039
  584   1HA   GLY  53          1HA       GLY  53  -7.976  -7.021  -0.417
  585   2HA   GLY  53          2HA       GLY  53  -8.269  -7.102   1.330
  586    QA   GLY  53           QA       GLY  53  -8.123  -7.062   0.457
  587    H    VAL  54           HN       VAL  54  -7.458  -4.542  -1.068
  588    HA   VAL  54           HA       VAL  54 -10.079  -3.255  -0.628
  589    HB   VAL  54           HB       VAL  54  -8.978  -0.998  -0.889
  590   1HG1  VAL  54          2HG1      VAL  54  -9.831  -1.818   1.300
  591   2HG1  VAL  54          3HG1      VAL  54  -8.194  -2.444   1.646
  592   3HG1  VAL  54          1HG1      VAL  54  -8.461  -0.702   1.456
  593   1HG2  VAL  54          3HG2      VAL  54  -6.748  -2.115  -1.623
  594   2HG2  VAL  54          1HG2      VAL  54  -6.653  -0.675  -0.616
  595   3HG2  VAL  54          2HG2      VAL  54  -6.412  -2.264   0.112
  596    QG1  VAL  54           QG1      VAL  54  -8.829  -1.655   1.468
  597    QG2  VAL  54           QG2      VAL  54  -6.604  -1.684  -0.709
  598    QQG  VAL  54           QQG      VAL  54  -7.716  -1.670   0.380
  599    H    SER  55           HN       SER  55 -10.457  -1.659  -2.525
  600    HA   SER  55           HA       SER  55  -9.764  -2.990  -5.024
  601   1HB   SER  55          2HB       SER  55 -11.524  -1.211  -5.764
  602   2HB   SER  55          3HB       SER  55 -12.053  -2.522  -4.707
  603    HG   SER  55           HG       SER  55 -11.384   0.124  -3.904
  604    QB   SER  55           QB       SER  55 -11.788  -1.867  -5.235
  605    H    VAL  56           HN       VAL  56  -8.730  -1.948  -6.753
  606    HA   VAL  56           HA       VAL  56  -6.672  -0.055  -6.289
  607    HB   VAL  56           HB       VAL  56  -8.191  -0.886  -8.807
  608   1HG1  VAL  56          1HG1      VAL  56  -5.987   1.094  -8.357
  609   2HG1  VAL  56          2HG1      VAL  56  -5.937   0.099  -9.829
  610   3HG1  VAL  56          3HG1      VAL  56  -7.329   1.158  -9.506
  611   1HG2  VAL  56          2HG2      VAL  56  -6.839  -2.657  -7.681
  612   2HG2  VAL  56          3HG2      VAL  56  -6.123  -2.177  -9.224
  613   3HG2  VAL  56          1HG2      VAL  56  -5.427  -1.576  -7.704
  614    QG1  VAL  56           QG1      VAL  56  -6.417   0.784  -9.231
  615    QG2  VAL  56           QG2      VAL  56  -6.130  -2.136  -8.203
  616    QQG  VAL  56           QQG      VAL  56  -6.273  -0.677  -8.717
  617    H    ASP  57           HN       ASP  57 -10.078   0.410  -7.341
  618    HA   ASP  57           HA       ASP  57 -10.074   3.136  -7.843
  619   1HB   ASP  57          2HB       ASP  57 -12.292   1.733  -6.297
  620   2HB   ASP  57          3HB       ASP  57 -12.428   3.022  -7.502
  621    QB   ASP  57           QB       ASP  57 -12.360   2.378  -6.900
  622    CH2  TRP  58           CH2      TRP  58  -7.352   2.361   2.461
  623    H    TRP  58           HN       TRP  58  -9.974   1.417  -4.720
  624    HA   TRP  58           HA       TRP  58 -10.440   3.879  -3.185
  625   1HB   TRP  58          2HB       TRP  58 -11.281   1.735  -2.339
  626   2HB   TRP  58          3HB       TRP  58  -9.627   1.124  -2.236
  627    HD1  TRP  58           HD1      TRP  58 -11.846   3.871  -0.704
  628    HE1  TRP  58           HE1      TRP  58 -11.039   4.390   1.661
  629    HE3  TRP  58           HE3      TRP  58  -7.429   1.356  -0.804
  630    HZ2  TRP  58           HZ2      TRP  58  -8.841   3.632   3.383
  631    HZ3  TRP  58           HZ3      TRP  58  -5.966   1.289   1.217
  632    HH2  TRP  58           HH2      TRP  58  -6.696   2.346   3.320
  633    QB   TRP  58           QB       TRP  58 -10.454   1.429  -2.287
  634    H    LEU  59           HN       LEU  59  -7.686   1.747  -4.166
  635    HA   LEU  59           HA       LEU  59  -5.763   3.192  -2.647
  636   1HB   LEU  59          2HB       LEU  59  -5.683   1.347  -4.939
  637   2HB   LEU  59          3HB       LEU  59  -4.383   2.504  -4.976
  638    HG   LEU  59           HG       LEU  59  -5.129   0.665  -2.705
  639   1HD1  LEU  59          2HD1      LEU  59  -3.984  -0.336  -4.710
  640   2HD1  LEU  59          3HD1      LEU  59  -2.542   0.604  -4.270
  641   3HD1  LEU  59          1HD1      LEU  59  -3.194  -0.602  -3.149
  642   1HD2  LEU  59          3HD2      LEU  59  -3.504   3.104  -2.617
  643   2HD2  LEU  59          1HD2      LEU  59  -3.964   2.014  -1.287
  644   3HD2  LEU  59          2HD2      LEU  59  -2.505   1.713  -2.235
  645    QB   LEU  59           QB       LEU  59  -5.033   1.925  -4.958
  646    QD1  LEU  59           QD1      LEU  59  -3.240  -0.111  -4.043
  647    QD2  LEU  59           QD2      LEU  59  -3.325   2.277  -2.046
  648    QQD  LEU  59           QQD      LEU  59  -3.282   1.083  -3.044
  649    H    LEU  60           HN       LEU  60  -7.183   3.946  -5.819
  650    HA   LEU  60           HA       LEU  60  -5.667   6.435  -6.050
  651   1HB   LEU  60          2HB       LEU  60  -7.948   5.240  -7.629
  652   2HB   LEU  60          3HB       LEU  60  -7.237   6.806  -8.022
  653    HG   LEU  60           HG       LEU  60  -5.685   4.190  -7.886
  654   1HD1  LEU  60          1HD1      LEU  60  -7.350   4.280  -9.746
  655   2HD1  LEU  60          2HD1      LEU  60  -6.539   5.742 -10.351
  656   3HD1  LEU  60          3HD1      LEU  60  -5.666   4.192 -10.293
  657   1HD2  LEU  60          1HD2      LEU  60  -4.875   6.989  -8.797
  658   2HD2  LEU  60          2HD2      LEU  60  -4.116   6.018  -7.517
  659   3HD2  LEU  60          3HD2      LEU  60  -3.954   5.527  -9.198
  660    QB   LEU  60           QB       LEU  60  -7.592   6.023  -7.826
  661    QD1  LEU  60           QD1      LEU  60  -6.518   4.738 -10.130
  662    QD2  LEU  60           QD2      LEU  60  -4.316   6.179  -8.504
  663    QQD  LEU  60           QQD      LEU  60  -5.417   5.458  -9.317
  664    H    ASN  61           HN       ASN  61  -9.067   5.728  -5.122
  665    HA   ASN  61           HA       ASN  61  -9.631   8.568  -4.660
  666   1HB   ASN  61          2HB       ASN  61 -11.206   6.035  -4.027
  667   2HB   ASN  61          3HB       ASN  61 -11.717   7.649  -3.555
  668   1HD2  ASN  61          2HD2      ASN  61 -12.424   6.462  -7.335
  669   2HD2  ASN  61          1HD2      ASN  61 -11.552   5.427  -6.203
  670    QB   ASN  61           QB       ASN  61 -11.462   6.842  -3.791
  671    QD2  ASN  61           QD2      ASN  61 -11.987   5.944  -6.769
  672    H    GLY  62           HN       GLY  62  -9.402   5.713  -2.478
  673   1HA   GLY  62          1HA       GLY  62  -8.460   5.627  -0.395
  674   2HA   GLY  62          2HA       GLY  62  -8.368   7.399  -0.334
  675    QA   GLY  62           QA       GLY  62  -8.414   6.513  -0.364
  676    H    THR  63           HN       THR  63 -11.448   6.844  -1.268
  677    HA   THR  63           HA       THR  63 -12.614   6.193   1.329
  678    HB   THR  63           HB       THR  63 -14.005   8.325   1.135
  679    HG1  THR  63          1HG       THR  63 -11.810   9.040  -0.530
  680   1HG2  THR  63          2HG2      THR  63 -12.162   7.989   2.847
  681   2HG2  THR  63          3HG2      THR  63 -11.064   8.849   1.749
  682   3HG2  THR  63          1HG2      THR  63 -12.478   9.680   2.404
  683    QG2  THR  63           QG2      THR  63 -11.901   8.839   2.333
  684    H    SER  64           HN       SER  64 -14.215   4.809   0.795
  685    HA   SER  64           HA       SER  64 -15.442   4.960  -1.933
  686   1HB   SER  64          2HB       SER  64 -14.010   2.896  -1.335
  687   2HB   SER  64          3HB       SER  64 -15.299   2.487  -0.192
  688    HG   SER  64           HG       SER  64 -15.500   1.608  -2.387
  689    QB   SER  64           QB       SER  64 -14.654   2.691  -0.764
  690    H    ASP  65           HN       ASP  65 -17.346   6.052  -1.634
  691    HA   ASP  65           HA       ASP  65 -18.712   6.362   0.837
  692   1HB   ASP  65          2HB       ASP  65 -20.557   7.152  -0.727
  693   2HB   ASP  65          3HB       ASP  65 -19.017   8.018  -0.806
  694    QB   ASP  65           QB       ASP  65 -19.787   7.585  -0.767
  695    H    SER  66           HN       SER  66 -19.561   4.710   1.909
  696    HA   SER  66           HA       SER  66 -20.660   2.798   2.454
  697   1HB   SER  66          2HB       SER  66 -22.374   3.788   0.151
  698   2HB   SER  66          3HB       SER  66 -22.848   2.489   1.260
  699    HG   SER  66           HG       SER  66 -23.590   4.533   1.997
  700    QB   SER  66           QB       SER  66 -22.611   3.139   0.706
  701    H    ASN  67           HN       ASN  67 -18.647   1.620   1.706
  702    HA   ASN  67           HA       ASN  67 -19.463  -0.471  -0.230
  703   1HB   ASN  67          2HB       ASN  67 -17.998   1.533  -1.185
  704   2HB   ASN  67          3HB       ASN  67 -16.677   0.661  -0.397
  705   1HD2  ASN  67          2HD2      ASN  67 -18.588  -0.868  -3.716
  706   2HD2  ASN  67          1HD2      ASN  67 -19.305   0.438  -2.782
  707    QB   ASN  67           QB       ASN  67 -17.338   1.098  -0.790
  708    QD2  ASN  67           QD2      ASN  67 -18.947  -0.215  -3.249
  709    H    VAL  68           HN       VAL  68 -19.544  -2.165   1.141
  710    HA   VAL  68           HA       VAL  68 -17.129  -2.946   2.646
  711    HB   VAL  68           HB       VAL  68 -19.956  -2.704   3.783
  712   1HG1  VAL  68          2HG1      VAL  68 -17.623  -4.382   4.677
  713   2HG1  VAL  68          3HG1      VAL  68 -18.587  -3.568   5.916
  714   3HG1  VAL  68          1HG1      VAL  68 -19.368  -4.685   4.791
  715   1HG2  VAL  68          3HG2      VAL  68 -18.648  -0.607   3.913
  716   2HG2  VAL  68          1HG2      VAL  68 -18.899  -1.309   5.510
  717   3HG2  VAL  68          2HG2      VAL  68 -17.323  -1.486   4.708
  718    QG1  VAL  68           QG1      VAL  68 -18.526  -4.211   5.129
  719    QG2  VAL  68           QG2      VAL  68 -18.290  -1.134   4.711
  720    QQG  VAL  68           QQG      VAL  68 -18.408  -2.673   4.920
  721    NH1  ARG  69           NH2      ARG  69 -17.014 -10.778  -1.609
  722    NH2  ARG  69           NH1      ARG  69 -14.821 -10.234  -2.123
  723    H    ARG  69           HN       ARG  69 -16.968  -5.309   2.729
  724    HA   ARG  69           HA       ARG  69 -18.960  -7.010   1.726
  725   1HB   ARG  69          2HB       ARG  69 -17.901  -5.818  -0.423
  726   2HB   ARG  69          3HB       ARG  69 -16.507  -6.843  -0.051
  727   1HG   ARG  69          2HG       ARG  69 -18.152  -8.825  -0.063
  728   2HG   ARG  69          3HG       ARG  69 -19.383  -7.690  -0.621
  729   1HD   ARG  69          2HD       ARG  69 -18.529  -8.746  -2.612
  730   2HD   ARG  69          3HD       ARG  69 -17.892  -7.110  -2.574
  731    HE   ARG  69           HE       ARG  69 -15.756  -7.906  -2.380
  732   1HH1  ARG  69          2HH2      ARG  69 -17.955 -10.465  -1.426
  733   2HH1  ARG  69          1HH2      ARG  69 -16.775 -11.741  -1.429
  734   1HH2  ARG  69          2HH1      ARG  69 -14.122  -9.553  -2.375
  735   2HH2  ARG  69          1HH1      ARG  69 -14.530 -11.189  -1.970
  736    QB   ARG  69           QB       ARG  69 -17.204  -6.330  -0.237
  737    QG   ARG  69           QG       ARG  69 -18.768  -8.258  -0.342
  738    QD   ARG  69           QD       ARG  69 -18.211  -7.928  -2.593
  739    QH1  ARG  69           QH2      ARG  69 -17.365 -11.104  -1.427
  740    QH2  ARG  69           QH1      ARG  69 -14.326 -10.372  -2.172
   
  Start of MODEL           7
 Raw file had 740 H/Q atoms
  Start of MODEL    7
    1    H    SER   1           HN       SER   1  -5.032  10.201   4.436
    2    HA   SER   1           HA       SER   1  -3.422  11.218   2.179
    3   1HB   SER   1          2HB       SER   1  -2.725  10.750   5.116
    4   2HB   SER   1          3HB       SER   1  -1.508  11.102   3.872
    5    HG   SER   1           HG       SER   1  -2.290  13.000   4.904
    6    QB   SER   1           QB       SER   1  -2.117  10.927   4.494
    7    H    ILE   2           HN       ILE   2  -1.709   9.913   1.357
    8    HA   ILE   2           HA       ILE   2  -2.626   7.305   0.882
    9    HB   ILE   2           HB       ILE   2  -1.483   8.628  -0.734
   10   1HG1  ILE   2          2HG1      ILE   2   0.340   6.269  -0.299
   11   2HG1  ILE   2          3HG1      ILE   2  -1.385   5.993  -0.544
   12   1HG2  ILE   2          1HG2      ILE   2   0.229   9.764   0.695
   13   2HG2  ILE   2          2HG2      ILE   2   1.129   8.240   0.792
   14   3HG2  ILE   2          3HG2      ILE   2   0.905   9.043  -0.765
   15   1HD1  ILE   2          3HD1      ILE   2  -1.283   7.397  -2.653
   16   2HD1  ILE   2          1HD1      ILE   2   0.486   7.364  -2.497
   17   3HD1  ILE   2          2HD1      ILE   2  -0.438   5.852  -2.697
   18    QG1  ILE   2           QG1      ILE   2  -0.523   6.131  -0.422
   19    QG2  ILE   2           QG2      ILE   2   0.754   9.016   0.240
   20    QD1  ILE   2           QD1      ILE   2  -0.412   6.871  -2.615
   21    H    SER   3           HN       SER   3   0.286   8.336   2.735
   22    HA   SER   3           HA       SER   3   0.962   5.831   3.829
   23   1HB   SER   3          2HB       SER   3   2.385   7.790   4.184
   24   2HB   SER   3          3HB       SER   3   1.106   8.603   5.138
   25    HG   SER   3           HG       SER   3   2.420   6.167   5.812
   26    QB   SER   3           QB       SER   3   1.745   8.196   4.661
   27    H    SER   4           HN       SER   4  -1.400   8.293   5.160
   28    HA   SER   4           HA       SER   4  -2.244   6.764   7.305
   29   1HB   SER   4          2HB       SER   4  -4.049   8.483   5.573
   30   2HB   SER   4          3HB       SER   4  -4.387   7.959   7.213
   31    HG   SER   4           HG       SER   4  -2.681   9.190   7.943
   32    QB   SER   4           QB       SER   4  -4.218   8.221   6.393
   33    NH1  ARG   5           NH2      ARG   5  -4.163   4.548  -0.528
   34    NH2  ARG   5           NH1      ARG   5  -3.830   6.479  -1.756
   35    H    ARG   5           HN       ARG   5  -3.395   6.412   3.884
   36    HA   ARG   5           HA       ARG   5  -5.381   4.446   4.614
   37   1HB   ARG   5          2HB       ARG   5  -3.903   4.888   2.019
   38   2HB   ARG   5          3HB       ARG   5  -5.098   3.734   2.180
   39   1HG   ARG   5          2HG       ARG   5  -6.669   5.598   3.014
   40   2HG   ARG   5          3HG       ARG   5  -5.412   6.754   2.634
   41   1HD   ARG   5          2HD       ARG   5  -6.616   4.855   0.552
   42   2HD   ARG   5          3HD       ARG   5  -7.200   6.455   0.964
   43    HE   ARG   5           HE       ARG   5  -5.502   7.453  -0.180
   44   1HH1  ARG   5          2HH2      ARG   5  -4.702   4.042   0.157
   45   2HH1  ARG   5          1HH2      ARG   5  -3.360   4.105  -0.945
   46   1HH2  ARG   5          2HH1      ARG   5  -4.037   7.448  -1.943
   47   2HH2  ARG   5          1HH1      ARG   5  -3.455   5.942  -2.535
   48    QB   ARG   5           QB       ARG   5  -4.500   4.310   2.099
   49    QG   ARG   5           QG       ARG   5  -6.040   6.176   2.824
   50    QD   ARG   5           QD       ARG   5  -6.908   5.655   0.758
   51    QH1  ARG   5           QH2      ARG   5  -4.032   4.074  -0.394
   52    QH2  ARG   5           QH1      ARG   5  -3.745   6.695  -2.239
   53    H    VAL   6           HN       VAL   6  -2.090   4.036   3.187
   54    HA   VAL   6           HA       VAL   6  -2.180   1.198   3.209
   55    HB   VAL   6           HB       VAL   6   0.224   3.080   3.360
   56   1HG1  VAL   6          3HG1      VAL   6   0.023   0.128   2.671
   57   2HG1  VAL   6          1HG1      VAL   6   1.466   1.121   2.436
   58   3HG1  VAL   6          2HG1      VAL   6   0.885   0.813   4.074
   59   1HG2  VAL   6          2HG2      VAL   6  -1.143   1.659   1.023
   60   2HG2  VAL   6          3HG2      VAL   6  -1.141   3.411   1.309
   61   3HG2  VAL   6          1HG2      VAL   6   0.370   2.579   0.916
   62    QG1  VAL   6           QG1      VAL   6   0.792   0.687   3.061
   63    QG2  VAL   6           QG2      VAL   6  -0.637   2.549   1.082
   64    QQG  VAL   6           QQG      VAL   6   0.077   1.618   2.071
   65    H    LYS   7           HN       LYS   7  -0.880   3.497   5.584
   66    HA   LYS   7           HA       LYS   7  -0.045   1.608   7.464
   67   1HB   LYS   7          2HB       LYS   7   0.691   3.945   7.221
   68   2HB   LYS   7          3HB       LYS   7  -0.798   4.505   7.992
   69   1HG   LYS   7          2HG       LYS   7  -0.156   3.743  10.070
   70   2HG   LYS   7          3HG       LYS   7   0.802   2.395   9.428
   71   1HD   LYS   7          2HD       LYS   7   2.570   3.851   8.666
   72   2HD   LYS   7          3HD       LYS   7   1.687   5.304   9.111
   73   1HE   LYS   7          2HE       LYS   7   2.482   3.131  11.123
   74   2HE   LYS   7          3HE       LYS   7   3.534   4.499  10.734
   75   1HZ   LYS   7          1HZ       LYS   7   0.793   4.844  11.741
   76   2HZ   LYS   7          2HZ       LYS   7   2.121   4.816  12.708
   77   3HZ   LYS   7          3HZ       LYS   7   1.957   5.993  11.573
   78    QB   LYS   7           QB       LYS   7  -0.054   4.225   7.606
   79    QG   LYS   7           QG       LYS   7   0.323   3.069   9.750
   80    QD   LYS   7           QD       LYS   7   2.129   4.577   8.888
   81    QE   LYS   7           QE       LYS   7   3.008   3.814  10.929
   82    QZ   LYS   7           QZ       LYS   7   1.623   5.218  12.008
   83    H    SER   8           HN       SER   8  -3.117   3.649   7.573
   84    HA   SER   8           HA       SER   8  -4.238   2.459   9.843
   85   1HB   SER   8          2HB       SER   8  -5.637   3.384   7.304
   86   2HB   SER   8          3HB       SER   8  -6.462   2.967   8.810
   87    HG   SER   8           HG       SER   8  -5.257   5.248   8.168
   88    QB   SER   8           QB       SER   8  -6.050   3.176   8.058
   89    H    LYS   9           HN       LYS   9  -4.438   1.294   6.430
   90    HA   LYS   9           HA       LYS   9  -6.135  -0.869   7.102
   91   1HB   LYS   9          2HB       LYS   9  -5.458   0.234   4.790
   92   2HB   LYS   9          3HB       LYS   9  -4.273  -1.062   4.751
   93   1HG   LYS   9          2HG       LYS   9  -7.317  -1.222   4.975
   94   2HG   LYS   9          3HG       LYS   9  -6.309  -1.638   3.582
   95   1HD   LYS   9          2HD       LYS   9  -5.271  -3.492   4.951
   96   2HD   LYS   9          3HD       LYS   9  -6.439  -3.187   6.212
   97   1HE   LYS   9          2HE       LYS   9  -7.091  -3.972   3.332
   98   2HE   LYS   9          3HE       LYS   9  -7.043  -5.068   4.738
   99   1HZ   LYS   9          1HZ       LYS   9  -8.911  -2.828   4.493
  100   2HZ   LYS   9          2HZ       LYS   9  -9.236  -4.386   4.070
  101   3HZ   LYS   9          3HZ       LYS   9  -8.894  -4.017   5.642
  102    QB   LYS   9           QB       LYS   9  -4.865  -0.414   4.770
  103    QG   LYS   9           QG       LYS   9  -6.813  -1.430   4.278
  104    QD   LYS   9           QD       LYS   9  -5.855  -3.339   5.581
  105    QE   LYS   9           QE       LYS   9  -7.067  -4.520   4.036
  106    QZ   LYS   9           QZ       LYS   9  -9.014  -3.744   4.735
  107    NH1  ARG  10           NH2      ARG  10   2.999  -1.239  10.187
  108    NH2  ARG  10           NH1      ARG  10   3.881   0.702   9.275
  109    H    ARG  10           HN       ARG  10  -2.571  -0.529   6.769
  110    HA   ARG  10           HA       ARG  10  -1.810  -3.171   7.383
  111   1HB   ARG  10          2HB       ARG  10  -0.296  -1.531   6.447
  112   2HB   ARG  10          3HB       ARG  10  -0.370  -0.541   7.915
  113   1HG   ARG  10          2HG       ARG  10   0.669  -2.153   9.247
  114   2HG   ARG  10          3HG       ARG  10   0.489  -3.411   8.015
  115   1HD   ARG  10          2HD       ARG  10   2.716  -2.828   7.914
  116   2HD   ARG  10          3HD       ARG  10   2.014  -2.114   6.489
  117    HE   ARG  10           HE       ARG  10   2.845  -0.124   7.162
  118   1HH1  ARG  10          2HH2      ARG  10   2.532  -2.144  10.074
  119   2HH1  ARG  10          1HH2      ARG  10   3.372  -1.025  11.098
  120   1HH2  ARG  10          2HH1      ARG  10   4.095   1.294   8.478
  121   2HH2  ARG  10          1HH1      ARG  10   4.356   0.911  10.139
  122    QB   ARG  10           QB       ARG  10  -0.333  -1.036   7.181
  123    QG   ARG  10           QG       ARG  10   0.579  -2.782   8.631
  124    QD   ARG  10           QD       ARG  10   2.365  -2.470   7.202
  125    QH1  ARG  10           QH2      ARG  10   2.952  -1.585  10.586
  126    QH2  ARG  10           QH1      ARG  10   4.225   1.103   9.309
  127    H    ILE  11           HN       ILE  11  -2.730  -0.488   9.568
  128    HA   ILE  11           HA       ILE  11  -2.034  -1.831  12.016
  129    HB   ILE  11           HB       ILE  11  -3.796   0.536  11.329
  130   1HG1  ILE  11          2HG1      ILE  11  -2.424   1.433  13.300
  131   2HG1  ILE  11          3HG1      ILE  11  -1.394   0.009  13.129
  132   1HG2  ILE  11          2HG2      ILE  11  -3.843  -0.928  13.991
  133   2HG2  ILE  11          3HG2      ILE  11  -4.430   0.725  13.742
  134   3HG2  ILE  11          1HG2      ILE  11  -5.229  -0.595  12.926
  135   1HD1  ILE  11          1HD1      ILE  11  -1.965   2.113  10.997
  136   2HD1  ILE  11          2HD1      ILE  11  -0.524   2.066  12.018
  137   3HD1  ILE  11          3HD1      ILE  11  -0.795   0.759  10.852
  138    QG1  ILE  11           QG1      ILE  11  -1.909   0.722  13.214
  139    QG2  ILE  11           QG2      ILE  11  -4.501  -0.266  13.553
  140    QD1  ILE  11           QD1      ILE  11  -1.095   1.646  11.289
  141    H    GLN  12           HN       GLN  12  -5.207  -1.448  10.361
  142    HA   GLN  12           HA       GLN  12  -6.562  -3.210  12.086
  143   1HB   GLN  12          2HB       GLN  12  -8.341  -3.418  10.502
  144   2HB   GLN  12          3HB       GLN  12  -7.702  -1.757  10.392
  145   1HG   GLN  12          2HG       GLN  12  -6.661  -2.169   8.467
  146   2HG   GLN  12          3HG       GLN  12  -6.805  -3.923   8.495
  147   1HE2  GLN  12          2HE2      GLN  12  -9.999  -1.715   7.147
  148   2HE2  GLN  12          1HE2      GLN  12  -8.745  -0.919   8.073
  149    QB   GLN  12           QB       GLN  12  -8.021  -2.587  10.447
  150    QG   GLN  12           QG       GLN  12  -6.733  -3.045   8.481
  151    QE2  GLN  12           QE2      GLN  12  -9.371  -1.317   7.610
  152    H    LEU  13           HN       LEU  13  -4.568  -4.049   9.281
  153    HA   LEU  13           HA       LEU  13  -5.021  -6.930   9.512
  154   1HB   LEU  13          2HB       LEU  13  -3.489  -5.040   7.798
  155   2HB   LEU  13          3HB       LEU  13  -2.652  -6.535   8.075
  156    HG   LEU  13           HG       LEU  13  -4.253  -6.190   6.022
  157   1HD1  LEU  13          2HD1      LEU  13  -3.561  -8.616   7.607
  158   2HD1  LEU  13          3HD1      LEU  13  -4.819  -8.817   6.377
  159   3HD1  LEU  13          1HD1      LEU  13  -3.233  -8.194   5.912
  160   1HD2  LEU  13          2HD2      LEU  13  -6.303  -5.739   7.435
  161   2HD2  LEU  13          3HD2      LEU  13  -6.462  -6.972   6.181
  162   3HD2  LEU  13          1HD2      LEU  13  -6.300  -7.466   7.863
  163    QB   LEU  13           QB       LEU  13  -3.071  -5.787   7.937
  164    QD1  LEU  13           QD1      LEU  13  -3.871  -8.542   6.632
  165    QD2  LEU  13           QD2      LEU  13  -6.355  -6.726   7.160
  166    QQD  LEU  13           QQD      LEU  13  -5.113  -7.634   6.896
  167    H    GLY  14           HN       GLY  14  -2.719  -4.668  10.922
  168   1HA   GLY  14          1HA       GLY  14  -1.339  -4.941  12.708
  169   2HA   GLY  14          2HA       GLY  14  -1.920  -6.600  12.910
  170    QA   GLY  14           QA       GLY  14  -1.630  -5.771  12.809
  171    H    LEU  15           HN       LEU  15  -0.208  -4.889  10.222
  172    HA   LEU  15           HA       LEU  15   2.018  -6.915  10.431
  173   1HB   LEU  15          2HB       LEU  15   0.821  -5.863   7.851
  174   2HB   LEU  15          3HB       LEU  15   2.093  -7.079   8.010
  175    HG   LEU  15           HG       LEU  15  -0.780  -7.428   8.954
  176   1HD1  LEU  15          1HD1      LEU  15   0.619  -8.454   6.456
  177   2HD1  LEU  15          2HD1      LEU  15  -1.001  -8.941   6.999
  178   3HD1  LEU  15          3HD1      LEU  15  -0.693  -7.261   6.517
  179   1HD2  LEU  15          2HD2      LEU  15   1.147  -8.899  10.035
  180   2HD2  LEU  15          3HD2      LEU  15  -0.357  -9.630   9.478
  181   3HD2  LEU  15          1HD2      LEU  15   1.096  -9.727   8.473
  182    QB   LEU  15           QB       LEU  15   1.457  -6.471   7.930
  183    QD1  LEU  15           QD1      LEU  15  -0.358  -8.218   6.657
  184    QD2  LEU  15           QD2      LEU  15   0.628  -9.419   9.328
  185    QQD  LEU  15           QQD      LEU  15   0.135  -8.819   7.993
  186    H    ASN  16           HN       ASN  16   3.958  -6.163   9.023
  187    HA   ASN  16           HA       ASN  16   4.458  -3.265   9.547
  188   1HB   ASN  16          2HB       ASN  16   6.806  -3.740   9.564
  189   2HB   ASN  16          3HB       ASN  16   5.945  -4.647  10.810
  190   1HD2  ASN  16          2HD2      ASN  16   8.234  -7.124   9.362
  191   2HD2  ASN  16          1HD2      ASN  16   8.340  -5.716  10.411
  192    QB   ASN  16           QB       ASN  16   6.376  -4.193  10.187
  193    QD2  ASN  16           QD2      ASN  16   8.287  -6.421   9.887
  194    H    GLN  17           HN       GLN  17   5.882  -2.206   7.959
  195    HA   GLN  17           HA       GLN  17   4.665  -2.280   5.385
  196   1HB   GLN  17          2HB       GLN  17   7.022  -0.896   6.605
  197   2HB   GLN  17          3HB       GLN  17   6.823  -0.851   4.830
  198   1HG   GLN  17          2HG       GLN  17   4.641   0.222   5.102
  199   2HG   GLN  17          3HG       GLN  17   4.749  -0.061   6.839
  200   1HE2  GLN  17          2HE2      GLN  17   6.969   3.045   5.325
  201   2HE2  GLN  17          1HE2      GLN  17   6.308   1.849   4.232
  202    QB   GLN  17           QB       GLN  17   6.923  -0.873   5.717
  203    QG   GLN  17           QG       GLN  17   4.696   0.080   5.971
  204    QE2  GLN  17           QE2      GLN  17   6.639   2.448   4.779
  205    H    ALA  18           HN       ALA  18   7.600  -3.815   6.644
  206    HA   ALA  18           HA       ALA  18   8.647  -4.939   4.281
  207   1HB   ALA  18          3HB       ALA  18   8.794  -5.475   7.200
  208   2HB   ALA  18          1HB       ALA  18   9.099  -6.887   6.176
  209   3HB   ALA  18          2HB       ALA  18  10.068  -5.416   5.978
  210    QB   ALA  18           QB       ALA  18   9.321  -5.926   6.451
  211    H    GLU  19           HN       GLU  19   6.344  -6.583   6.538
  212    HA   GLU  19           HA       GLU  19   5.826  -8.797   4.870
  213   1HB   GLU  19          2HB       GLU  19   4.278  -7.404   7.080
  214   2HB   GLU  19          3HB       GLU  19   3.565  -8.719   6.192
  215   1HG   GLU  19          2HG       GLU  19   5.532 -10.187   6.750
  216   2HG   GLU  19          3HG       GLU  19   6.195  -8.879   7.732
  217    QB   GLU  19           QB       GLU  19   3.922  -8.062   6.636
  218    QG   GLU  19           QG       GLU  19   5.863  -9.533   7.241
  219    H    LEU  20           HN       LEU  20   4.149  -5.634   5.157
  220    HA   LEU  20           HA       LEU  20   2.154  -6.125   3.238
  221   1HB   LEU  20          2HB       LEU  20   2.547  -4.121   4.770
  222   2HB   LEU  20          3HB       LEU  20   3.590  -3.451   3.509
  223    HG   LEU  20           HG       LEU  20   0.712  -4.355   3.018
  224   1HD1  LEU  20          1HD1      LEU  20   1.767  -1.650   3.930
  225   2HD1  LEU  20          2HD1      LEU  20   0.134  -1.950   3.304
  226   3HD1  LEU  20          3HD1      LEU  20   0.655  -2.747   4.792
  227   1HD2  LEU  20          1HD2      LEU  20   2.726  -3.429   1.227
  228   2HD2  LEU  20          2HD2      LEU  20   0.989  -3.621   0.914
  229   3HD2  LEU  20          3HD2      LEU  20   1.641  -2.066   1.463
  230    QB   LEU  20           QB       LEU  20   3.069  -3.786   4.140
  231    QD1  LEU  20           QD1      LEU  20   0.852  -2.116   4.009
  232    QD2  LEU  20           QD2      LEU  20   1.785  -3.038   1.202
  233    QQD  LEU  20           QQD      LEU  20   1.319  -2.577   2.605
  234    H    ALA  21           HN       ALA  21   5.503  -4.853   2.704
  235    HA   ALA  21           HA       ALA  21   5.406  -4.801  -0.089
  236   1HB   ALA  21          2HB       ALA  21   7.302  -4.114   1.702
  237   2HB   ALA  21          3HB       ALA  21   7.998  -5.645   1.137
  238   3HB   ALA  21          1HB       ALA  21   7.595  -4.372  -0.026
  239    QB   ALA  21           QB       ALA  21   7.631  -4.710   0.937
  240    H    GLN  22           HN       GLN  22   6.283  -7.551   2.040
  241    HA   GLN  22           HA       GLN  22   6.893  -9.350  -0.105
  242   1HB   GLN  22          2HB       GLN  22   5.998  -9.798   2.753
  243   2HB   GLN  22          3HB       GLN  22   6.330 -11.134   1.642
  244   1HG   GLN  22          2HG       GLN  22   8.604 -10.367   1.270
  245   2HG   GLN  22          3HG       GLN  22   8.350  -8.950   2.308
  246   1HE2  GLN  22          2HE2      GLN  22  10.054 -11.666   4.283
  247   2HE2  GLN  22          1HE2      GLN  22  10.439 -10.824   2.792
  248    QB   GLN  22           QB       GLN  22   6.164 -10.466   2.198
  249    QG   GLN  22           QG       GLN  22   8.477  -9.658   1.789
  250    QE2  GLN  22           QE2      GLN  22  10.247 -11.244   3.538
  251    H    LYS  23           HN       LYS  23   3.761  -8.727   1.584
  252    HA   LYS  23           HA       LYS  23   2.337 -10.727   0.044
  253   1HB   LYS  23          2HB       LYS  23   1.393  -8.371   1.728
  254   2HB   LYS  23          3HB       LYS  23   0.315  -9.341   0.724
  255   1HG   LYS  23          2HG       LYS  23  -0.024 -10.521   2.567
  256   2HG   LYS  23          3HG       LYS  23   1.397 -11.398   2.002
  257   1HD   LYS  23          2HD       LYS  23   2.821 -10.119   3.479
  258   2HD   LYS  23          3HD       LYS  23   1.465  -9.101   4.014
  259   1HE   LYS  23          2HE       LYS  23   0.566 -10.771   5.384
  260   2HE   LYS  23          3HE       LYS  23   1.252 -12.081   4.421
  261   1HZ   LYS  23          2HZ       LYS  23   3.300 -10.527   5.641
  262   2HZ   LYS  23          3HZ       LYS  23   2.389 -11.124   6.790
  263   3HZ   LYS  23          1HZ       LYS  23   3.053 -12.130   5.679
  264    QB   LYS  23           QB       LYS  23   0.853  -8.856   1.227
  265    QG   LYS  23           QG       LYS  23   0.686 -10.960   2.285
  266    QD   LYS  23           QD       LYS  23   2.143  -9.610   3.747
  267    QE   LYS  23           QE       LYS  23   0.909 -11.426   4.902
  268    QZ   LYS  23           QZ       LYS  23   2.914 -11.260   6.036
  269    H    VAL  24           HN       VAL  24   3.143  -7.312  -0.537
  270    HA   VAL  24           HA       VAL  24   1.656  -7.191  -3.030
  271    HB   VAL  24           HB       VAL  24   4.047  -5.615  -2.073
  272   1HG1  VAL  24          2HG1      VAL  24   3.371  -5.539  -4.631
  273   2HG1  VAL  24          3HG1      VAL  24   2.028  -4.557  -4.036
  274   3HG1  VAL  24          1HG1      VAL  24   3.698  -4.053  -3.750
  275   1HG2  VAL  24          3HG2      VAL  24   1.263  -5.558  -1.224
  276   2HG2  VAL  24          1HG2      VAL  24   2.670  -4.665  -0.618
  277   3HG2  VAL  24          2HG2      VAL  24   1.738  -4.010  -1.932
  278    QG1  VAL  24           QG1      VAL  24   3.032  -4.716  -4.139
  279    QG2  VAL  24           QG2      VAL  24   1.891  -4.745  -1.258
  280    QQG  VAL  24           QQG      VAL  24   2.461  -4.730  -2.699
  281    H    GLY  25           HN       GLY  25   4.957  -8.242  -2.117
  282   1HA   GLY  25          1HA       GLY  25   6.321  -9.722  -3.320
  283   2HA   GLY  25          2HA       GLY  25   5.340  -9.519  -4.777
  284    QA   GLY  25           QA       GLY  25   5.831  -9.620  -4.048
  285    H    THR  26           HN       THR  26   6.613  -6.962  -2.662
  286    HA   THR  26           HA       THR  26   8.729  -6.247  -4.597
  287    HB   THR  26           HB       THR  26   6.726  -4.844  -5.128
  288    HG1  THR  26          1HG       THR  26   8.665  -3.944  -5.590
  289   1HG2  THR  26          2HG2      THR  26   5.860  -4.667  -2.755
  290   2HG2  THR  26          3HG2      THR  26   7.160  -3.523  -2.410
  291   3HG2  THR  26          1HG2      THR  26   5.952  -3.132  -3.641
  292    QG2  THR  26           QG2      THR  26   6.324  -3.774  -2.936
  293    H    THR  27           HN       THR  27   9.383  -3.924  -3.146
  294    HA   THR  27           HA       THR  27  10.526  -5.065  -0.608
  295    HB   THR  27           HB       THR  27  12.315  -3.254  -1.166
  296    HG1  THR  27          1HG       THR  27  10.848  -2.397  -2.899
  297   1HG2  THR  27          1HG2      THR  27  11.929  -5.731  -2.918
  298   2HG2  THR  27          2HG2      THR  27  13.435  -4.796  -2.822
  299   3HG2  THR  27          3HG2      THR  27  12.815  -5.632  -1.383
  300    QG2  THR  27           QG2      THR  27  12.727  -5.386  -2.374
  301    H    GLN  28           HN       GLN  28  10.330  -3.839   1.233
  302    HA   GLN  28           HA       GLN  28   8.307  -2.094   1.778
  303   1HB   GLN  28          2HB       GLN  28   9.553  -2.975   3.558
  304   2HB   GLN  28          3HB       GLN  28  11.091  -2.336   2.956
  305   1HG   GLN  28          2HG       GLN  28  10.467  -0.063   3.565
  306   2HG   GLN  28          3HG       GLN  28   8.817  -0.564   3.929
  307   1HE2  GLN  28          2HE2      GLN  28  11.878  -1.390   6.575
  308   2HE2  GLN  28          1HE2      GLN  28  12.243  -1.012   4.902
  309    QB   GLN  28           QB       GLN  28  10.322  -2.655   3.257
  310    QG   GLN  28           QG       GLN  28   9.642  -0.313   3.747
  311    QE2  GLN  28           QE2      GLN  28  12.061  -1.201   5.739
  312    H    GLN  29           HN       GLN  29  11.475  -1.176   0.519
  313    HA   GLN  29           HA       GLN  29  11.447   1.540   0.614
  314   1HB   GLN  29          2HB       GLN  29  12.987  -0.365  -0.578
  315   2HB   GLN  29          3HB       GLN  29  12.273   0.339  -2.026
  316   1HG   GLN  29          2HG       GLN  29  13.629   2.000   0.165
  317   2HG   GLN  29          3HG       GLN  29  14.525   1.221  -1.132
  318   1HE2  GLN  29          2HE2      GLN  29  12.603   4.681  -1.954
  319   2HE2  GLN  29          1HE2      GLN  29  12.492   3.972  -0.353
  320    QB   GLN  29           QB       GLN  29  12.630  -0.014  -1.302
  321    QG   GLN  29           QG       GLN  29  14.078   1.610  -0.484
  322    QE2  GLN  29           QE2      GLN  29  12.547   4.326  -1.154
  323    H    SER  30           HN       SER  30   9.648  -0.449  -1.788
  324    HA   SER  30           HA       SER  30   8.606   1.703  -3.344
  325   1HB   SER  30          2HB       SER  30   7.630  -1.129  -2.831
  326   2HB   SER  30          3HB       SER  30   6.904  -0.023  -3.992
  327    HG   SER  30           HG       SER  30   8.891   0.089  -5.068
  328    QB   SER  30           QB       SER  30   7.267  -0.576  -3.412
  329    H    ILE  31           HN       ILE  31   7.207  -0.066  -0.509
  330    HA   ILE  31           HA       ILE  31   4.808   1.453  -0.456
  331    HB   ILE  31           HB       ILE  31   6.243  -0.205   1.678
  332   1HG1  ILE  31          2HG1      ILE  31   4.362  -1.739   1.233
  333   2HG1  ILE  31          3HG1      ILE  31   3.808  -0.679  -0.087
  334   1HG2  ILE  31          1HG2      ILE  31   3.525   1.160   1.652
  335   2HG2  ILE  31          2HG2      ILE  31   3.966  -0.118   2.801
  336   3HG2  ILE  31          3HG2      ILE  31   4.827   1.420   2.821
  337   1HD1  ILE  31          1HD1      ILE  31   6.470  -2.136  -0.066
  338   2HD1  ILE  31          2HD1      ILE  31   4.966  -2.766  -0.779
  339   3HD1  ILE  31          3HD1      ILE  31   5.683  -1.322  -1.453
  340    QG1  ILE  31           QG1      ILE  31   4.085  -1.209   0.572
  341    QG2  ILE  31           QG2      ILE  31   4.106   0.820   2.425
  342    QD1  ILE  31           QD1      ILE  31   5.706  -2.075  -0.766
  343    H    GLU  32           HN       GLU  32   7.835   1.724   1.462
  344    HA   GLU  32           HA       GLU  32   7.270   4.023   2.926
  345   1HB   GLU  32          2HB       GLU  32   9.238   2.594   3.176
  346   2HB   GLU  32          3HB       GLU  32   9.921   3.202   1.667
  347   1HG   GLU  32          2HG       GLU  32  10.737   5.056   2.687
  348   2HG   GLU  32          3HG       GLU  32   9.199   5.404   3.494
  349    QB   GLU  32           QB       GLU  32   9.579   2.898   2.422
  350    QG   GLU  32           QG       GLU  32   9.969   5.231   3.091
  351    H    GLN  33           HN       GLN  33   8.644   3.891  -0.415
  352    HA   GLN  33           HA       GLN  33   8.685   6.682  -0.840
  353   1HB   GLN  33          2HB       GLN  33   9.581   6.013  -2.725
  354   2HB   GLN  33          3HB       GLN  33   9.139   4.357  -2.406
  355   1HG   GLN  33          2HG       GLN  33   7.025   4.642  -3.645
  356   2HG   GLN  33          3HG       GLN  33   7.405   6.350  -3.917
  357   1HE2  GLN  33          2HE2      GLN  33   9.803   3.581  -5.835
  358   2HE2  GLN  33          1HE2      GLN  33   9.351   3.306  -4.161
  359    QB   GLN  33           QB       GLN  33   9.360   5.185  -2.566
  360    QG   GLN  33           QG       GLN  33   7.215   5.496  -3.781
  361    QE2  GLN  33           QE2      GLN  33   9.576   3.444  -4.998
  362    H    LEU  34           HN       LEU  34   6.081   4.340  -1.518
  363    HA   LEU  34           HA       LEU  34   4.221   6.218  -2.489
  364   1HB   LEU  34          2HB       LEU  34   4.092   3.675  -2.613
  365   2HB   LEU  34          3HB       LEU  34   3.557   3.698  -0.928
  366    HG   LEU  34           HG       LEU  34   1.654   5.164  -1.618
  367   1HD1  LEU  34          2HD1      LEU  34   2.713   4.501  -4.395
  368   2HD1  LEU  34          3HD1      LEU  34   1.049   5.018  -4.126
  369   3HD1  LEU  34          1HD1      LEU  34   2.370   6.113  -3.710
  370   1HD2  LEU  34          2HD2      LEU  34   1.615   2.568  -1.420
  371   2HD2  LEU  34          3HD2      LEU  34   0.267   3.391  -2.216
  372   3HD2  LEU  34          1HD2      LEU  34   1.513   2.591  -3.192
  373    QB   LEU  34           QB       LEU  34   3.825   3.686  -1.771
  374    QD1  LEU  34           QD1      LEU  34   2.044   5.211  -4.077
  375    QD2  LEU  34           QD2      LEU  34   1.131   2.850  -2.276
  376    QQD  LEU  34           QQD      LEU  34   1.587   4.030  -3.176
  377    H    GLU  35           HN       GLU  35   4.799   5.153   0.886
  378    HA   GLU  35           HA       GLU  35   2.772   6.627   2.162
  379   1HB   GLU  35          2HB       GLU  35   5.519   5.840   3.211
  380   2HB   GLU  35          3HB       GLU  35   4.177   6.308   4.198
  381   1HG   GLU  35          2HG       GLU  35   3.327   4.126   2.428
  382   2HG   GLU  35          3HG       GLU  35   4.878   3.728   3.191
  383    QB   GLU  35           QB       GLU  35   4.848   6.074   3.705
  384    QG   GLU  35           QG       GLU  35   4.101   3.927   2.810
  385    H    ASN  36           HN       ASN  36   6.151   7.449   1.364
  386    HA   ASN  36           HA       ASN  36   6.012  10.189   2.308
  387   1HB   ASN  36          2HB       ASN  36   7.916   8.741   0.440
  388   2HB   ASN  36          3HB       ASN  36   8.142  10.418   0.965
  389   1HD2  ASN  36          2HD2      ASN  36  10.100   8.040   3.163
  390   2HD2  ASN  36          1HD2      ASN  36   9.979   8.177   1.421
  391    QB   ASN  36           QB       ASN  36   8.029   9.580   0.702
  392    QD2  ASN  36           QD2      ASN  36  10.040   8.108   2.291
  393    H    GLY  37           HN       GLY  37   4.325   8.820  -0.256
  394   1HA   GLY  37          1HA       GLY  37   3.049   9.798  -1.847
  395   2HA   GLY  37          2HA       GLY  37   3.368  11.342  -1.046
  396    QA   GLY  37           QA       GLY  37   3.210  10.570  -1.446
  397    H    LYS  38           HN       LYS  38   5.138   8.950  -3.072
  398    HA   LYS  38           HA       LYS  38   5.887  11.058  -5.021
  399   1HB   LYS  38          2HB       LYS  38   8.322  10.208  -4.776
  400   2HB   LYS  38          3HB       LYS  38   7.690  11.400  -3.638
  401   1HG   LYS  38          2HG       LYS  38   7.295   9.757  -1.934
  402   2HG   LYS  38          3HG       LYS  38   7.696   8.437  -3.039
  403   1HD   LYS  38          2HD       LYS  38   9.648  10.548  -1.981
  404   2HD   LYS  38          3HD       LYS  38   9.387   8.948  -1.306
  405   1HE   LYS  38          2HE       LYS  38  11.179   8.401  -2.610
  406   2HE   LYS  38          3HE       LYS  38   9.868   8.074  -3.754
  407   1HZ   LYS  38          3HZ       LYS  38  10.259  10.481  -4.440
  408   2HZ   LYS  38          1HZ       LYS  38  11.715  10.334  -3.686
  409   3HZ   LYS  38          2HZ       LYS  38  11.328   9.334  -4.938
  410    QB   LYS  38           QB       LYS  38   8.006  10.804  -4.207
  411    QG   LYS  38           QG       LYS  38   7.495   9.097  -2.486
  412    QD   LYS  38           QD       LYS  38   9.517   9.748  -1.643
  413    QE   LYS  38           QE       LYS  38  10.523   8.238  -3.181
  414    QZ   LYS  38           QZ       LYS  38  11.100  10.049  -4.355
  415    H    THR  39           HN       THR  39   4.041   9.263  -5.542
  416    HA   THR  39           HA       THR  39   5.274   7.612  -7.643
  417    HB   THR  39           HB       THR  39   3.180   6.430  -5.802
  418    HG1  THR  39          1HG       THR  39   4.841   5.352  -4.700
  419   1HG2  THR  39          3HG2      THR  39   3.552   5.346  -8.020
  420   2HG2  THR  39          1HG2      THR  39   5.263   5.108  -7.595
  421   3HG2  THR  39          2HG2      THR  39   3.991   4.287  -6.671
  422    QG2  THR  39           QG2      THR  39   4.269   4.914  -7.429
  423    H    LYS  40           HN       LYS  40   3.837   7.563  -9.482
  424    HA   LYS  40           HA       LYS  40   1.275   9.016  -9.237
  425   1HB   LYS  40          2HB       LYS  40   2.301   9.967 -10.979
  426   2HB   LYS  40          3HB       LYS  40   3.353   8.600 -11.326
  427   1HG   LYS  40          2HG       LYS  40   1.810   7.491 -12.639
  428   2HG   LYS  40          3HG       LYS  40   0.432   8.377 -11.965
  429   1HD   LYS  40          2HD       LYS  40   2.626   9.782 -13.519
  430   2HD   LYS  40          3HD       LYS  40   1.351   8.952 -14.399
  431   1HE   LYS  40          2HE       LYS  40   0.639  10.987 -12.235
  432   2HE   LYS  40          3HE       LYS  40   1.127  11.528 -13.843
  433   1HZ   LYS  40          1HZ       LYS  40  -0.656  10.259 -14.784
  434   2HZ   LYS  40          2HZ       LYS  40  -1.134   9.734 -13.295
  435   3HZ   LYS  40          3HZ       LYS  40  -1.228  11.330 -13.680
  436    QB   LYS  40           QB       LYS  40   2.827   9.284 -11.152
  437    QG   LYS  40           QG       LYS  40   1.121   7.935 -12.302
  438    QD   LYS  40           QD       LYS  40   1.989   9.367 -13.959
  439    QE   LYS  40           QE       LYS  40   0.883  11.258 -13.039
  440    QZ   LYS  40           QZ       LYS  40  -1.006  10.441 -13.920
  441    NH1  ARG  41           NH2      ARG  41  -4.077   4.220 -13.770
  442    NH2  ARG  41           NH1      ARG  41  -4.210   6.531 -13.806
  443    H    ARG  41           HN       ARG  41   2.583   5.960 -10.683
  444    HA   ARG  41           HA       ARG  41   0.062   4.616  -9.995
  445   1HB   ARG  41          2HB       ARG  41  -0.103   5.797 -12.321
  446   2HB   ARG  41          3HB       ARG  41   1.015   4.557 -12.873
  447   1HG   ARG  41          2HG       ARG  41  -1.125   3.693 -13.366
  448   2HG   ARG  41          3HG       ARG  41  -0.638   2.843 -11.907
  449   1HD   ARG  41          2HD       ARG  41  -2.924   3.515 -11.517
  450   2HD   ARG  41          3HD       ARG  41  -1.980   4.650 -10.588
  451    HE   ARG  41           HE       ARG  41  -2.526   6.382 -11.932
  452   1HH1  ARG  41          2HH2      ARG  41  -3.667   3.379 -13.393
  453   2HH1  ARG  41          1HH2      ARG  41  -4.781   4.131 -14.489
  454   1HH2  ARG  41          2HH1      ARG  41  -3.973   7.431 -13.418
  455   2HH2  ARG  41          1HH1      ARG  41  -4.880   6.497 -14.562
  456    QB   ARG  41           QB       ARG  41   0.456   5.177 -12.597
  457    QG   ARG  41           QG       ARG  41  -0.882   3.268 -12.636
  458    QD   ARG  41           QD       ARG  41  -2.452   4.082 -11.053
  459    QH1  ARG  41           QH2      ARG  41  -4.225   3.756 -13.941
  460    QH2  ARG  41           QH1      ARG  41  -4.426   6.964 -13.990
  461    HA   PRO  42           HA       PRO  42   3.762   2.014  -9.490
  462   1HB   PRO  42          2HB       PRO  42   2.747   0.488  -7.396
  463   2HB   PRO  42          3HB       PRO  42   3.697   1.994  -7.241
  464   1HG   PRO  42          2HG       PRO  42   0.808   1.559  -6.808
  465   2HG   PRO  42          3HG       PRO  42   1.843   2.846  -6.165
  466   1HD   PRO  42          2HD       PRO  42   0.036   3.044  -8.364
  467   2HD   PRO  42          3HD       PRO  42   1.211   4.265  -7.883
  468    QB   PRO  42           QB       PRO  42   3.221   1.241  -7.319
  469    QG   PRO  42           QG       PRO  42   1.325   2.202  -6.487
  470    QD   PRO  42           QD       PRO  42   0.623   3.654  -8.123
  471    NH1  ARG  43           NH2      ARG  43   6.956  -3.689 -13.518
  472    NH2  ARG  43           NH1      ARG  43   7.525  -3.434 -15.751
  473    H    ARG  43           HN       ARG  43   4.076   0.149 -10.626
  474    HA   ARG  43           HA       ARG  43   2.073  -1.284 -12.021
  475   1HB   ARG  43          2HB       ARG  43   4.944  -1.756 -11.234
  476   2HB   ARG  43          3HB       ARG  43   4.006  -3.193 -11.570
  477   1HG   ARG  43          2HG       ARG  43   3.501  -1.216 -13.673
  478   2HG   ARG  43          3HG       ARG  43   5.222  -1.389 -13.417
  479   1HD   ARG  43          2HD       ARG  43   4.267  -4.096 -13.472
  480   2HD   ARG  43          3HD       ARG  43   3.261  -3.250 -14.618
  481    HE   ARG  43           HE       ARG  43   5.035  -3.111 -16.051
  482   1HH1  ARG  43          2HH2      ARG  43   6.242  -3.693 -12.805
  483   2HH1  ARG  43          1HH2      ARG  43   7.913  -3.866 -13.249
  484   1HH2  ARG  43          2HH1      ARG  43   7.263  -3.254 -16.710
  485   2HH2  ARG  43          1HH1      ARG  43   8.502  -3.578 -15.541
  486    QB   ARG  43           QB       ARG  43   4.475  -2.475 -11.403
  487    QG   ARG  43           QG       ARG  43   4.362  -1.302 -13.545
  488    QD   ARG  43           QD       ARG  43   3.765  -3.672 -14.045
  489    QH1  ARG  43           QH2      ARG  43   7.077  -3.780 -13.027
  490    QH2  ARG  43           QH1      ARG  43   7.883  -3.416 -16.126
  491    H    PHE  44           HN       PHE  44   3.298  -1.662  -8.739
  492    HA   PHE  44           HA       PHE  44   1.798  -4.120  -8.302
  493   1HB   PHE  44          2HB       PHE  44   2.717  -3.899  -6.044
  494   2HB   PHE  44          3HB       PHE  44   3.959  -3.863  -7.259
  495    HD1  PHE  44          1HD       PHE  44   1.979  -1.694  -4.907
  496    HD2  PHE  44          2HD       PHE  44   5.500  -2.029  -7.369
  497    HE1  PHE  44          1HE       PHE  44   2.797   0.454  -4.014
  498    HE2  PHE  44          2HE       PHE  44   6.297   0.152  -6.511
  499    HZ   PHE  44           HZ       PHE  44   4.945   1.402  -4.823
  500    QB   PHE  44           QB       PHE  44   3.338  -3.881  -6.651
  501    QR   PHE  44           QR       PHE  44   4.143  -0.779  -5.701
  502    H    LEU  45           HN       LEU  45   0.381  -1.323  -8.867
  503    HA   LEU  45           HA       LEU  45  -1.222  -0.775  -6.685
  504   1HB   LEU  45          2HB       LEU  45  -1.456  -0.558  -9.615
  505   2HB   LEU  45          3HB       LEU  45  -3.037  -0.803  -8.867
  506    HG   LEU  45           HG       LEU  45  -1.090   1.222  -7.774
  507   1HD1  LEU  45          2HD1      LEU  45  -3.154   1.605  -9.967
  508   2HD1  LEU  45          3HD1      LEU  45  -2.269   2.911  -9.118
  509   3HD1  LEU  45          1HD1      LEU  45  -1.388   1.738 -10.116
  510   1HD2  LEU  45          2HD2      LEU  45  -3.069   0.544  -6.361
  511   2HD2  LEU  45          3HD2      LEU  45  -3.055   2.255  -6.831
  512   3HD2  LEU  45          1HD2      LEU  45  -4.128   1.116  -7.652
  513    QB   LEU  45           QB       LEU  45  -2.246  -0.681  -9.241
  514    QD1  LEU  45           QD1      LEU  45  -2.270   2.084  -9.733
  515    QD2  LEU  45           QD2      LEU  45  -3.418   1.305  -6.949
  516    QQD  LEU  45           QQD      LEU  45  -2.844   1.695  -8.341
  517    HA   PRO  46           HA       PRO  46  -4.371  -4.186  -7.524
  518   1HB   PRO  46          2HB       PRO  46  -3.729  -6.368  -9.098
  519   2HB   PRO  46          3HB       PRO  46  -4.564  -4.900  -9.674
  520   1HG   PRO  46          2HG       PRO  46  -1.693  -5.676 -10.037
  521   2HG   PRO  46          3HG       PRO  46  -2.756  -4.756 -11.134
  522   1HD   PRO  46          2HD       PRO  46  -0.833  -3.707  -9.406
  523   2HD   PRO  46          3HD       PRO  46  -2.147  -2.756 -10.126
  524    QB   PRO  46           QB       PRO  46  -4.146  -5.634  -9.387
  525    QG   PRO  46           QG       PRO  46  -2.225  -5.216 -10.586
  526    QD   PRO  46           QD       PRO  46  -1.490  -3.232  -9.766
  527    H    GLU  47           HN       GLU  47  -0.931  -5.212  -7.554
  528    HA   GLU  47           HA       GLU  47  -1.167  -7.406  -5.806
  529   1HB   GLU  47          2HB       GLU  47   1.100  -5.444  -6.237
  530   2HB   GLU  47          3HB       GLU  47   1.215  -6.943  -5.315
  531   1HG   GLU  47          2HG       GLU  47   0.674  -8.290  -7.242
  532   2HG   GLU  47          3HG       GLU  47   0.372  -6.862  -8.247
  533    QB   GLU  47           QB       GLU  47   1.157  -6.193  -5.776
  534    QG   GLU  47           QG       GLU  47   0.523  -7.576  -7.744
  535    H    LEU  48           HN       LEU  48  -0.534  -3.916  -5.001
  536    HA   LEU  48           HA       LEU  48  -0.502  -4.420  -2.186
  537   1HB   LEU  48          2HB       LEU  48   0.569  -2.528  -3.407
  538   2HB   LEU  48          3HB       LEU  48  -0.999  -1.752  -3.575
  539    HG   LEU  48           HG       LEU  48  -0.237  -2.596  -0.791
  540   1HD1  LEU  48          1HD1      LEU  48   1.255  -0.338  -2.205
  541   2HD1  LEU  48          2HD1      LEU  48   1.292  -0.668  -0.464
  542   3HD1  LEU  48          3HD1      LEU  48   1.983  -1.835  -1.596
  543   1HD2  LEU  48          1HD2      LEU  48  -2.244  -1.193  -1.286
  544   2HD2  LEU  48          2HD2      LEU  48  -1.099  -0.403  -0.192
  545   3HD2  LEU  48          3HD2      LEU  48  -1.155   0.080  -1.894
  546    QB   LEU  48           QB       LEU  48  -0.215  -2.140  -3.491
  547    QD1  LEU  48           QD1      LEU  48   1.510  -0.947  -1.421
  548    QD2  LEU  48           QD2      LEU  48  -1.500  -0.505  -1.124
  549    QQD  LEU  48           QQD      LEU  48   0.006  -0.727  -1.273
  550    H    ALA  49           HN       ALA  49  -3.032  -3.316  -4.437
  551    HA   ALA  49           HA       ALA  49  -5.077  -2.908  -2.542
  552   1HB   ALA  49          1HB       ALA  49  -5.040  -2.425  -5.121
  553   2HB   ALA  49          2HB       ALA  49  -5.668  -4.070  -5.273
  554   3HB   ALA  49          3HB       ALA  49  -6.555  -2.847  -4.341
  555    QB   ALA  49           QB       ALA  49  -5.754  -3.113  -4.911
  556    H    SER  50           HN       SER  50  -4.110  -5.901  -4.268
  557    HA   SER  50           HA       SER  50  -6.124  -7.535  -3.049
  558   1HB   SER  50          2HB       SER  50  -4.990  -9.388  -4.075
  559   2HB   SER  50          3HB       SER  50  -5.014  -8.036  -5.218
  560    HG   SER  50           HG       SER  50  -2.815  -7.590  -4.410
  561    QB   SER  50           QB       SER  50  -5.002  -8.713  -4.647
  562    H    ALA  51           HN       ALA  51  -2.711  -6.909  -2.292
  563    HA   ALA  51           HA       ALA  51  -2.255  -8.807  -0.293
  564   1HB   ALA  51          3HB       ALA  51  -1.137  -5.985  -0.631
  565   2HB   ALA  51          1HB       ALA  51  -0.469  -7.194   0.461
  566   3HB   ALA  51          2HB       ALA  51  -0.455  -7.488  -1.293
  567    QB   ALA  51           QB       ALA  51  -0.687  -6.890  -0.488
  568    H    LEU  52           HN       LEU  52  -3.341  -5.386   0.026
  569    HA   LEU  52           HA       LEU  52  -3.908  -5.759   2.887
  570   1HB   LEU  52          2HB       LEU  52  -4.494  -3.540   0.892
  571   2HB   LEU  52          3HB       LEU  52  -4.953  -3.447   2.593
  572    HG   LEU  52           HG       LEU  52  -2.083  -3.855   1.657
  573   1HD1  LEU  52          3HD1      LEU  52  -3.060  -1.674   0.913
  574   2HD1  LEU  52          1HD1      LEU  52  -3.412  -1.280   2.604
  575   3HD1  LEU  52          2HD1      LEU  52  -1.736  -1.494   2.069
  576   1HD2  LEU  52          1HD2      LEU  52  -2.535  -4.618   4.024
  577   2HD2  LEU  52          2HD2      LEU  52  -1.505  -3.210   3.966
  578   3HD2  LEU  52          3HD2      LEU  52  -3.193  -3.013   4.381
  579    QB   LEU  52           QB       LEU  52  -4.723  -3.493   1.743
  580    QD1  LEU  52           QD1      LEU  52  -2.736  -1.482   1.862
  581    QD2  LEU  52           QD2      LEU  52  -2.411  -3.614   4.124
  582    QQD  LEU  52           QQD      LEU  52  -2.574  -2.548   2.993
  583    H    GLY  53           HN       GLY  53  -5.783  -5.642  -0.151
  584   1HA   GLY  53          1HA       GLY  53  -7.808  -6.740  -0.543
  585   2HA   GLY  53          2HA       GLY  53  -8.087  -6.954   1.189
  586    QA   GLY  53           QA       GLY  53  -7.947  -6.847   0.323
  587    H    VAL  54           HN       VAL  54  -7.487  -4.348  -1.169
  588    HA   VAL  54           HA       VAL  54  -9.937  -2.899  -0.378
  589    HB   VAL  54           HB       VAL  54  -8.790  -0.728  -0.548
  590   1HG1  VAL  54          2HG1      VAL  54  -8.629  -2.463   1.702
  591   2HG1  VAL  54          3HG1      VAL  54  -7.076  -1.633   1.568
  592   3HG1  VAL  54          1HG1      VAL  54  -8.581  -0.703   1.666
  593   1HG2  VAL  54          3HG2      VAL  54  -6.847  -1.327  -1.933
  594   2HG2  VAL  54          1HG2      VAL  54  -6.331  -0.546  -0.436
  595   3HG2  VAL  54          2HG2      VAL  54  -6.183  -2.301  -0.599
  596    QG1  VAL  54           QG1      VAL  54  -8.096  -1.600   1.645
  597    QG2  VAL  54           QG2      VAL  54  -6.454  -1.391  -0.989
  598    QQG  VAL  54           QQG      VAL  54  -7.274  -1.495   0.328
  599    H    SER  55           HN       SER  55 -10.328  -1.133  -2.237
  600    HA   SER  55           HA       SER  55 -10.008  -2.522  -4.793
  601   1HB   SER  55          2HB       SER  55 -11.542  -0.527  -5.445
  602   2HB   SER  55          3HB       SER  55 -12.185  -1.792  -4.383
  603    HG   SER  55           HG       SER  55 -12.594   0.329  -3.572
  604    QB   SER  55           QB       SER  55 -11.863  -1.159  -4.914
  605    H    VAL  56           HN       VAL  56  -8.962  -1.663  -6.562
  606    HA   VAL  56           HA       VAL  56  -6.647  -0.033  -6.274
  607    HB   VAL  56           HB       VAL  56  -8.413  -0.677  -8.663
  608   1HG1  VAL  56          1HG1      VAL  56  -6.775   1.341  -8.959
  609   2HG1  VAL  56          2HG1      VAL  56  -5.513   0.100  -8.946
  610   3HG1  VAL  56          3HG1      VAL  56  -6.801   0.048 -10.153
  611   1HG2  VAL  56          1HG2      VAL  56  -6.583  -2.299  -7.109
  612   2HG2  VAL  56          2HG2      VAL  56  -7.533  -2.747  -8.531
  613   3HG2  VAL  56          3HG2      VAL  56  -5.901  -2.094  -8.718
  614    QG1  VAL  56           QG1      VAL  56  -6.363   0.497  -9.352
  615    QG2  VAL  56           QG2      VAL  56  -6.672  -2.380  -8.119
  616    QQG  VAL  56           QQG      VAL  56  -6.518  -0.942  -8.736
  617    H    ASP  57           HN       ASP  57  -9.998   0.731  -7.353
  618    HA   ASP  57           HA       ASP  57  -9.803   3.391  -8.002
  619   1HB   ASP  57          2HB       ASP  57 -12.092   2.317  -6.304
  620   2HB   ASP  57          3HB       ASP  57 -12.147   3.488  -7.624
  621    QB   ASP  57           QB       ASP  57 -12.120   2.902  -6.964
  622    CH2  TRP  58           CH2      TRP  58  -7.383   2.899   2.442
  623    H    TRP  58           HN       TRP  58  -9.913   1.894  -4.787
  624    HA   TRP  58           HA       TRP  58 -10.100   4.450  -3.378
  625   1HB   TRP  58          2HB       TRP  58 -11.128   2.400  -2.482
  626   2HB   TRP  58          3HB       TRP  58  -9.531   1.671  -2.308
  627    HD1  TRP  58           HD1      TRP  58 -11.535   4.695  -1.026
  628    HE1  TRP  58           HE1      TRP  58 -10.863   5.216   1.357
  629    HE3  TRP  58           HE3      TRP  58  -7.523   1.555  -0.693
  630    HZ2  TRP  58           HZ2      TRP  58  -8.707   4.414   3.200
  631    HZ3  TRP  58           HZ3      TRP  58  -6.064   1.621   1.332
  632    HH2  TRP  58           HH2      TRP  58  -6.697   2.968   3.277
  633    QB   TRP  58           QB       TRP  58 -10.330   2.035  -2.395
  634    H    LEU  59           HN       LEU  59  -7.540   1.968  -4.051
  635    HA   LEU  59           HA       LEU  59  -5.509   3.340  -2.639
  636   1HB   LEU  59          2HB       LEU  59  -5.630   1.285  -4.739
  637   2HB   LEU  59          3HB       LEU  59  -4.188   2.274  -4.884
  638    HG   LEU  59           HG       LEU  59  -5.063   1.033  -2.269
  639   1HD1  LEU  59          1HD1      LEU  59  -4.393  -0.516  -4.359
  640   2HD1  LEU  59          2HD1      LEU  59  -2.762  -0.152  -3.809
  641   3HD1  LEU  59          3HD1      LEU  59  -3.931  -0.898  -2.698
  642   1HD2  LEU  59          1HD2      LEU  59  -3.341   3.053  -2.497
  643   2HD2  LEU  59          2HD2      LEU  59  -2.946   1.688  -1.426
  644   3HD2  LEU  59          3HD2      LEU  59  -2.222   1.841  -3.044
  645    QB   LEU  59           QB       LEU  59  -4.909   1.780  -4.811
  646    QD1  LEU  59           QD1      LEU  59  -3.695  -0.522  -3.622
  647    QD2  LEU  59           QD2      LEU  59  -2.836   2.194  -2.322
  648    QQD  LEU  59           QQD      LEU  59  -3.266   0.836  -2.972
  649    H    LEU  60           HN       LEU  60  -6.795   3.937  -5.843
  650    HA   LEU  60           HA       LEU  60  -5.011   6.091  -6.601
  651   1HB   LEU  60          2HB       LEU  60  -7.626   4.933  -7.561
  652   2HB   LEU  60          3HB       LEU  60  -7.124   6.492  -8.175
  653    HG   LEU  60           HG       LEU  60  -6.558   4.353  -9.487
  654   1HD1  LEU  60          2HD1      LEU  60  -5.610   6.785  -9.791
  655   2HD1  LEU  60          3HD1      LEU  60  -4.118   6.095  -9.123
  656   3HD1  LEU  60          1HD1      LEU  60  -4.842   5.411 -10.592
  657   1HD2  LEU  60          2HD2      LEU  60  -5.454   3.086  -7.634
  658   2HD2  LEU  60          3HD2      LEU  60  -4.509   3.256  -9.110
  659   3HD2  LEU  60          1HD2      LEU  60  -4.109   4.238  -7.692
  660    QB   LEU  60           QB       LEU  60  -7.375   5.712  -7.868
  661    QD1  LEU  60           QD1      LEU  60  -4.857   6.097  -9.835
  662    QD2  LEU  60           QD2      LEU  60  -4.691   3.526  -8.146
  663    QQD  LEU  60           QQD      LEU  60  -4.773   4.812  -8.990
  664    H    ASN  61           HN       ASN  61  -8.500   6.172  -5.592
  665    HA   ASN  61           HA       ASN  61  -8.365   9.089  -5.277
  666   1HB   ASN  61          2HB       ASN  61 -10.577   7.095  -4.598
  667   2HB   ASN  61          3HB       ASN  61 -10.689   8.848  -4.426
  668   1HD2  ASN  61          2HD2      ASN  61 -11.169   7.154  -8.087
  669   2HD2  ASN  61          1HD2      ASN  61 -10.671   6.183  -6.699
  670    QB   ASN  61           QB       ASN  61 -10.633   7.971  -4.512
  671    QD2  ASN  61           QD2      ASN  61 -10.920   6.669  -7.393
  672    H    GLY  62           HN       GLY  62  -9.044   6.361  -3.051
  673   1HA   GLY  62          1HA       GLY  62  -8.474   6.069  -0.879
  674   2HA   GLY  62          2HA       GLY  62  -7.418   7.478  -1.054
  675    QA   GLY  62           QA       GLY  62  -7.947   6.774  -0.967
  676    H    THR  63           HN       THR  63 -10.891   6.820  -1.079
  677    HA   THR  63           HA       THR  63 -11.354   8.651   1.227
  678    HB   THR  63           HB       THR  63 -13.368   9.312  -0.035
  679    HG1  THR  63          1HG       THR  63 -13.261   7.549  -1.516
  680   1HG2  THR  63          1HG2      THR  63 -11.297  10.764   0.020
  681   2HG2  THR  63          2HG2      THR  63 -10.726   9.981  -1.467
  682   3HG2  THR  63          3HG2      THR  63 -12.195  10.962  -1.500
  683    QG2  THR  63           QG2      THR  63 -11.407  10.569  -0.982
  684    H    SER  64           HN       SER  64 -11.935   7.236   2.722
  685    HA   SER  64           HA       SER  64 -14.108   5.257   2.252
  686   1HB   SER  64          2HB       SER  64 -12.100   5.445   4.559
  687   2HB   SER  64          3HB       SER  64 -13.373   4.235   4.372
  688    HG   SER  64           HG       SER  64 -11.387   3.429   3.610
  689    QB   SER  64           QB       SER  64 -12.737   4.839   4.465
  690    H    ASP  65           HN       ASP  65 -15.570   5.246   4.201
  691    HA   ASP  65           HA       ASP  65 -17.224   6.477   5.258
  692   1HB   ASP  65          2HB       ASP  65 -16.467   6.905   7.533
  693   2HB   ASP  65          3HB       ASP  65 -15.935   5.341   6.915
  694    QB   ASP  65           QB       ASP  65 -16.201   6.123   7.224
  695    H    SER  66           HN       SER  66 -17.591   8.152   3.687
  696    HA   SER  66           HA       SER  66 -16.482  10.698   3.671
  697   1HB   SER  66          2HB       SER  66 -19.386   9.848   3.315
  698   2HB   SER  66          3HB       SER  66 -18.740  11.433   2.874
  699    HG   SER  66           HG       SER  66 -17.356  10.417   1.406
  700    QB   SER  66           QB       SER  66 -19.063  10.641   3.094
  701    H    ASN  67           HN       ASN  67 -15.880  11.200   5.808
  702    HA   ASN  67           HA       ASN  67 -17.365  11.576   8.044
  703   1HB   ASN  67          2HB       ASN  67 -15.324  13.554   6.946
  704   2HB   ASN  67          3HB       ASN  67 -15.854  13.469   8.631
  705   1HD2  ASN  67          2HD2      ASN  67 -14.117  10.314   9.223
  706   2HD2  ASN  67          1HD2      ASN  67 -15.489  11.265   9.764
  707    QB   ASN  67           QB       ASN  67 -15.589  13.511   7.789
  708    QD2  ASN  67           QD2      ASN  67 -14.803  10.790   9.493
  709    H    VAL  68           HN       VAL  68 -17.513  13.540   5.164
  710    HA   VAL  68           HA       VAL  68 -19.010  14.961   4.307
  711    HB   VAL  68           HB       VAL  68 -20.719  14.290   6.733
  712   1HG1  VAL  68          3HG1      VAL  68 -21.378  16.050   4.352
  713   2HG1  VAL  68          1HG1      VAL  68 -22.563  15.382   5.497
  714   3HG1  VAL  68          2HG1      VAL  68 -21.344  16.529   6.063
  715   1HG2  VAL  68          3HG2      VAL  68 -20.165  12.742   4.513
  716   2HG2  VAL  68          1HG2      VAL  68 -21.673  12.679   5.440
  717   3HG2  VAL  68          2HG2      VAL  68 -21.570  13.645   3.954
  718    QG1  VAL  68           QG1      VAL  68 -21.762  15.987   5.304
  719    QG2  VAL  68           QG2      VAL  68 -21.136  13.022   4.635
  720    QQG  VAL  68           QQG      VAL  68 -21.448  14.505   4.970
  721    NH1  ARG  69           NH2      ARG  69 -15.569  21.850   5.234
  722    NH2  ARG  69           NH1      ARG  69 -15.354  23.630   6.670
  723    H    ARG  69           HN       ARG  69 -18.601  17.126   4.130
  724    HA   ARG  69           HA       ARG  69 -18.694  18.821   6.367
  725   1HB   ARG  69          2HB       ARG  69 -16.343  17.432   6.525
  726   2HB   ARG  69          3HB       ARG  69 -15.841  18.632   5.360
  727   1HG   ARG  69          2HG       ARG  69 -17.175  20.208   7.193
  728   2HG   ARG  69          3HG       ARG  69 -16.718  18.869   8.236
  729   1HD   ARG  69          2HD       ARG  69 -14.606  19.638   8.369
  730   2HD   ARG  69          3HD       ARG  69 -14.403  19.700   6.630
  731    HE   ARG  69           HE       ARG  69 -14.995  21.876   8.431
  732   1HH1  ARG  69          2HH2      ARG  69 -15.962  20.907   5.089
  733   2HH1  ARG  69          1HH2      ARG  69 -15.694  22.459   4.438
  734   1HH2  ARG  69          2HH1      ARG  69 -15.211  24.008   7.596
  735   2HH2  ARG  69          1HH1      ARG  69 -15.549  24.252   5.899
  736    QB   ARG  69           QB       ARG  69 -16.092  18.032   5.942
  737    QG   ARG  69           QG       ARG  69 -16.946  19.538   7.714
  738    QD   ARG  69           QD       ARG  69 -14.505  19.669   7.500
  739    QH1  ARG  69           QH2      ARG  69 -15.827  21.683   4.763
  740    QH2  ARG  69           QH1      ARG  69 -15.381  24.130   6.747
   
  Start of MODEL           8
 Raw file had 740 H/Q atoms
  Start of MODEL    8
    1    H    SER   1           HN       SER   1  -0.562  11.504   1.080
    2    HA   SER   1           HA       SER   1  -1.195  10.851   3.217
    3   1HB   SER   1          2HB       SER   1  -4.099  11.022   2.440
    4   2HB   SER   1          3HB       SER   1  -3.316  11.134   4.040
    5    HG   SER   1           HG       SER   1  -3.701  13.293   3.393
    6    QB   SER   1           QB       SER   1  -3.708  11.078   3.240
    7    H    ILE   2           HN       ILE   2  -1.509   9.422   0.329
    8    HA   ILE   2           HA       ILE   2  -2.977   7.077   0.782
    9    HB   ILE   2           HB       ILE   2  -0.336   6.949  -0.693
   10   1HG1  ILE   2          2HG1      ILE   2  -2.077   7.521  -2.697
   11   2HG1  ILE   2          3HG1      ILE   2  -2.795   8.514  -1.430
   12   1HG2  ILE   2          3HG2      ILE   2  -3.050   5.607  -1.054
   13   2HG2  ILE   2          1HG2      ILE   2  -1.630   5.351  -2.086
   14   3HG2  ILE   2          2HG2      ILE   2  -1.577   4.867  -0.394
   15   1HD1  ILE   2          1HD1      ILE   2  -0.252   9.344  -1.108
   16   2HD1  ILE   2          2HD1      ILE   2  -0.046   8.638  -2.713
   17   3HD1  ILE   2          3HD1      ILE   2  -1.214   9.953  -2.467
   18    QG1  ILE   2           QG1      ILE   2  -2.435   8.017  -2.064
   19    QG2  ILE   2           QG2      ILE   2  -2.086   5.275  -1.178
   20    QD1  ILE   2           QD1      ILE   2  -0.504   9.312  -2.096
   21    H    SER   3           HN       SER   3   0.154   8.061   2.035
   22    HA   SER   3           HA       SER   3   1.096   5.803   3.367
   23   1HB   SER   3          2HB       SER   3   2.146   8.037   3.404
   24   2HB   SER   3          3HB       SER   3   0.915   8.653   4.490
   25    HG   SER   3           HG       SER   3   3.097   7.578   5.229
   26    QB   SER   3           QB       SER   3   1.531   8.345   3.947
   27    H    SER   4           HN       SER   4  -1.166   8.228   4.885
   28    HA   SER   4           HA       SER   4  -1.610   6.587   7.122
   29   1HB   SER   4          2HB       SER   4  -3.724   8.140   7.291
   30   2HB   SER   4          3HB       SER   4  -2.101   8.830   7.433
   31    HG   SER   4           HG       SER   4  -3.281   8.688   4.880
   32    QB   SER   4           QB       SER   4  -2.913   8.485   7.363
   33    NH1  ARG   5           NH2      ARG   5  -6.155   9.971   0.976
   34    NH2  ARG   5           NH1      ARG   5  -5.563   9.342  -1.163
   35    H    ARG   5           HN       ARG   5  -3.215   6.598   3.948
   36    HA   ARG   5           HA       ARG   5  -5.481   5.028   4.840
   37   1HB   ARG   5          2HB       ARG   5  -4.441   5.247   1.991
   38   2HB   ARG   5          3HB       ARG   5  -6.019   4.809   2.556
   39   1HG   ARG   5          2HG       ARG   5  -6.252   7.001   3.736
   40   2HG   ARG   5          3HG       ARG   5  -4.847   7.582   2.840
   41   1HD   ARG   5          2HD       ARG   5  -7.135   6.295   1.356
   42   2HD   ARG   5          3HD       ARG   5  -7.346   7.901   1.990
   43    HE   ARG   5           HE       ARG   5  -5.539   7.023  -0.188
   44   1HH1  ARG   5          2HH2      ARG   5  -6.452   9.693   1.899
   45   2HH1  ARG   5          1HH2      ARG   5  -6.335  10.918   0.678
   46   1HH2  ARG   5          2HH1      ARG   5  -5.990   8.726  -1.855
   47   2HH2  ARG   5          1HH1      ARG   5  -5.575  10.311  -1.433
   48    QB   ARG   5           QB       ARG   5  -5.230   5.029   2.273
   49    QG   ARG   5           QG       ARG   5  -5.549   7.291   3.288
   50    QD   ARG   5           QD       ARG   5  -7.241   7.098   1.674
   51    QH1  ARG   5           QH2      ARG   5  -6.393  10.305   1.288
   52    QH2  ARG   5           QH1      ARG   5  -5.782   9.518  -1.644
   53    H    VAL   6           HN       VAL   6  -2.616   4.119   2.870
   54    HA   VAL   6           HA       VAL   6  -2.978   1.308   2.908
   55    HB   VAL   6           HB       VAL   6  -0.583   3.162   2.603
   56   1HG1  VAL   6          2HG1      VAL   6  -0.549   0.134   2.400
   57   2HG1  VAL   6          3HG1      VAL   6   0.691   1.209   1.728
   58   3HG1  VAL   6          1HG1      VAL   6   0.435   1.153   3.473
   59   1HG2  VAL   6          1HG2      VAL   6  -2.391   3.013   0.814
   60   2HG2  VAL   6          2HG2      VAL   6  -0.774   2.529   0.255
   61   3HG2  VAL   6          3HG2      VAL   6  -1.993   1.303   0.655
   62    QG1  VAL   6           QG1      VAL   6   0.192   0.832   2.533
   63    QG2  VAL   6           QG2      VAL   6  -1.719   2.282   0.575
   64    QQG  VAL   6           QQG      VAL   6  -0.763   1.557   1.554
   65    H    LYS   7           HN       LYS   7  -0.888   3.354   4.991
   66    HA   LYS   7           HA       LYS   7  -0.014   1.408   6.720
   67   1HB   LYS   7          2HB       LYS   7   0.729   3.811   6.489
   68   2HB   LYS   7          3HB       LYS   7  -0.641   4.280   7.505
   69   1HG   LYS   7          2HG       LYS   7   0.758   2.155   8.831
   70   2HG   LYS   7          3HG       LYS   7   1.989   3.262   8.171
   71   1HD   LYS   7          2HD       LYS   7   0.760   5.166   9.281
   72   2HD   LYS   7          3HD       LYS   7  -0.326   3.964  10.010
   73   1HE   LYS   7          2HE       LYS   7   2.064   2.890  10.778
   74   2HE   LYS   7          3HE       LYS   7   2.602   4.553  10.555
   75   1HZ   LYS   7          1HZ       LYS   7   0.863   5.216  12.123
   76   2HZ   LYS   7          2HZ       LYS   7   0.430   3.640  12.335
   77   3HZ   LYS   7          3HZ       LYS   7   1.920   4.152  12.799
   78    QB   LYS   7           QB       LYS   7   0.045   4.046   6.998
   79    QG   LYS   7           QG       LYS   7   1.374   2.709   8.501
   80    QD   LYS   7           QD       LYS   7   0.216   4.565   9.646
   81    QE   LYS   7           QE       LYS   7   2.333   3.722  10.667
   82    QZ   LYS   7           QZ       LYS   7   1.071   4.335  12.420
   83    H    SER   8           HN       SER   8  -2.925   3.543   7.250
   84    HA   SER   8           HA       SER   8  -3.740   2.479   9.711
   85   1HB   SER   8          2HB       SER   8  -4.762   4.483   8.722
   86   2HB   SER   8          3HB       SER   8  -5.467   3.503   7.414
   87    HG   SER   8           HG       SER   8  -6.041   3.300  10.196
   88    QB   SER   8           QB       SER   8  -5.115   3.993   8.068
   89    H    LYS   9           HN       LYS   9  -4.499   1.297   6.355
   90    HA   LYS   9           HA       LYS   9  -6.319  -0.646   7.374
   91   1HB   LYS   9          2HB       LYS   9  -5.686   0.463   4.904
   92   2HB   LYS   9          3HB       LYS   9  -5.045  -1.153   4.743
   93   1HG   LYS   9          2HG       LYS   9  -7.839  -0.696   5.803
   94   2HG   LYS   9          3HG       LYS   9  -7.541  -0.506   4.083
   95   1HD   LYS   9          2HD       LYS   9  -6.906  -2.710   3.746
   96   2HD   LYS   9          3HD       LYS   9  -6.561  -3.010   5.449
   97   1HE   LYS   9          2HE       LYS   9  -8.620  -3.718   5.889
   98   2HE   LYS   9          3HE       LYS   9  -9.379  -2.301   5.151
   99   1HZ   LYS   9          3HZ       LYS   9  -8.388  -4.555   3.525
  100   2HZ   LYS   9          1HZ       LYS   9  -9.934  -4.461   4.121
  101   3HZ   LYS   9          2HZ       LYS   9  -9.396  -3.359   3.062
  102    QB   LYS   9           QB       LYS   9  -5.365  -0.344   4.823
  103    QG   LYS   9           QG       LYS   9  -7.690  -0.602   4.943
  104    QD   LYS   9           QD       LYS   9  -6.733  -2.860   4.598
  105    QE   LYS   9           QE       LYS   9  -8.999  -3.010   5.520
  106    QZ   LYS   9           QZ       LYS   9  -9.239  -4.125   3.569
  107    NH1  ARG  10           NH2      ARG  10   1.928  -1.296   9.317
  108    NH2  ARG  10           NH1      ARG  10   2.776   0.614   8.329
  109    H    ARG  10           HN       ARG  10  -2.862  -0.540   6.730
  110    HA   ARG  10           HA       ARG  10  -2.242  -3.292   6.991
  111   1HB   ARG  10          2HB       ARG  10  -0.828  -0.864   6.560
  112   2HB   ARG  10          3HB       ARG  10  -0.251  -1.438   8.108
  113   1HG   ARG  10          2HG       ARG  10  -0.069  -3.738   6.576
  114   2HG   ARG  10          3HG       ARG  10   0.047  -2.475   5.351
  115   1HD   ARG  10          2HD       ARG  10   1.940  -3.208   7.503
  116   2HD   ARG  10          3HD       ARG  10   2.253  -2.862   5.832
  117    HE   ARG  10           HE       ARG  10   2.574  -0.671   6.211
  118   1HH1  ARG  10          2HH2      ARG  10   1.565  -2.252   9.258
  119   2HH1  ARG  10          1HH2      ARG  10   1.994  -0.895  10.239
  120   1HH2  ARG  10          2HH1      ARG  10   2.962   1.166   7.500
  121   2HH2  ARG  10          1HH1      ARG  10   3.037   0.990   9.227
  122    QB   ARG  10           QB       ARG  10  -0.539  -1.151   7.334
  123    QG   ARG  10           QG       ARG  10  -0.011  -3.107   5.963
  124    QD   ARG  10           QD       ARG  10   2.097  -3.035   6.668
  125    QH1  ARG  10           QH2      ARG  10   1.779  -1.573   9.748
  126    QH2  ARG  10           QH1      ARG  10   2.999   1.078   8.363
  127    H    ILE  11           HN       ILE  11  -2.399  -0.635   9.355
  128    HA   ILE  11           HA       ILE  11  -1.610  -2.107  11.675
  129    HB   ILE  11           HB       ILE  11  -3.250   0.421  11.291
  130   1HG1  ILE  11          2HG1      ILE  11  -1.426   1.227  12.859
  131   2HG1  ILE  11          3HG1      ILE  11  -0.605  -0.320  12.629
  132   1HG2  ILE  11          1HG2      ILE  11  -2.773  -1.043  13.920
  133   2HG2  ILE  11          2HG2      ILE  11  -3.341   0.632  13.777
  134   3HG2  ILE  11          3HG2      ILE  11  -4.356  -0.671  13.198
  135   1HD1  ILE  11          2HD1      ILE  11  -1.274   1.747  10.504
  136   2HD1  ILE  11          3HD1      ILE  11   0.319   1.478  11.237
  137   3HD1  ILE  11          1HD1      ILE  11  -0.376   0.217  10.214
  138    QG1  ILE  11           QG1      ILE  11  -1.016   0.453  12.743
  139    QG2  ILE  11           QG2      ILE  11  -3.490  -0.361  13.632
  140    QD1  ILE  11           QD1      ILE  11  -0.444   1.147  10.652
  141    H    GLN  12           HN       GLN  12  -4.910  -1.353  10.434
  142    HA   GLN  12           HA       GLN  12  -6.182  -2.904  12.392
  143   1HB   GLN  12          2HB       GLN  12  -8.168  -2.798  11.289
  144   2HB   GLN  12          3HB       GLN  12  -7.336  -1.334  10.753
  145   1HG   GLN  12          2HG       GLN  12  -7.075  -2.173   8.583
  146   2HG   GLN  12          3HG       GLN  12  -7.344  -3.853   9.028
  147   1HE2  GLN  12          2HE2      GLN  12 -10.742  -3.694   8.287
  148   2HE2  GLN  12          1HE2      GLN  12  -9.296  -4.671   8.504
  149    QB   GLN  12           QB       GLN  12  -7.752  -2.066  11.022
  150    QG   GLN  12           QG       GLN  12  -7.209  -3.013   8.805
  151    QE2  GLN  12           QE2      GLN  12 -10.019  -4.182   8.396
  152    H    LEU  13           HN       LEU  13  -4.881  -4.014   9.285
  153    HA   LEU  13           HA       LEU  13  -5.640  -6.779   9.563
  154   1HB   LEU  13          2HB       LEU  13  -3.802  -5.126   7.885
  155   2HB   LEU  13          3HB       LEU  13  -3.317  -6.798   8.093
  156    HG   LEU  13           HG       LEU  13  -6.204  -6.305   7.422
  157   1HD1  LEU  13          1HD1      LEU  13  -3.920  -5.956   5.451
  158   2HD1  LEU  13          2HD1      LEU  13  -5.614  -6.258   4.983
  159   3HD1  LEU  13          3HD1      LEU  13  -5.196  -4.803   5.908
  160   1HD2  LEU  13          1HD2      LEU  13  -4.728  -8.590   7.747
  161   2HD2  LEU  13          2HD2      LEU  13  -6.138  -8.477   6.679
  162   3HD2  LEU  13          3HD2      LEU  13  -4.501  -8.321   6.007
  163    QB   LEU  13           QB       LEU  13  -3.560  -5.962   7.989
  164    QD1  LEU  13           QD1      LEU  13  -4.910  -5.672   5.447
  165    QD2  LEU  13           QD2      LEU  13  -5.123  -8.463   6.811
  166    QQD  LEU  13           QQD      LEU  13  -5.016  -7.068   6.129
  167    H    GLY  14           HN       GLY  14  -2.900  -4.911  10.821
  168   1HA   GLY  14          1HA       GLY  14  -1.629  -5.439  12.685
  169   2HA   GLY  14          2HA       GLY  14  -2.237  -7.100  12.679
  170    QA   GLY  14           QA       GLY  14  -1.933  -6.270  12.682
  171    H    LEU  15           HN       LEU  15  -0.721  -5.183  10.049
  172    HA   LEU  15           HA       LEU  15   1.606  -7.089   9.976
  173   1HB   LEU  15          2HB       LEU  15  -0.013  -5.927   7.690
  174   2HB   LEU  15          3HB       LEU  15   1.488  -6.821   7.466
  175    HG   LEU  15           HG       LEU  15  -0.846  -8.113   8.923
  176   1HD1  LEU  15          2HD1      LEU  15  -1.699  -7.204   6.748
  177   2HD1  LEU  15          3HD1      LEU  15  -0.445  -8.105   5.908
  178   3HD1  LEU  15          1HD1      LEU  15  -1.703  -8.975   6.830
  179   1HD2  LEU  15          1HD2      LEU  15   1.482  -9.228   8.787
  180   2HD2  LEU  15          2HD2      LEU  15   0.104 -10.180   8.201
  181   3HD2  LEU  15          3HD2      LEU  15   1.175  -9.393   7.046
  182    QB   LEU  15           QB       LEU  15   0.737  -6.373   7.578
  183    QD1  LEU  15           QD1      LEU  15  -1.282  -8.094   6.495
  184    QD2  LEU  15           QD2      LEU  15   0.920  -9.600   8.011
  185    QQD  LEU  15           QQD      LEU  15  -0.180  -8.847   7.253
  186    H    ASN  16           HN       ASN  16   3.569  -6.095   9.084
  187    HA   ASN  16           HA       ASN  16   3.707  -3.140   9.430
  188   1HB   ASN  16          2HB       ASN  16   6.084  -3.393   9.698
  189   2HB   ASN  16          3HB       ASN  16   5.196  -4.326  10.903
  190   1HD2  ASN  16          2HD2      ASN  16   7.907  -6.551   9.726
  191   2HD2  ASN  16          1HD2      ASN  16   7.802  -5.063  10.647
  192    QB   ASN  16           QB       ASN  16   5.640  -3.859  10.301
  193    QD2  ASN  16           QD2      ASN  16   7.854  -5.808  10.186
  194    H    GLN  17           HN       GLN  17   5.335  -2.095   7.902
  195    HA   GLN  17           HA       GLN  17   4.424  -2.367   5.211
  196   1HB   GLN  17          2HB       GLN  17   6.839  -1.058   6.429
  197   2HB   GLN  17          3HB       GLN  17   6.512  -0.995   4.684
  198   1HG   GLN  17          2HG       GLN  17   4.493   0.285   5.053
  199   2HG   GLN  17          3HG       GLN  17   4.618  -0.017   6.792
  200   1HE2  GLN  17          2HE2      GLN  17   6.710   3.108   5.243
  201   2HE2  GLN  17          1HE2      GLN  17   5.445   2.272   4.351
  202    QB   GLN  17           QB       GLN  17   6.675  -1.027   5.557
  203    QG   GLN  17           QG       GLN  17   4.555   0.134   5.923
  204    QE2  GLN  17           QE2      GLN  17   6.077   2.690   4.797
  205    H    ALA  18           HN       ALA  18   7.040  -4.016   6.947
  206    HA   ALA  18           HA       ALA  18   8.374  -5.055   4.637
  207   1HB   ALA  18          1HB       ALA  18   9.310  -4.914   6.973
  208   2HB   ALA  18          2HB       ALA  18   8.267  -6.287   7.408
  209   3HB   ALA  18          3HB       ALA  18   9.521  -6.483   6.169
  210    QB   ALA  18           QB       ALA  18   9.033  -5.895   6.851
  211    H    GLU  19           HN       GLU  19   5.890  -6.514   6.830
  212    HA   GLU  19           HA       GLU  19   5.470  -8.937   5.435
  213   1HB   GLU  19          2HB       GLU  19   3.796  -7.217   7.254
  214   2HB   GLU  19          3HB       GLU  19   3.109  -8.620   6.448
  215   1HG   GLU  19          2HG       GLU  19   5.702  -8.888   8.004
  216   2HG   GLU  19          3HG       GLU  19   4.130  -8.973   8.810
  217    QB   GLU  19           QB       GLU  19   3.452  -7.919   6.850
  218    QG   GLU  19           QG       GLU  19   4.916  -8.930   8.407
  219    H    LEU  20           HN       LEU  20   4.003  -5.695   5.101
  220    HA   LEU  20           HA       LEU  20   2.202  -6.465   3.028
  221   1HB   LEU  20          2HB       LEU  20   2.148  -4.372   4.405
  222   2HB   LEU  20          3HB       LEU  20   3.410  -3.707   3.339
  223    HG   LEU  20           HG       LEU  20   1.668  -4.480   1.444
  224   1HD1  LEU  20          2HD1      LEU  20   0.206  -5.524   3.374
  225   2HD1  LEU  20          3HD1      LEU  20  -0.302  -3.861   3.654
  226   3HD1  LEU  20          1HD1      LEU  20  -0.579  -4.624   2.078
  227   1HD2  LEU  20          1HD2      LEU  20   1.595  -2.006   3.192
  228   2HD2  LEU  20          2HD2      LEU  20   2.233  -2.213   1.543
  229   3HD2  LEU  20          3HD2      LEU  20   0.482  -2.195   1.826
  230    QB   LEU  20           QB       LEU  20   2.778  -4.039   3.873
  231    QD1  LEU  20           QD1      LEU  20  -0.224  -4.670   3.036
  232    QD2  LEU  20           QD2      LEU  20   1.437  -2.138   2.187
  233    QQD  LEU  20           QQD      LEU  20   0.606  -3.404   2.612
  234    H    ALA  21           HN       ALA  21   5.477  -4.956   2.810
  235    HA   ALA  21           HA       ALA  21   5.720  -4.907   0.037
  236   1HB   ALA  21          3HB       ALA  21   7.812  -5.389   2.193
  237   2HB   ALA  21          1HB       ALA  21   8.178  -5.113   0.481
  238   3HB   ALA  21          2HB       ALA  21   7.342  -3.860   1.425
  239    QB   ALA  21           QB       ALA  21   7.777  -4.787   1.366
  240    H    GLN  22           HN       GLN  22   6.651  -7.633   2.250
  241    HA   GLN  22           HA       GLN  22   7.453  -9.252   0.029
  242   1HB   GLN  22          2HB       GLN  22   7.650 -11.103   1.509
  243   2HB   GLN  22          3HB       GLN  22   8.288  -9.637   2.267
  244   1HG   GLN  22          2HG       GLN  22   6.066  -9.423   3.433
  245   2HG   GLN  22          3HG       GLN  22   5.654 -11.051   2.884
  246   1HE2  GLN  22          2HE2      GLN  22   8.306 -10.438   5.953
  247   2HE2  GLN  22          1HE2      GLN  22   7.740  -9.091   4.961
  248    QB   GLN  22           QB       GLN  22   7.970 -10.370   1.888
  249    QG   GLN  22           QG       GLN  22   5.860 -10.238   3.159
  250    QE2  GLN  22           QE2      GLN  22   8.023  -9.765   5.457
  251    H    LYS  23           HN       LYS  23   4.257  -9.103   1.775
  252    HA   LYS  23           HA       LYS  23   3.186 -11.184   0.115
  253   1HB   LYS  23          2HB       LYS  23   1.238 -10.996   1.243
  254   2HB   LYS  23          3HB       LYS  23   2.373 -10.332   2.419
  255   1HG   LYS  23          2HG       LYS  23   1.704  -8.033   1.323
  256   2HG   LYS  23          3HG       LYS  23   0.320  -8.917   0.689
  257   1HD   LYS  23          2HD       LYS  23   1.122  -8.564   3.624
  258   2HD   LYS  23          3HD       LYS  23  -0.153  -7.692   2.774
  259   1HE   LYS  23          2HE       LYS  23  -1.635  -9.164   3.450
  260   2HE   LYS  23          3HE       LYS  23  -0.905 -10.361   2.381
  261   1HZ   LYS  23          3HZ       LYS  23   0.144  -9.951   5.085
  262   2HZ   LYS  23          1HZ       LYS  23  -1.155 -10.916   4.803
  263   3HZ   LYS  23          2HZ       LYS  23   0.299 -11.261   4.107
  264    QB   LYS  23           QB       LYS  23   1.806 -10.664   1.831
  265    QG   LYS  23           QG       LYS  23   1.012  -8.475   1.007
  266    QD   LYS  23           QD       LYS  23   0.485  -8.128   3.199
  267    QE   LYS  23           QE       LYS  23  -1.269  -9.762   2.916
  268    QZ   LYS  23           QZ       LYS  23  -0.238 -10.709   4.665
  269    H    VAL  24           HN       VAL  24   3.576  -7.746  -0.403
  270    HA   VAL  24           HA       VAL  24   1.949  -7.561  -2.809
  271    HB   VAL  24           HB       VAL  24   4.122  -5.845  -1.546
  272   1HG1  VAL  24          1HG1      VAL  24   2.583  -5.281  -4.094
  273   2HG1  VAL  24          2HG1      VAL  24   3.539  -4.084  -3.203
  274   3HG1  VAL  24          3HG1      VAL  24   4.342  -5.458  -3.969
  275   1HG2  VAL  24          2HG2      VAL  24   1.750  -5.889  -0.565
  276   2HG2  VAL  24          3HG2      VAL  24   2.346  -4.302  -1.087
  277   3HG2  VAL  24          1HG2      VAL  24   1.214  -5.219  -2.105
  278    QG1  VAL  24           QG1      VAL  24   3.489  -4.941  -3.755
  279    QG2  VAL  24           QG2      VAL  24   1.770  -5.137  -1.252
  280    QQG  VAL  24           QQG      VAL  24   2.628  -5.039  -2.504
  281    H    GLY  25           HN       GLY  25   5.184  -8.757  -2.019
  282   1HA   GLY  25          1HA       GLY  25   6.714  -9.810  -3.383
  283   2HA   GLY  25          2HA       GLY  25   5.648  -9.602  -4.783
  284    QA   GLY  25           QA       GLY  25   6.182  -9.706  -4.083
  285    H    THR  26           HN       THR  26   6.896  -7.161  -2.479
  286    HA   THR  26           HA       THR  26   8.899  -6.218  -4.393
  287    HB   THR  26           HB       THR  26   6.844  -4.891  -4.908
  288    HG1  THR  26          1HG       THR  26   7.983  -2.909  -4.816
  289   1HG2  THR  26          2HG2      THR  26   6.020  -4.771  -2.473
  290   2HG2  THR  26          3HG2      THR  26   7.236  -3.513  -2.216
  291   3HG2  THR  26          1HG2      THR  26   5.954  -3.264  -3.410
  292    QG2  THR  26           QG2      THR  26   6.403  -3.849  -2.700
  293    H    THR  27           HN       THR  27   9.535  -3.956  -2.947
  294    HA   THR  27           HA       THR  27  10.561  -5.104  -0.360
  295    HB   THR  27           HB       THR  27  12.476  -3.453  -0.823
  296    HG1  THR  27          1HG       THR  27  11.140  -2.486  -2.647
  297   1HG2  THR  27          3HG2      THR  27  12.055  -5.807  -2.725
  298   2HG2  THR  27          1HG2      THR  27  13.611  -5.047  -2.336
  299   3HG2  THR  27          2HG2      THR  27  12.705  -5.905  -1.074
  300    QG2  THR  27           QG2      THR  27  12.790  -5.586  -2.045
  301    H    GLN  28           HN       GLN  28  10.435  -3.857   1.463
  302    HA   GLN  28           HA       GLN  28   8.455  -1.970   1.792
  303   1HB   GLN  28          2HB       GLN  28   9.427  -3.198   3.586
  304   2HB   GLN  28          3HB       GLN  28  10.987  -2.396   3.414
  305   1HG   GLN  28          2HG       GLN  28   8.598  -0.607   3.844
  306   2HG   GLN  28          3HG       GLN  28   9.034  -1.682   5.181
  307   1HE2  GLN  28          2HE2      GLN  28  11.226   0.883   6.228
  308   2HE2  GLN  28          1HE2      GLN  28   9.778  -0.035   6.605
  309    QB   GLN  28           QB       GLN  28  10.207  -2.797   3.500
  310    QG   GLN  28           QG       GLN  28   8.816  -1.145   4.512
  311    QE2  GLN  28           QE2      GLN  28  10.502   0.424   6.417
  312    H    GLN  29           HN       GLN  29  11.789  -1.348   0.735
  313    HA   GLN  29           HA       GLN  29  11.885   1.395   0.864
  314   1HB   GLN  29          2HB       GLN  29  13.433  -0.565  -0.288
  315   2HB   GLN  29          3HB       GLN  29  12.746   0.145  -1.745
  316   1HG   GLN  29          2HG       GLN  29  14.857   1.219  -1.231
  317   2HG   GLN  29          3HG       GLN  29  13.555   2.393  -0.966
  318   1HE2  GLN  29          2HE2      GLN  29  14.775   2.987   2.306
  319   2HE2  GLN  29          1HE2      GLN  29  14.201   3.661   0.799
  320    QB   GLN  29           QB       GLN  29  13.090  -0.210  -1.017
  321    QG   GLN  29           QG       GLN  29  14.206   1.805  -1.098
  322    QE2  GLN  29           QE2      GLN  29  14.488   3.324   1.552
  323    H    SER  30           HN       SER  30  10.184  -0.540  -1.644
  324    HA   SER  30           HA       SER  30   9.402   1.723  -3.236
  325   1HB   SER  30          2HB       SER  30   8.175  -1.058  -3.117
  326   2HB   SER  30          3HB       SER  30   8.026   0.139  -4.420
  327    HG   SER  30           HG       SER  30  10.351   0.010  -4.613
  328    QB   SER  30           QB       SER  30   8.101  -0.460  -3.769
  329    H    ILE  31           HN       ILE  31   8.010  -0.121  -0.563
  330    HA   ILE  31           HA       ILE  31   5.387   1.069  -0.666
  331    HB   ILE  31           HB       ILE  31   6.832  -0.253   1.660
  332   1HG1  ILE  31          2HG1      ILE  31   6.773  -1.838  -0.173
  333   2HG1  ILE  31          3HG1      ILE  31   5.604  -2.282   1.059
  334   1HG2  ILE  31          2HG2      ILE  31   4.008   0.684   1.270
  335   2HG2  ILE  31          3HG2      ILE  31   4.313  -0.789   2.217
  336   3HG2  ILE  31          1HG2      ILE  31   5.090   0.725   2.681
  337   1HD1  ILE  31          3HD1      ILE  31   3.783  -1.248  -0.360
  338   2HD1  ILE  31          1HD1      ILE  31   5.004  -0.984  -1.629
  339   3HD1  ILE  31          2HD1      ILE  31   4.610  -2.627  -1.107
  340    QG1  ILE  31           QG1      ILE  31   6.188  -2.059   0.443
  341    QG2  ILE  31           QG2      ILE  31   4.471   0.207   2.056
  342    QD1  ILE  31           QD1      ILE  31   4.466  -1.620  -1.032
  343    H    GLU  32           HN       GLU  32   8.324   1.812   1.318
  344    HA   GLU  32           HA       GLU  32   7.315   4.120   2.546
  345   1HB   GLU  32          2HB       GLU  32   9.326   3.150   3.356
  346   2HB   GLU  32          3HB       GLU  32  10.174   3.369   1.818
  347   1HG   GLU  32          2HG       GLU  32  10.256   5.751   2.080
  348   2HG   GLU  32          3HG       GLU  32   9.041   5.734   3.370
  349    QB   GLU  32           QB       GLU  32   9.750   3.260   2.587
  350    QG   GLU  32           QG       GLU  32   9.649   5.742   2.724
  351    H    GLN  33           HN       GLN  33   9.288   4.023  -0.544
  352    HA   GLN  33           HA       GLN  33   9.131   6.818  -0.884
  353   1HB   GLN  33          2HB       GLN  33   9.948   6.569  -3.012
  354   2HB   GLN  33          3HB       GLN  33  10.540   5.113  -2.180
  355   1HG   GLN  33          2HG       GLN  33   8.693   3.840  -3.254
  356   2HG   GLN  33          3HG       GLN  33   8.219   5.281  -4.163
  357   1HE2  GLN  33          2HE2      GLN  33  11.170   5.202  -6.267
  358   2HE2  GLN  33          1HE2      GLN  33  10.188   6.358  -5.386
  359    QB   GLN  33           QB       GLN  33  10.244   5.842  -2.596
  360    QG   GLN  33           QG       GLN  33   8.457   4.561  -3.708
  361    QE2  GLN  33           QE2      GLN  33  10.679   5.781  -5.827
  362    H    LEU  34           HN       LEU  34   6.888   4.312  -1.974
  363    HA   LEU  34           HA       LEU  34   5.039   6.024  -3.294
  364   1HB   LEU  34          2HB       LEU  34   4.990   3.602  -3.564
  365   2HB   LEU  34          3HB       LEU  34   4.584   3.389  -1.857
  366    HG   LEU  34           HG       LEU  34   2.419   4.621  -2.248
  367   1HD1  LEU  34          1HD1      LEU  34   3.304   4.429  -5.166
  368   2HD1  LEU  34          2HD1      LEU  34   1.661   4.845  -4.626
  369   3HD1  LEU  34          3HD1      LEU  34   3.014   5.912  -4.237
  370   1HD2  LEU  34          1HD2      LEU  34   2.622   2.137  -2.281
  371   2HD2  LEU  34          2HD2      LEU  34   1.305   2.761  -3.292
  372   3HD2  LEU  34          3HD2      LEU  34   2.820   2.229  -4.052
  373    QB   LEU  34           QB       LEU  34   4.788   3.495  -2.710
  374    QD1  LEU  34           QD1      LEU  34   2.660   5.062  -4.676
  375    QD2  LEU  34           QD2      LEU  34   2.249   2.375  -3.208
  376    QQD  LEU  34           QQD      LEU  34   2.454   3.718  -3.942
  377    H    GLU  35           HN       GLU  35   5.065   4.900   0.144
  378    HA   GLU  35           HA       GLU  35   2.792   6.475   0.914
  379   1HB   GLU  35          2HB       GLU  35   4.966   5.075   2.516
  380   2HB   GLU  35          3HB       GLU  35   3.591   5.917   3.238
  381   1HG   GLU  35          2HG       GLU  35   2.023   4.445   1.885
  382   2HG   GLU  35          3HG       GLU  35   3.431   3.531   1.362
  383    QB   GLU  35           QB       GLU  35   4.278   5.495   2.877
  384    QG   GLU  35           QG       GLU  35   2.727   3.988   1.624
  385    H    ASN  36           HN       ASN  36   6.159   7.288   0.480
  386    HA   ASN  36           HA       ASN  36   6.009   9.856   1.776
  387   1HB   ASN  36          2HB       ASN  36   8.038   8.463   0.938
  388   2HB   ASN  36          3HB       ASN  36   7.750   9.242  -0.622
  389   1HD2  ASN  36          2HD2      ASN  36  10.316  11.112   1.305
  390   2HD2  ASN  36          1HD2      ASN  36  10.137   9.488   0.691
  391    QB   ASN  36           QB       ASN  36   7.894   8.852   0.159
  392    QD2  ASN  36           QD2      ASN  36  10.227  10.301   0.998
  393    H    GLY  37           HN       GLY  37   4.284   8.657  -0.925
  394   1HA   GLY  37          1HA       GLY  37   2.654   9.709  -2.108
  395   2HA   GLY  37          2HA       GLY  37   3.069  11.245  -1.338
  396    QA   GLY  37           QA       GLY  37   2.861  10.477  -1.723
  397    H    LYS  38           HN       LYS  38   5.780   9.685  -2.794
  398    HA   LYS  38           HA       LYS  38   5.939  11.689  -4.928
  399   1HB   LYS  38          2HB       LYS  38   7.736   9.554  -3.738
  400   2HB   LYS  38          3HB       LYS  38   8.155  10.336  -5.259
  401   1HG   LYS  38          2HG       LYS  38   9.228  11.367  -3.276
  402   2HG   LYS  38          3HG       LYS  38   8.287  12.487  -4.292
  403   1HD   LYS  38          2HD       LYS  38   6.438  12.461  -2.651
  404   2HD   LYS  38          3HD       LYS  38   7.298  11.193  -1.763
  405   1HE   LYS  38          2HE       LYS  38   7.372  13.303  -0.602
  406   2HE   LYS  38          3HE       LYS  38   9.004  12.781  -1.040
  407   1HZ   LYS  38          1HZ       LYS  38   7.421  14.703  -2.624
  408   2HZ   LYS  38          2HZ       LYS  38   8.438  15.156  -1.414
  409   3HZ   LYS  38          3HZ       LYS  38   9.040  14.397  -2.744
  410    QB   LYS  38           QB       LYS  38   7.945   9.946  -4.499
  411    QG   LYS  38           QG       LYS  38   8.758  11.927  -3.784
  412    QD   LYS  38           QD       LYS  38   6.868  11.827  -2.207
  413    QE   LYS  38           QE       LYS  38   8.189  13.042  -0.821
  414    QZ   LYS  38           QZ       LYS  38   8.299  14.752  -2.260
  415    H    THR  39           HN       THR  39   4.159   8.911  -4.735
  416    HA   THR  39           HA       THR  39   4.029   8.756  -7.638
  417    HB   THR  39           HB       THR  39   4.718   6.372  -5.852
  418    HG1  THR  39          1HG       THR  39   6.178   8.021  -7.322
  419   1HG2  THR  39          1HG2      THR  39   3.958   6.363  -8.807
  420   2HG2  THR  39          2HG2      THR  39   4.614   4.995  -7.893
  421   3HG2  THR  39          3HG2      THR  39   3.014   5.629  -7.483
  422    QG2  THR  39           QG2      THR  39   3.862   5.662  -8.061
  423    H    LYS  40           HN       LYS  40   1.910   8.291  -8.223
  424    HA   LYS  40           HA       LYS  40  -0.022   7.521  -6.060
  425   1HB   LYS  40          2HB       LYS  40  -0.388   9.499  -8.347
  426   2HB   LYS  40          3HB       LYS  40  -1.729   8.664  -7.556
  427   1HG   LYS  40          2HG       LYS  40  -0.632   9.572  -5.317
  428   2HG   LYS  40          3HG       LYS  40   0.150  10.712  -6.398
  429   1HD   LYS  40          2HD       LYS  40  -1.712  11.968  -6.403
  430   2HD   LYS  40          3HD       LYS  40  -2.597  10.703  -7.234
  431   1HE   LYS  40          2HE       LYS  40  -2.270  10.995  -4.216
  432   2HE   LYS  40          3HE       LYS  40  -3.700  11.488  -5.117
  433   1HZ   LYS  40          1HZ       LYS  40  -2.784   8.685  -5.137
  434   2HZ   LYS  40          2HZ       LYS  40  -3.780   9.265  -3.975
  435   3HZ   LYS  40          3HZ       LYS  40  -4.294   9.233  -5.503
  436    QB   LYS  40           QB       LYS  40  -1.059   9.081  -7.952
  437    QG   LYS  40           QG       LYS  40  -0.241  10.142  -5.858
  438    QD   LYS  40           QD       LYS  40  -2.155  11.335  -6.819
  439    QE   LYS  40           QE       LYS  40  -2.985  11.242  -4.667
  440    QZ   LYS  40           QZ       LYS  40  -3.619   9.062  -4.872
  441    NH1  ARG  41           NH2      ARG  41  -4.981   6.668 -13.300
  442    NH2  ARG  41           NH1      ARG  41  -4.875   5.243 -15.119
  443    H    ARG  41           HN       ARG  41   1.304   6.777  -9.206
  444    HA   ARG  41           HA       ARG  41  -0.737   4.639  -9.464
  445   1HB   ARG  41          2HB       ARG  41  -0.718   6.735 -11.086
  446   2HB   ARG  41          3HB       ARG  41   0.669   5.968 -11.812
  447   1HG   ARG  41          2HG       ARG  41  -0.758   4.908 -13.142
  448   2HG   ARG  41          3HG       ARG  41  -1.199   3.876 -11.778
  449   1HD   ARG  41          2HD       ARG  41  -3.125   5.199 -11.284
  450   2HD   ARG  41          3HD       ARG  41  -2.531   6.577 -12.244
  451    HE   ARG  41           HE       ARG  41  -2.950   4.214 -13.856
  452   1HH1  ARG  41          2HH2      ARG  41  -4.634   6.956 -12.398
  453   2HH1  ARG  41          1HH2      ARG  41  -5.779   7.150 -13.687
  454   1HH2  ARG  41          2HH1      ARG  41  -4.433   4.488 -15.625
  455   2HH2  ARG  41          1HH1      ARG  41  -5.664   5.703 -15.548
  456    QB   ARG  41           QB       ARG  41  -0.024   6.351 -11.449
  457    QG   ARG  41           QG       ARG  41  -0.979   4.392 -12.460
  458    QD   ARG  41           QD       ARG  41  -2.827   5.888 -11.764
  459    QH1  ARG  41           QH2      ARG  41  -5.206   7.054 -13.043
  460    QH2  ARG  41           QH1      ARG  41  -5.049   5.096 -15.586
  461    HA   PRO  42           HA       PRO  42   3.494   2.849  -9.084
  462   1HB   PRO  42          2HB       PRO  42   2.932   0.950  -7.173
  463   2HB   PRO  42          3HB       PRO  42   3.303   2.637  -6.776
  464   1HG   PRO  42          2HG       PRO  42   0.629   1.281  -7.010
  465   2HG   PRO  42          3HG       PRO  42   1.134   2.437  -5.754
  466   1HD   PRO  42          2HD       PRO  42  -0.404   3.148  -7.928
  467   2HD   PRO  42          3HD       PRO  42   0.703   4.295  -7.202
  468    QB   PRO  42           QB       PRO  42   3.118   1.794  -6.975
  469    QG   PRO  42           QG       PRO  42   0.882   1.859  -6.382
  470    QD   PRO  42           QD       PRO  42   0.150   3.722  -7.565
  471    NH1  ARG  43           NH2      ARG  43   9.536  -3.026 -10.089
  472    NH2  ARG  43           NH1      ARG  43   8.897  -4.698  -8.612
  473    H    ARG  43           HN       ARG  43   4.232   0.746  -9.761
  474    HA   ARG  43           HA       ARG  43   2.554  -0.573 -11.663
  475   1HB   ARG  43          2HB       ARG  43   4.353  -2.119 -11.951
  476   2HB   ARG  43          3HB       ARG  43   5.068  -0.515 -11.730
  477   1HG   ARG  43          2HG       ARG  43   5.453  -1.118  -9.293
  478   2HG   ARG  43          3HG       ARG  43   4.850  -2.751  -9.670
  479   1HD   ARG  43          2HD       ARG  43   6.714  -2.735 -11.509
  480   2HD   ARG  43          3HD       ARG  43   7.397  -1.419 -10.525
  481    HE   ARG  43           HE       ARG  43   6.591  -3.887  -9.101
  482   1HH1  ARG  43          2HH2      ARG  43   9.283  -2.285 -10.723
  483   2HH1  ARG  43          1HH2      ARG  43  10.512  -3.259  -9.980
  484   1HH2  ARG  43          2HH1      ARG  43   8.179  -5.225  -8.131
  485   2HH2  ARG  43          1HH1      ARG  43   9.857  -4.977  -8.469
  486    QB   ARG  43           QB       ARG  43   4.711  -1.317 -11.841
  487    QG   ARG  43           QG       ARG  43   5.151  -1.935  -9.481
  488    QD   ARG  43           QD       ARG  43   7.055  -2.077 -11.018
  489    QH1  ARG  43           QH2      ARG  43   9.897  -2.771 -10.351
  490    QH2  ARG  43           QH1      ARG  43   9.017  -5.101  -8.300
  491    H    PHE  44           HN       PHE  44   3.252  -1.159  -8.236
  492    HA   PHE  44           HA       PHE  44   1.937  -3.807  -8.318
  493   1HB   PHE  44          2HB       PHE  44   2.676  -3.891  -5.937
  494   2HB   PHE  44          3HB       PHE  44   3.948  -3.801  -7.124
  495    HD1  PHE  44          2HD       PHE  44   2.175  -1.980  -4.438
  496    HD2  PHE  44          1HD       PHE  44   5.493  -1.905  -7.171
  497    HE1  PHE  44          2HE       PHE  44   3.104  -0.022  -3.256
  498    HE2  PHE  44          1HE       PHE  44   6.287   0.216  -6.153
  499    HZ   PHE  44           HZ       PHE  44   5.131   1.130  -4.144
  500    QB   PHE  44           QB       PHE  44   3.312  -3.846  -6.531
  501    QR   PHE  44           QR       PHE  44   4.265  -0.923  -5.254
  502    H    LEU  45           HN       LEU  45   0.380  -1.332  -8.832
  503    HA   LEU  45           HA       LEU  45  -1.334  -0.710  -6.709
  504   1HB   LEU  45          2HB       LEU  45  -1.240  -0.377  -9.588
  505   2HB   LEU  45          3HB       LEU  45  -2.869  -0.887  -9.171
  506    HG   LEU  45           HG       LEU  45  -1.478   1.347  -7.685
  507   1HD1  LEU  45          1HD1      LEU  45  -1.508   1.888 -10.122
  508   2HD1  LEU  45          2HD1      LEU  45  -3.271   1.631 -10.127
  509   3HD1  LEU  45          3HD1      LEU  45  -2.553   2.947  -9.167
  510   1HD2  LEU  45          2HD2      LEU  45  -4.326   0.429  -7.989
  511   2HD2  LEU  45          3HD2      LEU  45  -3.386   0.595  -6.509
  512   3HD2  LEU  45          1HD2      LEU  45  -3.906   2.044  -7.365
  513    QB   LEU  45           QB       LEU  45  -2.055  -0.632  -9.379
  514    QD1  LEU  45           QD1      LEU  45  -2.444   2.156  -9.805
  515    QD2  LEU  45           QD2      LEU  45  -3.872   1.023  -7.287
  516    QQD  LEU  45           QQD      LEU  45  -3.158   1.589  -8.546
  517    HA   PRO  46           HA       PRO  46  -4.223  -4.332  -7.731
  518   1HB   PRO  46          2HB       PRO  46  -3.282  -6.519  -9.139
  519   2HB   PRO  46          3HB       PRO  46  -4.165  -5.136  -9.841
  520   1HG   PRO  46          2HG       PRO  46  -1.213  -5.675  -9.878
  521   2HG   PRO  46          3HG       PRO  46  -2.234  -4.946 -11.147
  522   1HD   PRO  46          2HD       PRO  46  -0.615  -3.552  -9.426
  523   2HD   PRO  46          3HD       PRO  46  -2.053  -2.832 -10.193
  524    QB   PRO  46           QB       PRO  46  -3.723  -5.827  -9.490
  525    QG   PRO  46           QG       PRO  46  -1.723  -5.311 -10.513
  526    QD   PRO  46           QD       PRO  46  -1.334  -3.192  -9.809
  527    H    GLU  47           HN       GLU  47  -0.744  -5.198  -7.423
  528    HA   GLU  47           HA       GLU  47  -1.175  -7.405  -5.695
  529   1HB   GLU  47          2HB       GLU  47   1.340  -5.736  -5.930
  530   2HB   GLU  47          3HB       GLU  47   1.166  -7.397  -5.335
  531   1HG   GLU  47          2HG       GLU  47   0.095  -7.852  -7.716
  532   2HG   GLU  47          3HG       GLU  47   0.926  -6.350  -8.165
  533    QB   GLU  47           QB       GLU  47   1.252  -6.566  -5.632
  534    QG   GLU  47           QG       GLU  47   0.510  -7.101  -7.941
  535    H    LEU  48           HN       LEU  48  -0.718  -3.918  -5.082
  536    HA   LEU  48           HA       LEU  48  -0.700  -4.130  -2.213
  537   1HB   LEU  48          2HB       LEU  48   0.122  -2.228  -3.639
  538   2HB   LEU  48          3HB       LEU  48  -1.551  -1.779  -3.922
  539    HG   LEU  48           HG       LEU  48  -0.558  -0.402  -2.239
  540   1HD1  LEU  48          2HD1      LEU  48  -2.969  -1.273  -1.885
  541   2HD1  LEU  48          3HD1      LEU  48  -2.290  -2.244  -0.579
  542   3HD1  LEU  48          1HD1      LEU  48  -2.158  -0.481  -0.546
  543   1HD2  LEU  48          1HD2      LEU  48   1.189  -2.143  -1.520
  544   2HD2  LEU  48          2HD2      LEU  48   0.510  -1.093  -0.262
  545   3HD2  LEU  48          3HD2      LEU  48  -0.049  -2.775  -0.416
  546    QB   LEU  48           QB       LEU  48  -0.714  -2.003  -3.780
  547    QD1  LEU  48           QD1      LEU  48  -2.473  -1.332  -1.004
  548    QD2  LEU  48           QD2      LEU  48   0.550  -2.004  -0.733
  549    QQD  LEU  48           QQD      LEU  48  -0.961  -1.669  -0.868
  550    H    ALA  49           HN       ALA  49  -3.280  -3.382  -4.625
  551    HA   ALA  49           HA       ALA  49  -5.455  -3.119  -2.877
  552   1HB   ALA  49          1HB       ALA  49  -5.230  -4.138  -5.726
  553   2HB   ALA  49          2HB       ALA  49  -6.788  -4.061  -4.907
  554   3HB   ALA  49          3HB       ALA  49  -5.848  -2.588  -5.143
  555    QB   ALA  49           QB       ALA  49  -5.955  -3.596  -5.259
  556    H    SER  50           HN       SER  50  -4.209  -6.170  -4.301
  557    HA   SER  50           HA       SER  50  -5.988  -7.834  -2.760
  558   1HB   SER  50          2HB       SER  50  -4.284  -9.640  -3.341
  559   2HB   SER  50          3HB       SER  50  -5.114  -8.829  -4.676
  560    HG   SER  50           HG       SER  50  -3.287  -7.604  -5.078
  561    QB   SER  50           QB       SER  50  -4.699  -9.234  -4.008
  562    H    ALA  51           HN       ALA  51  -2.536  -6.885  -2.178
  563    HA   ALA  51           HA       ALA  51  -2.105  -8.260   0.163
  564   1HB   ALA  51          2HB       ALA  51  -0.376  -6.981  -1.009
  565   2HB   ALA  51          3HB       ALA  51  -1.116  -5.455  -0.461
  566   3HB   ALA  51          1HB       ALA  51  -0.410  -6.567   0.708
  567    QB   ALA  51           QB       ALA  51  -0.634  -6.334  -0.253
  568    H    LEU  52           HN       LEU  52  -3.587  -4.979  -0.008
  569    HA   LEU  52           HA       LEU  52  -4.118  -5.022   2.884
  570   1HB   LEU  52          2HB       LEU  52  -4.278  -2.965   0.735
  571   2HB   LEU  52          3HB       LEU  52  -5.536  -2.887   1.940
  572    HG   LEU  52           HG       LEU  52  -4.133  -1.476   2.878
  573   1HD1  LEU  52          1HD1      LEU  52  -4.345  -3.348   4.565
  574   2HD1  LEU  52          2HD1      LEU  52  -2.730  -3.921   4.058
  575   3HD1  LEU  52          3HD1      LEU  52  -2.917  -2.318   4.752
  576   1HD2  LEU  52          3HD2      LEU  52  -1.907  -2.964   1.633
  577   2HD2  LEU  52          1HD2      LEU  52  -2.422  -1.252   1.503
  578   3HD2  LEU  52          2HD2      LEU  52  -1.616  -1.815   2.975
  579    QB   LEU  52           QB       LEU  52  -4.907  -2.925   1.338
  580    QD1  LEU  52           QD1      LEU  52  -3.331  -3.195   4.459
  581    QD2  LEU  52           QD2      LEU  52  -1.982  -2.010   2.037
  582    QQD  LEU  52           QQD      LEU  52  -2.657  -2.603   3.248
  583    H    GLY  53           HN       GLY  53  -5.747  -6.068   0.016
  584   1HA   GLY  53          1HA       GLY  53  -7.873  -6.769  -0.402
  585   2HA   GLY  53          2HA       GLY  53  -8.169  -6.872   1.342
  586    QA   GLY  53           QA       GLY  53  -8.021  -6.821   0.470
  587    H    VAL  54           HN       VAL  54  -7.596  -4.410  -1.217
  588    HA   VAL  54           HA       VAL  54 -10.051  -2.987  -0.519
  589    HB   VAL  54           HB       VAL  54  -8.920  -0.757  -0.622
  590   1HG1  VAL  54          2HG1      VAL  54  -9.656  -1.704   1.511
  591   2HG1  VAL  54          3HG1      VAL  54  -8.043  -2.426   1.736
  592   3HG1  VAL  54          1HG1      VAL  54  -8.239  -0.659   1.685
  593   1HG2  VAL  54          2HG2      VAL  54  -6.355  -2.354  -0.246
  594   2HG2  VAL  54          3HG2      VAL  54  -6.790  -1.374  -1.660
  595   3HG2  VAL  54          1HG2      VAL  54  -6.508  -0.594  -0.095
  596    QG1  VAL  54           QG1      VAL  54  -8.646  -1.596   1.644
  597    QG2  VAL  54           QG2      VAL  54  -6.550  -1.440  -0.667
  598    QQG  VAL  54           QQG      VAL  54  -7.599  -1.518   0.489
  599    H    SER  55           HN       SER  55 -10.426  -1.238  -2.276
  600    HA   SER  55           HA       SER  55  -9.977  -2.590  -4.823
  601   1HB   SER  55          2HB       SER  55 -11.790  -0.954  -5.455
  602   2HB   SER  55          3HB       SER  55 -12.211  -2.083  -4.199
  603    HG   SER  55           HG       SER  55 -12.170   0.608  -4.073
  604    QB   SER  55           QB       SER  55 -12.001  -1.519  -4.826
  605    H    VAL  56           HN       VAL  56  -9.220  -1.523  -6.683
  606    HA   VAL  56           HA       VAL  56  -6.868   0.087  -6.292
  607    HB   VAL  56           HB       VAL  56  -8.485  -0.806  -8.721
  608   1HG1  VAL  56          1HG1      VAL  56  -6.195   1.103  -8.566
  609   2HG1  VAL  56          2HG1      VAL  56  -6.217  -0.089  -9.890
  610   3HG1  VAL  56          3HG1      VAL  56  -7.568   1.047  -9.664
  611   1HG2  VAL  56          3HG2      VAL  56  -5.800  -1.666  -7.555
  612   2HG2  VAL  56          1HG2      VAL  56  -7.312  -2.602  -7.558
  613   3HG2  VAL  56          2HG2      VAL  56  -6.488  -2.257  -9.083
  614    QG1  VAL  56           QG1      VAL  56  -6.660   0.687  -9.373
  615    QG2  VAL  56           QG2      VAL  56  -6.533  -2.175  -8.065
  616    QQG  VAL  56           QQG      VAL  56  -6.597  -0.744  -8.719
  617    H    ASP  57           HN       ASP  57 -10.164   0.930  -7.441
  618    HA   ASP  57           HA       ASP  57  -9.864   3.681  -7.941
  619   1HB   ASP  57          2HB       ASP  57 -12.272   3.719  -6.923
  620   2HB   ASP  57          3HB       ASP  57 -11.974   2.718  -8.343
  621    QB   ASP  57           QB       ASP  57 -12.123   3.219  -7.634
  622    CH2  TRP  58           CH2      TRP  58  -7.429   2.824   2.423
  623    H    TRP  58           HN       TRP  58 -10.274   1.952  -4.820
  624    HA   TRP  58           HA       TRP  58 -10.175   4.364  -3.256
  625   1HB   TRP  58          2HB       TRP  58 -11.229   2.257  -2.509
  626   2HB   TRP  58          3HB       TRP  58  -9.633   1.537  -2.315
  627    HD1  TRP  58           HD1      TRP  58 -11.910   4.255  -0.795
  628    HE1  TRP  58           HE1      TRP  58 -11.151   4.811   1.525
  629    HE3  TRP  58           HE3      TRP  58  -7.495   1.627  -0.773
  630    HZ2  TRP  58           HZ2      TRP  58  -8.941   4.104   3.298
  631    HZ3  TRP  58           HZ3      TRP  58  -6.025   1.714   1.237
  632    HH2  TRP  58           HH2      TRP  58  -6.773   2.852   3.281
  633    QB   TRP  58           QB       TRP  58 -10.431   1.897  -2.412
  634    H    LEU  59           HN       LEU  59  -7.644   1.945  -4.167
  635    HA   LEU  59           HA       LEU  59  -5.567   3.270  -2.756
  636   1HB   LEU  59          2HB       LEU  59  -5.744   1.522  -5.186
  637   2HB   LEU  59          3HB       LEU  59  -4.219   2.307  -4.972
  638    HG   LEU  59           HG       LEU  59  -5.625   0.716  -2.803
  639   1HD1  LEU  59          1HD1      LEU  59  -4.905  -0.533  -4.962
  640   2HD1  LEU  59          2HD1      LEU  59  -3.247  -0.281  -4.400
  641   3HD1  LEU  59          3HD1      LEU  59  -4.422  -1.177  -3.404
  642   1HD2  LEU  59          1HD2      LEU  59  -3.488   2.544  -2.557
  643   2HD2  LEU  59          2HD2      LEU  59  -3.918   1.272  -1.403
  644   3HD2  LEU  59          3HD2      LEU  59  -2.675   0.993  -2.637
  645    QB   LEU  59           QB       LEU  59  -4.983   1.914  -5.079
  646    QD1  LEU  59           QD1      LEU  59  -4.192  -0.664  -4.256
  647    QD2  LEU  59           QD2      LEU  59  -3.360   1.603  -2.199
  648    QQD  LEU  59           QQD      LEU  59  -3.776   0.470  -3.227
  649    H    LEU  60           HN       LEU  60  -6.872   4.010  -5.964
  650    HA   LEU  60           HA       LEU  60  -5.091   6.188  -6.580
  651   1HB   LEU  60          2HB       LEU  60  -7.788   5.198  -7.500
  652   2HB   LEU  60          3HB       LEU  60  -7.309   6.810  -7.974
  653    HG   LEU  60           HG       LEU  60  -6.804   4.595  -9.421
  654   1HD1  LEU  60          1HD1      LEU  60  -6.414   7.009 -10.060
  655   2HD1  LEU  60          2HD1      LEU  60  -4.861   6.954  -9.199
  656   3HD1  LEU  60          3HD1      LEU  60  -5.141   5.921 -10.624
  657   1HD2  LEU  60          1HD2      LEU  60  -5.391   3.540  -7.783
  658   2HD2  LEU  60          2HD2      LEU  60  -4.647   3.790  -9.363
  659   3HD2  LEU  60          3HD2      LEU  60  -4.156   4.817  -8.004
  660    QB   LEU  60           QB       LEU  60  -7.548   6.004  -7.737
  661    QD1  LEU  60           QD1      LEU  60  -5.472   6.628  -9.961
  662    QD2  LEU  60           QD2      LEU  60  -4.731   4.049  -8.383
  663    QQD  LEU  60           QQD      LEU  60  -5.101   5.338  -9.172
  664    H    ASN  61           HN       ASN  61  -8.473   6.315  -5.463
  665    HA   ASN  61           HA       ASN  61  -8.230   9.197  -4.855
  666   1HB   ASN  61          2HB       ASN  61 -10.559   7.226  -4.800
  667   2HB   ASN  61          3HB       ASN  61 -10.662   8.865  -4.152
  668   1HD2  ASN  61          2HD2      ASN  61 -10.466   8.358  -8.221
  669   2HD2  ASN  61          1HD2      ASN  61 -10.043   7.019  -7.157
  670    QB   ASN  61           QB       ASN  61 -10.609   8.045  -4.476
  671    QD2  ASN  61           QD2      ASN  61 -10.255   7.689  -7.689
  672    H    GLY  62           HN       GLY  62  -9.262   6.263  -3.068
  673   1HA   GLY  62          1HA       GLY  62  -8.988   5.624  -0.915
  674   2HA   GLY  62          2HA       GLY  62  -7.666   6.766  -0.871
  675    QA   GLY  62           QA       GLY  62  -8.327   6.194  -0.893
  676    H    THR  63           HN       THR  63 -11.137   6.304  -0.594
  677    HA   THR  63           HA       THR  63 -11.468   8.380   1.480
  678    HB   THR  63           HB       THR  63 -13.477   9.032   0.169
  679    HG1  THR  63          1HG       THR  63 -13.385   7.166  -1.228
  680   1HG2  THR  63          1HG2      THR  63 -11.325  10.404   0.115
  681   2HG2  THR  63          2HG2      THR  63 -10.884   9.554  -1.384
  682   3HG2  THR  63          3HG2      THR  63 -12.319  10.587  -1.350
  683    QG2  THR  63           QG2      THR  63 -11.509  10.182  -0.873
  684    H    SER  64           HN       SER  64 -12.528   7.356   3.046
  685    HA   SER  64           HA       SER  64 -14.134   6.219   4.195
  686   1HB   SER  64          2HB       SER  64 -15.312   4.999   1.677
  687   2HB   SER  64          3HB       SER  64 -16.069   5.279   3.250
  688    HG   SER  64           HG       SER  64 -15.390   7.160   1.268
  689    QB   SER  64           QB       SER  64 -15.690   5.140   2.463
  690    H    ASP  65           HN       ASP  65 -14.925   3.522   3.770
  691    HA   ASP  65           HA       ASP  65 -14.321   1.464   4.049
  692   1HB   ASP  65          2HB       ASP  65 -13.516   1.737   1.650
  693   2HB   ASP  65          3HB       ASP  65 -11.873   1.838   2.307
  694    QB   ASP  65           QB       ASP  65 -12.695   1.787   1.978
  695    H    SER  66           HN       SER  66 -13.457   0.344   5.693
  696    HA   SER  66           HA       SER  66 -12.341   0.023   7.674
  697   1HB   SER  66          2HB       SER  66  -9.734   0.066   7.243
  698   2HB   SER  66          3HB       SER  66 -10.784  -1.183   6.598
  699    HG   SER  66           HG       SER  66 -10.239   1.149   5.064
  700    QB   SER  66           QB       SER  66 -10.259  -0.558   6.920
  701    H    ASN  67           HN       ASN  67 -13.367   2.136   8.436
  702    HA   ASN  67           HA       ASN  67 -11.248   3.575   9.831
  703   1HB   ASN  67          2HB       ASN  67 -11.537   4.829   7.646
  704   2HB   ASN  67          3HB       ASN  67 -13.229   5.101   8.080
  705   1HD2  ASN  67          2HD2      ASN  67 -10.194   7.024  10.138
  706   2HD2  ASN  67          1HD2      ASN  67  -9.872   5.529   9.262
  707    QB   ASN  67           QB       ASN  67 -12.383   4.965   7.863
  708    QD2  ASN  67           QD2      ASN  67 -10.033   6.277   9.700
  709    H    VAL  68           HN       VAL  68 -11.964   3.474  11.871
  710    HA   VAL  68           HA       VAL  68 -13.243   3.364  13.695
  711    HB   VAL  68           HB       VAL  68 -14.958   5.362  12.185
  712   1HG1  VAL  68          3HG1      VAL  68 -14.910   4.531  15.120
  713   2HG1  VAL  68          1HG1      VAL  68 -15.582   6.075  14.553
  714   3HG1  VAL  68          2HG1      VAL  68 -16.305   4.555  14.020
  715   1HG2  VAL  68          1HG2      VAL  68 -12.682   5.663  14.202
  716   2HG2  VAL  68          2HG2      VAL  68 -12.598   6.066  12.473
  717   3HG2  VAL  68          3HG2      VAL  68 -13.655   6.991  13.543
  718    QG1  VAL  68           QG1      VAL  68 -15.599   5.054  14.564
  719    QG2  VAL  68           QG2      VAL  68 -12.978   6.240  13.406
  720    QQG  VAL  68           QQG      VAL  68 -14.289   5.647  13.985
  721    NH1  ARG  69           NH2      ARG  69 -12.920  -5.453  11.313
  722    NH2  ARG  69           NH1      ARG  69 -14.644  -6.148  12.700
  723    H    ARG  69           HN       ARG  69 -13.698   1.247  13.704
  724    HA   ARG  69           HA       ARG  69 -16.322   0.253  12.701
  725   1HB   ARG  69          2HB       ARG  69 -13.743  -1.074  13.622
  726   2HB   ARG  69          3HB       ARG  69 -15.291  -1.923  13.673
  727   1HG   ARG  69          2HG       ARG  69 -15.629  -1.577  11.265
  728   2HG   ARG  69          3HG       ARG  69 -14.130  -0.639  11.163
  729   1HD   ARG  69          2HD       ARG  69 -13.800  -2.931  10.362
  730   2HD   ARG  69          3HD       ARG  69 -12.810  -2.604  11.808
  731    HE   ARG  69           HE       ARG  69 -15.261  -3.704  12.681
  732   1HH1  ARG  69          2HH2      ARG  69 -12.435  -4.700  10.850
  733   2HH1  ARG  69          1HH2      ARG  69 -12.561  -6.392  11.226
  734   1HH2  ARG  69          2HH1      ARG  69 -15.455  -5.938  13.264
  735   2HH2  ARG  69          1HH1      ARG  69 -14.331  -7.107  12.653
  736    QB   ARG  69           QB       ARG  69 -14.517  -1.499  13.647
  737    QG   ARG  69           QG       ARG  69 -14.879  -1.108  11.213
  738    QD   ARG  69           QD       ARG  69 -13.306  -2.767  11.085
  739    QH1  ARG  69           QH2      ARG  69 -12.498  -5.546  11.037
  740    QH2  ARG  69           QH1      ARG  69 -14.893  -6.522  12.959
   
  Start of MODEL           9
 Raw file had 740 H/Q atoms
  Start of MODEL    9
    1    H    SER   1           HN       SER   1  -4.863  10.196   4.863
    2    HA   SER   1           HA       SER   1  -4.578  11.192   2.093
    3   1HB   SER   1          2HB       SER   1  -3.229  12.500   3.697
    4   2HB   SER   1          3HB       SER   1  -2.485  11.015   4.326
    5    HG   SER   1           HG       SER   1  -1.725  12.453   2.230
    6    QB   SER   1           QB       SER   1  -2.858  11.758   4.012
    7    H    ILE   2           HN       ILE   2  -2.574   9.978   1.016
    8    HA   ILE   2           HA       ILE   2  -3.394   7.235   0.766
    9    HB   ILE   2           HB       ILE   2  -2.424   8.422  -1.113
   10   1HG1  ILE   2          2HG1      ILE   2  -0.724   6.069  -0.202
   11   2HG1  ILE   2          3HG1      ILE   2  -2.336   5.944  -0.876
   12   1HG2  ILE   2          2HG2      ILE   2  -0.682   9.770   0.172
   13   2HG2  ILE   2          3HG2      ILE   2   0.304   8.294   0.251
   14   3HG2  ILE   2          1HG2      ILE   2  -0.106   9.018  -1.311
   15   1HD1  ILE   2          2HD1      ILE   2  -1.496   7.027  -2.993
   16   2HD1  ILE   2          3HD1      ILE   2   0.152   6.967  -2.315
   17   3HD1  ILE   2          1HD1      ILE   2  -0.738   5.468  -2.615
   18    QG1  ILE   2           QG1      ILE   2  -1.530   6.006  -0.539
   19    QG2  ILE   2           QG2      ILE   2  -0.162   9.027  -0.296
   20    QD1  ILE   2           QD1      ILE   2  -0.694   6.488  -2.641
   21    H    SER   3           HN       SER   3  -0.698   8.822   2.459
   22    HA   SER   3           HA       SER   3   0.560   6.515   3.470
   23   1HB   SER   3          2HB       SER   3   1.303   8.989   3.660
   24   2HB   SER   3          3HB       SER   3   0.221   9.103   5.054
   25    HG   SER   3           HG       SER   3   2.543   7.568   4.675
   26    QB   SER   3           QB       SER   3   0.762   9.045   4.357
   27    H    SER   4           HN       SER   4  -2.183   8.450   4.828
   28    HA   SER   4           HA       SER   4  -2.739   6.848   7.054
   29   1HB   SER   4          2HB       SER   4  -5.085   7.887   5.502
   30   2HB   SER   4          3HB       SER   4  -4.719   8.028   7.218
   31    HG   SER   4           HG       SER   4  -3.229   9.671   6.728
   32    QB   SER   4           QB       SER   4  -4.902   7.959   6.360
   33    NH1  ARG   5           NH2      ARG   5  -4.648   6.427  -1.571
   34    NH2  ARG   5           NH1      ARG   5  -5.733   8.428  -2.007
   35    H    ARG   5           HN       ARG   5  -4.037   6.573   3.697
   36    HA   ARG   5           HA       ARG   5  -5.722   4.393   4.151
   37   1HB   ARG   5          2HB       ARG   5  -4.102   4.983   1.645
   38   2HB   ARG   5          3HB       ARG   5  -5.281   3.832   1.693
   39   1HG   ARG   5          2HG       ARG   5  -6.939   5.636   2.534
   40   2HG   ARG   5          3HG       ARG   5  -5.708   6.810   2.110
   41   1HD   ARG   5          2HD       ARG   5  -6.154   4.932  -0.120
   42   2HD   ARG   5          3HD       ARG   5  -7.647   5.574   0.452
   43    HE   ARG   5           HE       ARG   5  -7.137   7.731  -0.082
   44   1HH1  ARG   5          2HH2      ARG   5  -4.487   5.658  -0.940
   45   2HH1  ARG   5          1HH2      ARG   5  -4.230   6.358  -2.502
   46   1HH2  ARG   5          2HH1      ARG   5  -6.410   9.128  -1.756
   47   2HH2  ARG   5          1HH1      ARG   5  -5.286   8.529  -2.922
   48    QB   ARG   5           QB       ARG   5  -4.691   4.408   1.668
   49    QG   ARG   5           QG       ARG   5  -6.324   6.223   2.322
   50    QD   ARG   5           QD       ARG   5  -6.901   5.253   0.165
   51    QH1  ARG   5           QH2      ARG   5  -4.359   6.008  -1.721
   52    QH2  ARG   5           QH1      ARG   5  -5.847   8.828  -2.338
   53    H    VAL   6           HN       VAL   6  -2.344   4.185   2.847
   54    HA   VAL   6           HA       VAL   6  -2.383   1.334   2.983
   55    HB   VAL   6           HB       VAL   6  -0.064   3.300   2.798
   56   1HG1  VAL   6          2HG1      VAL   6  -0.181   0.255   2.825
   57   2HG1  VAL   6          3HG1      VAL   6   1.144   1.135   2.056
   58   3HG1  VAL   6          1HG1      VAL   6   0.821   1.371   3.784
   59   1HG2  VAL   6          3HG2      VAL   6  -1.656   1.645   0.798
   60   2HG2  VAL   6          1HG2      VAL   6  -1.285   3.385   0.757
   61   3HG2  VAL   6          2HG2      VAL   6  -0.018   2.199   0.439
   62    QG1  VAL   6           QG1      VAL   6   0.594   0.920   2.888
   63    QG2  VAL   6           QG2      VAL   6  -0.986   2.410   0.665
   64    QQG  VAL   6           QQG      VAL   6  -0.196   1.665   1.776
   65    H    LYS   7           HN       LYS   7  -1.009   3.765   5.288
   66    HA   LYS   7           HA       LYS   7   0.174   1.853   7.007
   67   1HB   LYS   7          2HB       LYS   7   0.525   4.398   6.895
   68   2HB   LYS   7          3HB       LYS   7  -0.969   4.555   7.815
   69   1HG   LYS   7          2HG       LYS   7   0.572   4.640   9.501
   70   2HG   LYS   7          3HG       LYS   7   0.240   2.916   9.507
   71   1HD   LYS   7          2HD       LYS   7   2.388   2.436   9.084
   72   2HD   LYS   7          3HD       LYS   7   2.402   3.385   7.602
   73   1HE   LYS   7          2HE       LYS   7   2.779   4.556  10.409
   74   2HE   LYS   7          3HE       LYS   7   4.116   4.048   9.372
   75   1HZ   LYS   7          1HZ       LYS   7   2.168   6.121   8.595
   76   2HZ   LYS   7          2HZ       LYS   7   3.646   6.416   9.251
   77   3HZ   LYS   7          3HZ       LYS   7   3.530   5.692   7.786
   78    QB   LYS   7           QB       LYS   7  -0.222   4.476   7.355
   79    QG   LYS   7           QG       LYS   7   0.405   3.779   9.504
   80    QD   LYS   7           QD       LYS   7   2.395   2.910   8.344
   81    QE   LYS   7           QE       LYS   7   3.447   4.302   9.891
   82    QZ   LYS   7           QZ       LYS   7   3.115   6.076   8.544
   83    H    SER   8           HN       SER   8  -3.035   3.528   7.290
   84    HA   SER   8           HA       SER   8  -3.981   2.260   9.637
   85   1HB   SER   8          2HB       SER   8  -5.516   3.245   7.195
   86   2HB   SER   8          3HB       SER   8  -6.258   2.754   8.722
   87    HG   SER   8           HG       SER   8  -4.167   4.637   8.722
   88    QB   SER   8           QB       SER   8  -5.886   3.000   7.958
   89    H    LYS   9           HN       LYS   9  -4.269   1.233   6.179
   90    HA   LYS   9           HA       LYS   9  -5.780  -1.072   6.896
   91   1HB   LYS   9          2HB       LYS   9  -5.503   0.187   4.610
   92   2HB   LYS   9          3HB       LYS   9  -4.124  -0.878   4.379
   93   1HG   LYS   9          2HG       LYS   9  -6.118  -1.785   3.331
   94   2HG   LYS   9          3HG       LYS   9  -5.742  -2.822   4.720
   95   1HD   LYS   9          2HD       LYS   9  -7.505  -0.809   5.713
   96   2HD   LYS   9          3HD       LYS   9  -8.109  -1.104   4.116
   97   1HE   LYS   9          2HE       LYS   9  -7.529  -3.323   6.143
   98   2HE   LYS   9          3HE       LYS   9  -9.096  -2.525   5.997
   99   1HZ   LYS   9          2HZ       LYS   9  -9.247  -3.343   3.698
  100   2HZ   LYS   9          3HZ       LYS   9  -7.798  -4.083   3.834
  101   3HZ   LYS   9          1HZ       LYS   9  -9.047  -4.576   4.762
  102    QB   LYS   9           QB       LYS   9  -4.814  -0.345   4.494
  103    QG   LYS   9           QG       LYS   9  -5.930  -2.304   4.026
  104    QD   LYS   9           QD       LYS   9  -7.807  -0.957   4.915
  105    QE   LYS   9           QE       LYS   9  -8.312  -2.924   6.070
  106    QZ   LYS   9           QZ       LYS   9  -8.697  -4.000   4.098
  107    NH1  ARG  10           NH2      ARG  10   2.406  -0.984   3.426
  108    NH2  ARG  10           NH1      ARG  10   3.258   0.866   4.493
  109    H    ARG  10           HN       ARG  10  -2.275  -0.557   6.560
  110    HA   ARG  10           HA       ARG  10  -1.373  -3.175   7.014
  111   1HB   ARG  10          2HB       ARG  10  -0.173  -0.668   6.838
  112   2HB   ARG  10          3HB       ARG  10   0.004  -0.989   8.553
  113   1HG   ARG  10          2HG       ARG  10   1.879  -2.090   8.016
  114   2HG   ARG  10          3HG       ARG  10   0.829  -3.389   7.436
  115   1HD   ARG  10          2HD       ARG  10   2.259  -2.965   5.649
  116   2HD   ARG  10          3HD       ARG  10   0.735  -2.150   5.215
  117    HE   ARG  10           HE       ARG  10   2.808  -0.515   6.564
  118   1HH1  ARG  10          2HH2      ARG  10   1.998  -1.905   3.468
  119   2HH1  ARG  10          1HH2      ARG  10   2.592  -0.555   2.529
  120   1HH2  ARG  10          2HH1      ARG  10   3.367   1.461   5.295
  121   2HH2  ARG  10          1HH1      ARG  10   3.432   1.287   3.572
  122    QB   ARG  10           QB       ARG  10  -0.084  -0.829   7.695
  123    QG   ARG  10           QG       ARG  10   1.354  -2.740   7.726
  124    QD   ARG  10           QD       ARG  10   1.497  -2.557   5.432
  125    QH1  ARG  10           QH2      ARG  10   2.295  -1.230   2.999
  126    QH2  ARG  10           QH1      ARG  10   3.399   1.374   4.434
  127    H    ILE  11           HN       ILE  11  -2.267  -0.665   9.459
  128    HA   ILE  11           HA       ILE  11  -1.863  -2.329  11.747
  129    HB   ILE  11           HB       ILE  11  -3.694   0.075  11.403
  130   1HG1  ILE  11          2HG1      ILE  11  -2.045   0.924  13.156
  131   2HG1  ILE  11          3HG1      ILE  11  -0.997  -0.433  12.757
  132   1HG2  ILE  11          1HG2      ILE  11  -3.095  -1.560  13.905
  133   2HG2  ILE  11          2HG2      ILE  11  -3.904   0.019  13.892
  134   3HG2  ILE  11          3HG2      ILE  11  -4.694  -1.359  13.152
  135   1HD1  ILE  11          3HD1      ILE  11  -1.968   1.666  10.777
  136   2HD1  ILE  11          1HD1      ILE  11  -0.454   1.796  11.684
  137   3HD1  ILE  11          2HD1      ILE  11  -0.654   0.463  10.537
  138    QG1  ILE  11           QG1      ILE  11  -1.521   0.245  12.956
  139    QG2  ILE  11           QG2      ILE  11  -3.898  -0.967  13.650
  140    QD1  ILE  11           QD1      ILE  11  -1.026   1.309  10.999
  141    H    GLN  12           HN       GLN  12  -4.886  -1.617   9.974
  142    HA   GLN  12           HA       GLN  12  -6.582  -3.378  11.381
  143   1HB   GLN  12          2HB       GLN  12  -6.600  -2.440   8.504
  144   2HB   GLN  12          3HB       GLN  12  -7.851  -3.513   9.130
  145   1HG   GLN  12          2HG       GLN  12  -7.381  -1.215  10.930
  146   2HG   GLN  12          3HG       GLN  12  -7.844  -0.707   9.309
  147   1HE2  GLN  12          2HE2      GLN  12 -11.169  -1.992   9.545
  148   2HE2  GLN  12          1HE2      GLN  12  -9.942  -1.377   8.452
  149    QB   GLN  12           QB       GLN  12  -7.225  -2.977   8.817
  150    QG   GLN  12           QG       GLN  12  -7.613  -0.961  10.120
  151    QE2  GLN  12           QE2      GLN  12 -10.556  -1.684   8.998
  152    H    LEU  13           HN       LEU  13  -4.376  -4.211   8.686
  153    HA   LEU  13           HA       LEU  13  -5.097  -7.033   8.680
  154   1HB   LEU  13          2HB       LEU  13  -2.845  -5.344   7.572
  155   2HB   LEU  13          3HB       LEU  13  -2.676  -7.095   7.597
  156    HG   LEU  13           HG       LEU  13  -5.323  -6.130   6.624
  157   1HD1  LEU  13          3HD1      LEU  13  -3.605  -4.517   5.585
  158   2HD1  LEU  13          1HD1      LEU  13  -3.027  -5.930   4.681
  159   3HD1  LEU  13          2HD1      LEU  13  -4.738  -5.414   4.578
  160   1HD2  LEU  13          1HD2      LEU  13  -4.607  -8.533   6.674
  161   2HD2  LEU  13          2HD2      LEU  13  -4.982  -7.968   5.022
  162   3HD2  LEU  13          3HD2      LEU  13  -3.290  -8.135   5.546
  163    QB   LEU  13           QB       LEU  13  -2.760  -6.219   7.584
  164    QD1  LEU  13           QD1      LEU  13  -3.790  -5.286   4.948
  165    QD2  LEU  13           QD2      LEU  13  -4.293  -8.212   5.747
  166    QQD  LEU  13           QQD      LEU  13  -4.041  -6.749   5.348
  167    H    GLY  14           HN       GLY  14  -2.873  -5.085  10.601
  168   1HA   GLY  14          1HA       GLY  14  -1.822  -5.645  12.568
  169   2HA   GLY  14          2HA       GLY  14  -2.427  -7.307  12.443
  170    QA   GLY  14           QA       GLY  14  -2.125  -6.476  12.505
  171    H    LEU  15           HN       LEU  15  -0.522  -5.351  10.109
  172    HA   LEU  15           HA       LEU  15   1.858  -7.109  10.428
  173   1HB   LEU  15          2HB       LEU  15   0.350  -6.503   7.849
  174   2HB   LEU  15          3HB       LEU  15   1.970  -7.201   7.887
  175    HG   LEU  15           HG       LEU  15  -0.423  -8.547   9.221
  176   1HD1  LEU  15          3HD1      LEU  15  -0.819  -8.255   6.790
  177   2HD1  LEU  15          1HD1      LEU  15   0.727  -9.088   6.479
  178   3HD1  LEU  15          2HD1      LEU  15  -0.612  -9.956   7.270
  179   1HD2  LEU  15          2HD2      LEU  15   2.285  -9.624   8.291
  180   2HD2  LEU  15          3HD2      LEU  15   1.832  -9.335   9.984
  181   3HD2  LEU  15          1HD2      LEU  15   0.991 -10.571   9.041
  182    QB   LEU  15           QB       LEU  15   1.160  -6.852   7.868
  183    QD1  LEU  15           QD1      LEU  15  -0.235  -9.100   6.846
  184    QD2  LEU  15           QD2      LEU  15   1.703  -9.843   9.105
  185    QQD  LEU  15           QQD      LEU  15   0.734  -9.471   7.975
  186    H    ASN  16           HN       ASN  16   3.743  -6.111   9.351
  187    HA   ASN  16           HA       ASN  16   3.562  -3.134   9.485
  188   1HB   ASN  16          2HB       ASN  16   5.697  -3.053  10.201
  189   2HB   ASN  16          3HB       ASN  16   5.173  -4.566  10.927
  190   1HD2  ASN  16          2HD2      ASN  16   7.405  -6.560   8.920
  191   2HD2  ASN  16          1HD2      ASN  16   5.850  -6.614   9.737
  192    QB   ASN  16           QB       ASN  16   5.434  -3.809  10.564
  193    QD2  ASN  16           QD2      ASN  16   6.628  -6.587   9.328
  194    H    GLN  17           HN       GLN  17   5.468  -2.118   8.147
  195    HA   GLN  17           HA       GLN  17   4.518  -2.067   5.468
  196   1HB   GLN  17          2HB       GLN  17   7.091  -1.028   6.610
  197   2HB   GLN  17          3HB       GLN  17   6.382  -0.511   5.079
  198   1HG   GLN  17          2HG       GLN  17   4.445   0.361   6.648
  199   2HG   GLN  17          3HG       GLN  17   5.533   0.005   7.967
  200   1HE2  GLN  17          2HE2      GLN  17   6.659   3.024   5.371
  201   2HE2  GLN  17          1HE2      GLN  17   5.904   1.606   4.688
  202    QB   GLN  17           QB       GLN  17   6.737  -0.770   5.844
  203    QG   GLN  17           QG       GLN  17   4.989   0.184   7.307
  204    QE2  GLN  17           QE2      GLN  17   6.281   2.316   5.029
  205    H    ALA  18           HN       ALA  18   7.496  -3.566   6.811
  206    HA   ALA  18           HA       ALA  18   8.449  -4.438   4.240
  207   1HB   ALA  18          2HB       ALA  18   9.913  -4.124   6.190
  208   2HB   ALA  18          3HB       ALA  18   9.112  -5.473   7.023
  209   3HB   ALA  18          1HB       ALA  18  10.037  -5.767   5.531
  210    QB   ALA  18           QB       ALA  18   9.687  -5.121   6.248
  211    H    GLU  19           HN       GLU  19   6.547  -6.071   6.829
  212    HA   GLU  19           HA       GLU  19   6.222  -8.616   5.612
  213   1HB   GLU  19          2HB       GLU  19   4.566  -6.898   7.464
  214   2HB   GLU  19          3HB       GLU  19   3.850  -8.359   6.784
  215   1HG   GLU  19          2HG       GLU  19   5.475  -9.796   7.726
  216   2HG   GLU  19          3HG       GLU  19   6.521  -8.465   8.220
  217    QB   GLU  19           QB       GLU  19   4.208  -7.628   7.124
  218    QG   GLU  19           QG       GLU  19   5.998  -9.131   7.973
  219    H    LEU  20           HN       LEU  20   4.248  -5.604   5.233
  220    HA   LEU  20           HA       LEU  20   2.555  -6.761   3.312
  221   1HB   LEU  20          2HB       LEU  20   1.982  -4.773   4.407
  222   2HB   LEU  20          3HB       LEU  20   3.245  -3.844   3.566
  223    HG   LEU  20           HG       LEU  20   1.578  -5.460   1.714
  224   1HD1  LEU  20          3HD1      LEU  20   0.136  -3.599   3.578
  225   2HD1  LEU  20          1HD1      LEU  20  -0.404  -3.934   1.921
  226   3HD1  LEU  20          2HD1      LEU  20  -0.259  -5.262   3.088
  227   1HD2  LEU  20          1HD2      LEU  20   3.121  -3.356   1.269
  228   2HD2  LEU  20          2HD2      LEU  20   1.639  -3.679   0.362
  229   3HD2  LEU  20          3HD2      LEU  20   1.603  -2.472   1.616
  230    QB   LEU  20           QB       LEU  20   2.614  -4.308   3.986
  231    QD1  LEU  20           QD1      LEU  20  -0.175  -4.265   2.862
  232    QD2  LEU  20           QD2      LEU  20   2.121  -3.169   1.082
  233    QQD  LEU  20           QQD      LEU  20   0.973  -3.717   1.972
  234    H    ALA  21           HN       ALA  21   5.595  -4.884   2.820
  235    HA   ALA  21           HA       ALA  21   5.746  -4.989   0.048
  236   1HB   ALA  21          2HB       ALA  21   7.399  -3.975   1.886
  237   2HB   ALA  21          3HB       ALA  21   8.282  -5.477   1.598
  238   3HB   ALA  21          1HB       ALA  21   7.953  -4.378   0.249
  239    QB   ALA  21           QB       ALA  21   7.878  -4.610   1.244
  240    H    GLN  22           HN       GLN  22   6.766  -7.504   2.390
  241    HA   GLN  22           HA       GLN  22   7.736  -9.383   0.491
  242   1HB   GLN  22          2HB       GLN  22   6.624  -9.713   3.305
  243   2HB   GLN  22          3HB       GLN  22   6.999 -11.088   2.268
  244   1HG   GLN  22          2HG       GLN  22   9.335 -10.053   1.954
  245   2HG   GLN  22          3HG       GLN  22   8.916  -8.973   3.295
  246   1HE2  GLN  22          2HE2      GLN  22  10.379 -11.552   5.310
  247   2HE2  GLN  22          1HE2      GLN  22  10.517  -9.893   4.751
  248    QB   GLN  22           QB       GLN  22   6.811 -10.401   2.787
  249    QG   GLN  22           QG       GLN  22   9.125  -9.513   2.624
  250    QE2  GLN  22           QE2      GLN  22  10.448 -10.723   5.031
  251    H    LYS  23           HN       LYS  23   4.391  -9.240   1.968
  252    HA   LYS  23           HA       LYS  23   3.576 -11.398   0.262
  253   1HB   LYS  23          2HB       LYS  23   1.339 -11.065   0.888
  254   2HB   LYS  23          3HB       LYS  23   2.372 -10.902   2.320
  255   1HG   LYS  23          2HG       LYS  23   2.110  -8.539   2.339
  256   2HG   LYS  23          3HG       LYS  23   1.382  -8.487   0.732
  257   1HD   LYS  23          2HD       LYS  23  -0.379  -8.158   2.273
  258   2HD   LYS  23          3HD       LYS  23  -0.585  -9.771   1.558
  259   1HE   LYS  23          2HE       LYS  23   0.435 -10.718   3.692
  260   2HE   LYS  23          3HE       LYS  23   0.609  -9.050   4.262
  261   1HZ   LYS  23          3HZ       LYS  23  -1.972  -9.089   3.693
  262   2HZ   LYS  23          1HZ       LYS  23  -1.769 -10.680   4.072
  263   3HZ   LYS  23          2HZ       LYS  23  -1.375  -9.522   5.165
  264    QB   LYS  23           QB       LYS  23   1.855 -10.984   1.604
  265    QG   LYS  23           QG       LYS  23   1.746  -8.512   1.536
  266    QD   LYS  23           QD       LYS  23  -0.482  -8.965   1.915
  267    QE   LYS  23           QE       LYS  23   0.522  -9.883   3.977
  268    QZ   LYS  23           QZ       LYS  23  -1.705  -9.763   4.310
  269    H    VAL  24           HN       VAL  24   3.735  -7.943  -0.364
  270    HA   VAL  24           HA       VAL  24   2.284  -8.021  -2.889
  271    HB   VAL  24           HB       VAL  24   4.417  -6.150  -1.834
  272   1HG1  VAL  24          3HG1      VAL  24   2.489  -5.826  -4.171
  273   2HG1  VAL  24          1HG1      VAL  24   3.448  -4.506  -3.474
  274   3HG1  VAL  24          2HG1      VAL  24   4.261  -5.861  -4.271
  275   1HG2  VAL  24          2HG2      VAL  24   1.991  -6.385  -0.664
  276   2HG2  VAL  24          3HG2      VAL  24   2.862  -4.856  -0.901
  277   3HG2  VAL  24          1HG2      VAL  24   1.545  -5.321  -2.001
  278    QG1  VAL  24           QG1      VAL  24   3.399  -5.398  -3.972
  279    QG2  VAL  24           QG2      VAL  24   2.133  -5.521  -1.189
  280    QQG  VAL  24           QQG      VAL  24   2.766  -5.459  -2.580
  281    H    GLY  25           HN       GLY  25   5.636  -8.694  -1.834
  282   1HA   GLY  25          1HA       GLY  25   7.298  -9.822  -2.952
  283   2HA   GLY  25          2HA       GLY  25   6.282  -9.972  -4.395
  284    QA   GLY  25           QA       GLY  25   6.790  -9.898  -3.674
  285    H    THR  26           HN       THR  26   7.249  -7.127  -2.462
  286    HA   THR  26           HA       THR  26   8.915  -6.092  -4.697
  287    HB   THR  26           HB       THR  26   6.668  -5.035  -4.846
  288    HG1  THR  26          1HG       THR  26   8.360  -3.854  -5.588
  289   1HG2  THR  26          2HG2      THR  26   6.269  -5.000  -2.299
  290   2HG2  THR  26          3HG2      THR  26   7.305  -3.560  -2.263
  291   3HG2  THR  26          1HG2      THR  26   5.814  -3.552  -3.220
  292    QG2  THR  26           QG2      THR  26   6.463  -4.037  -2.594
  293    H    THR  27           HN       THR  27   9.451  -3.682  -3.309
  294    HA   THR  27           HA       THR  27  11.171  -4.723  -1.063
  295    HB   THR  27           HB       THR  27  12.800  -3.000  -1.769
  296    HG1  THR  27          1HG       THR  27  10.858  -2.010  -3.233
  297   1HG2  THR  27          2HG2      THR  27  12.927  -5.385  -2.558
  298   2HG2  THR  27          3HG2      THR  27  12.054  -4.908  -4.032
  299   3HG2  THR  27          1HG2      THR  27  13.655  -4.224  -3.689
  300    QG2  THR  27           QG2      THR  27  12.878  -4.839  -3.426
  301    H    GLN  28           HN       GLN  28  11.149  -3.623   0.846
  302    HA   GLN  28           HA       GLN  28   9.081  -1.955   1.573
  303   1HB   GLN  28          2HB       GLN  28  10.518  -3.103   3.174
  304   2HB   GLN  28          3HB       GLN  28  11.867  -2.010   2.790
  305   1HG   GLN  28          2HG       GLN  28  10.606  -0.083   3.638
  306   2HG   GLN  28          3HG       GLN  28   9.150  -1.080   3.830
  307   1HE2  GLN  28          2HE2      GLN  28  10.315  -0.934   7.230
  308   2HE2  GLN  28          1HE2      GLN  28   9.344  -0.045   6.069
  309    QB   GLN  28           QB       GLN  28  11.193  -2.556   2.982
  310    QG   GLN  28           QG       GLN  28   9.878  -0.582   3.733
  311    QE2  GLN  28           QE2      GLN  28   9.830  -0.489   6.649
  312    H    GLN  29           HN       GLN  29  12.153  -0.992   0.046
  313    HA   GLN  29           HA       GLN  29  12.030   1.729   0.539
  314   1HB   GLN  29          2HB       GLN  29  13.812   0.273  -0.726
  315   2HB   GLN  29          3HB       GLN  29  12.856   0.589  -2.176
  316   1HG   GLN  29          2HG       GLN  29  14.724   2.171  -1.973
  317   2HG   GLN  29          3HG       GLN  29  13.191   3.040  -1.823
  318   1HE2  GLN  29          2HE2      GLN  29  13.615   4.095   1.531
  319   2HE2  GLN  29          1HE2      GLN  29  12.760   4.167   0.044
  320    QB   GLN  29           QB       GLN  29  13.334   0.430  -1.450
  321    QG   GLN  29           QG       GLN  29  13.958   2.605  -1.898
  322    QE2  GLN  29           QE2      GLN  29  13.188   4.131   0.788
  323    H    SER  30           HN       SER  30  10.344  -0.144  -1.995
  324    HA   SER  30           HA       SER  30   9.139   2.041  -3.353
  325   1HB   SER  30          2HB       SER  30   8.038  -0.797  -3.086
  326   2HB   SER  30          3HB       SER  30   7.897   0.306  -4.463
  327    HG   SER  30           HG       SER  30  10.171   0.084  -4.738
  328    QB   SER  30           QB       SER  30   7.968  -0.245  -3.774
  329    H    ILE  31           HN       ILE  31   8.310   0.131  -0.489
  330    HA   ILE  31           HA       ILE  31   5.569   1.058  -0.257
  331    HB   ILE  31           HB       ILE  31   7.429  -0.171   1.821
  332   1HG1  ILE  31          2HG1      ILE  31   7.327  -1.776   0.051
  333   2HG1  ILE  31          3HG1      ILE  31   6.165  -2.270   1.279
  334   1HG2  ILE  31          3HG2      ILE  31   5.509   0.875   2.830
  335   2HG2  ILE  31          1HG2      ILE  31   4.431  -0.051   1.752
  336   3HG2  ILE  31          2HG2      ILE  31   5.425  -0.890   2.956
  337   1HD1  ILE  31          3HD1      ILE  31   4.327  -1.256  -0.149
  338   2HD1  ILE  31          1HD1      ILE  31   5.554  -0.997  -1.413
  339   3HD1  ILE  31          2HD1      ILE  31   5.178  -2.634  -0.861
  340    QG1  ILE  31           QG1      ILE  31   6.746  -2.023   0.665
  341    QG2  ILE  31           QG2      ILE  31   5.122  -0.023   2.513
  342    QD1  ILE  31           QD1      ILE  31   5.019  -1.629  -0.807
  343    H    GLU  32           HN       GLU  32   8.674   1.965   1.319
  344    HA   GLU  32           HA       GLU  32   7.754   4.121   2.853
  345   1HB   GLU  32          2HB       GLU  32   9.991   3.134   3.040
  346   2HB   GLU  32          3HB       GLU  32  10.453   3.779   1.461
  347   1HG   GLU  32          2HG       GLU  32  10.256   6.078   2.304
  348   2HG   GLU  32          3HG       GLU  32   9.619   5.479   3.846
  349    QB   GLU  32           QB       GLU  32  10.222   3.456   2.251
  350    QG   GLU  32           QG       GLU  32   9.938   5.778   3.076
  351    H    GLN  33           HN       GLN  33   9.213   4.350  -0.443
  352    HA   GLN  33           HA       GLN  33   8.691   7.099  -0.770
  353   1HB   GLN  33          2HB       GLN  33   9.039   6.709  -3.187
  354   2HB   GLN  33          3HB       GLN  33  10.260   5.968  -2.107
  355   1HG   GLN  33          2HG       GLN  33  10.112   4.237  -3.429
  356   2HG   GLN  33          3HG       GLN  33   8.686   3.901  -2.443
  357   1HE2  GLN  33          2HE2      GLN  33   6.470   4.173  -5.139
  358   2HE2  GLN  33          1HE2      GLN  33   6.874   3.391  -3.620
  359    QB   GLN  33           QB       GLN  33   9.649   6.338  -2.648
  360    QG   GLN  33           QG       GLN  33   9.398   4.069  -2.936
  361    QE2  GLN  33           QE2      GLN  33   6.672   3.782  -4.379
  362    H    LEU  34           HN       LEU  34   6.632   4.362  -1.649
  363    HA   LEU  34           HA       LEU  34   4.514   5.862  -2.824
  364   1HB   LEU  34          2HB       LEU  34   4.652   3.461  -3.094
  365   2HB   LEU  34          3HB       LEU  34   4.476   3.214  -1.349
  366    HG   LEU  34           HG       LEU  34   2.170   4.073  -1.428
  367   1HD1  LEU  34          1HD1      LEU  34   2.680   4.293  -4.426
  368   2HD1  LEU  34          2HD1      LEU  34   1.080   4.378  -3.677
  369   3HD1  LEU  34          3HD1      LEU  34   2.272   5.644  -3.337
  370   1HD2  LEU  34          1HD2      LEU  34   2.860   1.629  -1.943
  371   2HD2  LEU  34          2HD2      LEU  34   1.222   2.144  -2.397
  372   3HD2  LEU  34          3HD2      LEU  34   2.494   2.040  -3.635
  373    QB   LEU  34           QB       LEU  34   4.564   3.338  -2.222
  374    QD1  LEU  34           QD1      LEU  34   2.010   4.771  -3.813
  375    QD2  LEU  34           QD2      LEU  34   2.192   1.938  -2.658
  376    QQD  LEU  34           QQD      LEU  34   2.101   3.355  -3.236
  377    H    GLU  35           HN       GLU  35   4.936   4.775   0.589
  378    HA   GLU  35           HA       GLU  35   2.620   6.094   1.603
  379   1HB   GLU  35          2HB       GLU  35   5.136   4.917   2.778
  380   2HB   GLU  35          3HB       GLU  35   4.162   5.986   3.788
  381   1HG   GLU  35          2HG       GLU  35   3.536   3.632   4.089
  382   2HG   GLU  35          3HG       GLU  35   2.185   4.625   3.532
  383    QB   GLU  35           QB       GLU  35   4.649   5.452   3.282
  384    QG   GLU  35           QG       GLU  35   2.861   4.129   3.810
  385    H    ASN  36           HN       ASN  36   5.885   7.278   1.009
  386    HA   ASN  36           HA       ASN  36   5.367   9.919   2.118
  387   1HB   ASN  36          2HB       ASN  36   7.565   8.515   0.705
  388   2HB   ASN  36          3HB       ASN  36   7.399  10.170   0.158
  389   1HD2  ASN  36          2HD2      ASN  36   9.775  10.014   3.053
  390   2HD2  ASN  36          1HD2      ASN  36   9.678   9.116   1.553
  391    QB   ASN  36           QB       ASN  36   7.482   9.343   0.431
  392    QD2  ASN  36           QD2      ASN  36   9.727   9.565   2.303
  393    H    GLY  37           HN       GLY  37   3.760   8.484  -0.371
  394   1HA   GLY  37          1HA       GLY  37   2.479   9.262  -2.054
  395   2HA   GLY  37          2HA       GLY  37   2.606  10.873  -1.331
  396    QA   GLY  37           QA       GLY  37   2.543  10.067  -1.692
  397    H    LYS  38           HN       LYS  38   5.269   8.808  -2.592
  398    HA   LYS  38           HA       LYS  38   5.664  10.703  -4.887
  399   1HB   LYS  38          2HB       LYS  38   7.815   9.332  -3.221
  400   2HB   LYS  38          3HB       LYS  38   8.035  10.306  -4.692
  401   1HG   LYS  38          2HG       LYS  38   6.842  12.195  -3.495
  402   2HG   LYS  38          3HG       LYS  38   6.976  11.257  -2.000
  403   1HD   LYS  38          2HD       LYS  38   9.201  11.766  -1.746
  404   2HD   LYS  38          3HD       LYS  38   9.556  11.336  -3.413
  405   1HE   LYS  38          2HE       LYS  38  10.107  13.660  -3.152
  406   2HE   LYS  38          3HE       LYS  38   8.705  13.520  -4.218
  407   1HZ   LYS  38          1HZ       LYS  38   7.311  14.053  -2.291
  408   2HZ   LYS  38          2HZ       LYS  38   8.650  14.248  -1.358
  409   3HZ   LYS  38          3HZ       LYS  38   8.382  15.257  -2.628
  410    QB   LYS  38           QB       LYS  38   7.925   9.819  -3.957
  411    QG   LYS  38           QG       LYS  38   6.909  11.726  -2.748
  412    QD   LYS  38           QD       LYS  38   9.379  11.551  -2.580
  413    QE   LYS  38           QE       LYS  38   9.406  13.590  -3.684
  414    QZ   LYS  38           QZ       LYS  38   8.114  14.519  -2.092
  415    H    THR  39           HN       THR  39   3.962   8.840  -5.355
  416    HA   THR  39           HA       THR  39   5.433   7.375  -7.424
  417    HB   THR  39           HB       THR  39   3.413   6.015  -5.602
  418    HG1  THR  39          1HG       THR  39   6.129   6.281  -5.476
  419   1HG2  THR  39          3HG2      THR  39   5.108   4.887  -7.884
  420   2HG2  THR  39          1HG2      THR  39   4.066   3.944  -6.803
  421   3HG2  THR  39          2HG2      THR  39   3.346   5.120  -7.904
  422    QG2  THR  39           QG2      THR  39   4.173   4.650  -7.531
  423    H    LYS  40           HN       LYS  40   4.236   7.581  -9.294
  424    HA   LYS  40           HA       LYS  40   1.666   8.945  -9.187
  425   1HB   LYS  40          2HB       LYS  40   3.406   7.755 -11.346
  426   2HB   LYS  40          3HB       LYS  40   1.773   8.244 -11.751
  427   1HG   LYS  40          2HG       LYS  40   3.426  10.240 -10.197
  428   2HG   LYS  40          3HG       LYS  40   3.959   9.876 -11.827
  429   1HD   LYS  40          2HD       LYS  40   2.579  11.842 -11.796
  430   2HD   LYS  40          3HD       LYS  40   1.870  10.601 -12.813
  431   1HE   LYS  40          2HE       LYS  40   0.987  11.213  -9.932
  432   2HE   LYS  40          3HE       LYS  40   0.285  11.969 -11.362
  433   1HZ   LYS  40          3HZ       LYS  40  -0.387   9.802 -12.138
  434   2HZ   LYS  40          1HZ       LYS  40   0.184   9.092 -10.765
  435   3HZ   LYS  40          2HZ       LYS  40  -1.053  10.156 -10.678
  436    QB   LYS  40           QB       LYS  40   2.589   7.999 -11.549
  437    QG   LYS  40           QG       LYS  40   3.693  10.058 -11.012
  438    QD   LYS  40           QD       LYS  40   2.225  11.221 -12.305
  439    QE   LYS  40           QE       LYS  40   0.636  11.590 -10.647
  440    QZ   LYS  40           QZ       LYS  40  -0.419   9.683 -11.194
  441    NH1  ARG  41           NH2      ARG  41  -0.082   2.170 -15.338
  442    NH2  ARG  41           NH1      ARG  41  -2.027   0.921 -15.458
  443    H    ARG  41           HN       ARG  41   2.639   5.642 -10.255
  444    HA   ARG  41           HA       ARG  41  -0.095   4.593  -9.680
  445   1HB   ARG  41          2HB       ARG  41   0.035   5.789 -11.909
  446   2HB   ARG  41          3HB       ARG  41   1.305   4.699 -12.418
  447   1HG   ARG  41          2HG       ARG  41  -1.596   3.977 -11.810
  448   2HG   ARG  41          3HG       ARG  41  -0.861   4.221 -13.393
  449   1HD   ARG  41          2HD       ARG  41   0.713   2.217 -12.791
  450   2HD   ARG  41          3HD       ARG  41  -0.411   1.910 -11.487
  451    HE   ARG  41           HE       ARG  41  -2.020   1.180 -12.951
  452   1HH1  ARG  41          2HH2      ARG  41   0.590   2.677 -14.784
  453   2HH1  ARG  41          1HH2      ARG  41   0.045   2.129 -16.339
  454   1HH2  ARG  41          2HH1      ARG  41  -2.819   0.477 -15.018
  455   2HH2  ARG  41          1HH1      ARG  41  -1.953   0.865 -16.463
  456    QB   ARG  41           QB       ARG  41   0.669   5.244 -12.163
  457    QG   ARG  41           QG       ARG  41  -1.228   4.099 -12.602
  458    QD   ARG  41           QD       ARG  41   0.151   2.063 -12.139
  459    QH1  ARG  41           QH2      ARG  41   0.317   2.403 -15.561
  460    QH2  ARG  41           QH1      ARG  41  -2.386   0.671 -15.740
  461    HA   PRO  42           HA       PRO  42   3.443   1.790  -9.000
  462   1HB   PRO  42          2HB       PRO  42   2.248   0.104  -7.084
  463   2HB   PRO  42          3HB       PRO  42   3.306   1.518  -6.810
  464   1HG   PRO  42          2HG       PRO  42   0.377   1.310  -6.507
  465   2HG   PRO  42          3HG       PRO  42   1.494   2.457  -5.741
  466   1HD   PRO  42          2HD       PRO  42  -0.230   3.066  -7.877
  467   2HD   PRO  42          3HD       PRO  42   1.196   4.022  -7.434
  468    QB   PRO  42           QB       PRO  42   2.776   0.811  -6.947
  469    QG   PRO  42           QG       PRO  42   0.935   1.884  -6.123
  470    QD   PRO  42           QD       PRO  42   0.483   3.544  -7.656
  471    NH1  ARG  43           NH2      ARG  43   5.262  -4.609 -16.384
  472    NH2  ARG  43           NH1      ARG  43   6.078  -6.524 -15.376
  473    H    ARG  43           HN       ARG  43   3.966  -0.051 -10.185
  474    HA   ARG  43           HA       ARG  43   2.058  -1.308 -11.890
  475   1HB   ARG  43          2HB       ARG  43   4.421  -1.382 -12.388
  476   2HB   ARG  43          3HB       ARG  43   4.763  -2.316 -10.923
  477   1HG   ARG  43          2HG       ARG  43   4.084  -4.283 -11.803
  478   2HG   ARG  43          3HG       ARG  43   2.712  -3.592 -12.659
  479   1HD   ARG  43          2HD       ARG  43   3.792  -3.241 -14.575
  480   2HD   ARG  43          3HD       ARG  43   5.354  -2.849 -13.822
  481    HE   ARG  43           HE       ARG  43   5.154  -5.492 -13.277
  482   1HH1  ARG  43          2HH2      ARG  43   4.798  -3.717 -16.313
  483   2HH1  ARG  43          1HH2      ARG  43   5.552  -4.931 -17.296
  484   1HH2  ARG  43          2HH1      ARG  43   6.253  -7.082 -14.551
  485   2HH2  ARG  43          1HH1      ARG  43   6.411  -6.874 -16.263
  486    QB   ARG  43           QB       ARG  43   4.592  -1.849 -11.655
  487    QG   ARG  43           QG       ARG  43   3.398  -3.938 -12.232
  488    QD   ARG  43           QD       ARG  43   4.572  -3.045 -14.198
  489    QH1  ARG  43           QH2      ARG  43   5.175  -4.324 -16.805
  490    QH2  ARG  43           QH1      ARG  43   6.331  -6.978 -15.407
  491    H    PHE  44           HN       PHE  44   3.180  -1.981  -8.627
  492    HA   PHE  44           HA       PHE  44   1.578  -4.391  -8.335
  493   1HB   PHE  44          2HB       PHE  44   2.491  -4.293  -6.009
  494   2HB   PHE  44          3HB       PHE  44   3.722  -4.297  -7.246
  495    HD1  PHE  44          1HD       PHE  44   1.946  -2.166  -4.775
  496    HD2  PHE  44          2HD       PHE  44   5.334  -2.488  -7.408
  497    HE1  PHE  44          1HE       PHE  44   2.910  -0.141  -3.765
  498    HE2  PHE  44          2HE       PHE  44   6.255  -0.385  -6.470
  499    HZ   PHE  44           HZ       PHE  44   5.029   0.820  -4.663
  500    QB   PHE  44           QB       PHE  44   3.106  -4.295  -6.628
  501    QR   PHE  44           QR       PHE  44   4.111  -1.295  -5.605
  502    H    LEU  45           HN       LEU  45   0.187  -1.660  -8.920
  503    HA   LEU  45           HA       LEU  45  -1.430  -1.084  -6.714
  504   1HB   LEU  45          2HB       LEU  45  -1.839  -0.986  -9.693
  505   2HB   LEU  45          3HB       LEU  45  -3.283  -0.886  -8.687
  506    HG   LEU  45           HG       LEU  45  -0.905   0.972  -8.502
  507   1HD1  LEU  45          2HD1      LEU  45  -2.412   1.124 -10.572
  508   2HD1  LEU  45          3HD1      LEU  45  -3.700   1.638  -9.475
  509   3HD1  LEU  45          1HD1      LEU  45  -2.224   2.603  -9.609
  510   1HD2  LEU  45          3HD2      LEU  45  -3.479   0.821  -6.909
  511   2HD2  LEU  45          1HD2      LEU  45  -1.835   1.035  -6.316
  512   3HD2  LEU  45          2HD2      LEU  45  -2.636   2.364  -7.152
  513    QB   LEU  45           QB       LEU  45  -2.561  -0.936  -9.189
  514    QD1  LEU  45           QD1      LEU  45  -2.778   1.788  -9.885
  515    QD2  LEU  45           QD2      LEU  45  -2.650   1.406  -6.793
  516    QQD  LEU  45           QQD      LEU  45  -2.714   1.598  -8.339
  517    HA   PRO  46           HA       PRO  46  -4.587  -4.459  -7.661
  518   1HB   PRO  46          2HB       PRO  46  -3.917  -6.695  -9.120
  519   2HB   PRO  46          3HB       PRO  46  -4.653  -5.221  -9.804
  520   1HG   PRO  46          2HG       PRO  46  -1.758  -6.050  -9.850
  521   2HG   PRO  46          3HG       PRO  46  -2.715  -5.280 -11.143
  522   1HD   PRO  46          2HD       PRO  46  -0.983  -3.952  -9.474
  523   2HD   PRO  46          3HD       PRO  46  -2.384  -3.151 -10.217
  524    QB   PRO  46           QB       PRO  46  -4.285  -5.958  -9.463
  525    QG   PRO  46           QG       PRO  46  -2.237  -5.665 -10.497
  526    QD   PRO  46           QD       PRO  46  -1.684  -3.552  -9.846
  527    H    GLU  47           HN       GLU  47  -1.218  -5.689  -7.632
  528    HA   GLU  47           HA       GLU  47  -1.480  -7.803  -5.822
  529   1HB   GLU  47          2HB       GLU  47   0.792  -5.807  -6.158
  530   2HB   GLU  47          3HB       GLU  47   0.952  -7.391  -5.408
  531   1HG   GLU  47          2HG       GLU  47   0.697  -8.544  -7.447
  532   2HG   GLU  47          3HG       GLU  47  -0.035  -7.179  -8.288
  533    QB   GLU  47           QB       GLU  47   0.871  -6.599  -5.783
  534    QG   GLU  47           QG       GLU  47   0.331  -7.861  -7.868
  535    H    LEU  48           HN       LEU  48  -0.813  -4.328  -5.167
  536    HA   LEU  48           HA       LEU  48  -0.715  -4.543  -2.349
  537   1HB   LEU  48          2HB       LEU  48   0.212  -2.685  -3.626
  538   2HB   LEU  48          3HB       LEU  48  -1.402  -2.179  -4.138
  539    HG   LEU  48           HG       LEU  48  -1.949  -1.746  -1.717
  540   1HD1  LEU  48          2HD1      LEU  48   0.995  -2.347  -1.336
  541   2HD1  LEU  48          3HD1      LEU  48  -0.039  -1.539  -0.132
  542   3HD1  LEU  48          1HD1      LEU  48  -0.385  -3.213  -0.597
  543   1HD2  LEU  48          3HD2      LEU  48  -1.116   0.071  -3.248
  544   2HD2  LEU  48          1HD2      LEU  48  -0.617   0.326  -1.566
  545   3HD2  LEU  48          2HD2      LEU  48   0.542  -0.314  -2.748
  546    QB   LEU  48           QB       LEU  48  -0.595  -2.432  -3.882
  547    QD1  LEU  48           QD1      LEU  48   0.191  -2.366  -0.689
  548    QD2  LEU  48           QD2      LEU  48  -0.397   0.027  -2.520
  549    QQD  LEU  48           QQD      LEU  48  -0.103  -1.169  -1.605
  550    H    ALA  49           HN       ALA  49  -3.370  -3.536  -4.553
  551    HA   ALA  49           HA       ALA  49  -5.377  -3.069  -2.649
  552   1HB   ALA  49          3HB       ALA  49  -5.477  -4.063  -5.515
  553   2HB   ALA  49          1HB       ALA  49  -6.930  -3.678  -4.587
  554   3HB   ALA  49          2HB       ALA  49  -5.721  -2.416  -4.889
  555    QB   ALA  49           QB       ALA  49  -6.043  -3.386  -4.997
  556    H    SER  50           HN       SER  50  -4.610  -6.189  -4.298
  557    HA   SER  50           HA       SER  50  -6.470  -7.773  -2.843
  558   1HB   SER  50          2HB       SER  50  -3.825  -8.440  -4.204
  559   2HB   SER  50          3HB       SER  50  -4.923  -9.655  -3.515
  560    HG   SER  50           HG       SER  50  -5.293  -9.202  -5.780
  561    QB   SER  50           QB       SER  50  -4.374  -9.047  -3.859
  562    H    ALA  51           HN       ALA  51  -2.954  -7.254  -2.266
  563    HA   ALA  51           HA       ALA  51  -2.625  -8.770   0.041
  564   1HB   ALA  51          1HB       ALA  51  -1.292  -6.222  -0.943
  565   2HB   ALA  51          2HB       ALA  51  -0.720  -7.078   0.475
  566   3HB   ALA  51          3HB       ALA  51  -0.717  -7.897  -1.101
  567    QB   ALA  51           QB       ALA  51  -0.910  -7.065  -0.523
  568    H    LEU  52           HN       LEU  52  -3.869  -5.472  -0.256
  569    HA   LEU  52           HA       LEU  52  -4.174  -5.139   2.620
  570   1HB   LEU  52          2HB       LEU  52  -4.641  -3.392   0.200
  571   2HB   LEU  52          3HB       LEU  52  -5.181  -2.917   1.806
  572    HG   LEU  52           HG       LEU  52  -2.320  -3.387   0.971
  573   1HD1  LEU  52          1HD1      LEU  52  -3.341  -1.262   0.214
  574   2HD1  LEU  52          2HD1      LEU  52  -3.842  -0.900   1.878
  575   3HD1  LEU  52          3HD1      LEU  52  -2.116  -0.970   1.464
  576   1HD2  LEU  52          1HD2      LEU  52  -3.614  -2.906   3.685
  577   2HD2  LEU  52          2HD2      LEU  52  -2.372  -4.082   3.270
  578   3HD2  LEU  52          3HD2      LEU  52  -1.955  -2.365   3.376
  579    QB   LEU  52           QB       LEU  52  -4.911  -3.154   1.003
  580    QD1  LEU  52           QD1      LEU  52  -3.100  -1.044   1.185
  581    QD2  LEU  52           QD2      LEU  52  -2.646  -3.117   3.443
  582    QQD  LEU  52           QQD      LEU  52  -2.873  -2.081   2.314
  583    H    GLY  53           HN       GLY  53  -6.189  -6.131  -0.038
  584   1HA   GLY  53          1HA       GLY  53  -8.391  -6.552  -0.265
  585   2HA   GLY  53          2HA       GLY  53  -8.559  -6.623   1.497
  586    QA   GLY  53           QA       GLY  53  -8.475  -6.588   0.616
  587    H    VAL  54           HN       VAL  54  -7.973  -4.237  -1.134
  588    HA   VAL  54           HA       VAL  54 -10.273  -2.623  -0.351
  589    HB   VAL  54           HB       VAL  54  -8.917  -0.483  -0.494
  590   1HG1  VAL  54          1HG1      VAL  54  -9.806  -1.360   1.654
  591   2HG1  VAL  54          2HG1      VAL  54  -8.228  -2.140   1.936
  592   3HG1  VAL  54          3HG1      VAL  54  -8.341  -0.375   1.809
  593   1HG2  VAL  54          1HG2      VAL  54  -6.826  -1.487  -1.438
  594   2HG2  VAL  54          2HG2      VAL  54  -6.533  -0.528   0.020
  595   3HG2  VAL  54          3HG2      VAL  54  -6.565  -2.288   0.121
  596    QG1  VAL  54           QG1      VAL  54  -8.792  -1.292   1.799
  597    QG2  VAL  54           QG2      VAL  54  -6.641  -1.435  -0.433
  598    QQG  VAL  54           QQG      VAL  54  -7.716  -1.363   0.684
  599    H    SER  55           HN       SER  55 -10.411  -0.716  -2.110
  600    HA   SER  55           HA       SER  55  -9.979  -2.050  -4.693
  601   1HB   SER  55          2HB       SER  55 -11.593  -0.434  -5.486
  602   2HB   SER  55          3HB       SER  55 -12.216  -1.299  -4.096
  603    HG   SER  55           HG       SER  55 -12.082   1.265  -4.327
  604    QB   SER  55           QB       SER  55 -11.904  -0.867  -4.791
  605    H    VAL  56           HN       VAL  56  -8.934  -1.051  -6.421
  606    HA   VAL  56           HA       VAL  56  -6.551   0.391  -5.757
  607    HB   VAL  56           HB       VAL  56  -7.902  -0.406  -8.376
  608   1HG1  VAL  56          2HG1      VAL  56  -5.394   1.202  -7.907
  609   2HG1  VAL  56          3HG1      VAL  56  -5.589   0.180  -9.358
  610   3HG1  VAL  56          1HG1      VAL  56  -6.725   1.502  -9.044
  611   1HG2  VAL  56          3HG2      VAL  56  -6.919  -2.234  -7.012
  612   2HG2  VAL  56          1HG2      VAL  56  -6.012  -1.992  -8.508
  613   3HG2  VAL  56          2HG2      VAL  56  -5.365  -1.367  -6.982
  614    QG1  VAL  56           QG1      VAL  56  -5.902   0.961  -8.770
  615    QG2  VAL  56           QG2      VAL  56  -6.099  -1.864  -7.501
  616    QQG  VAL  56           QQG      VAL  56  -6.001  -0.452  -8.136
  617    H    ASP  57           HN       ASP  57  -9.599   1.363  -7.313
  618    HA   ASP  57           HA       ASP  57  -9.162   4.101  -7.801
  619   1HB   ASP  57          2HB       ASP  57 -11.688   4.168  -7.167
  620   2HB   ASP  57          3HB       ASP  57 -11.193   3.139  -8.526
  621    QB   ASP  57           QB       ASP  57 -11.441   3.653  -7.847
  622    CH2  TRP  58           CH2      TRP  58  -7.252   2.572   2.254
  623    H    TRP  58           HN       TRP  58 -10.033   2.421  -4.726
  624    HA   TRP  58           HA       TRP  58 -10.186   4.896  -3.288
  625   1HB   TRP  58          2HB       TRP  58 -11.408   3.043  -2.440
  626   2HB   TRP  58          3HB       TRP  58  -9.967   2.038  -2.346
  627    HD1  TRP  58           HD1      TRP  58 -11.834   4.713  -0.354
  628    HE1  TRP  58           HE1      TRP  58 -10.763   5.014   1.912
  629    HE3  TRP  58           HE3      TRP  58  -7.727   1.768  -1.030
  630    HZ2  TRP  58           HZ2      TRP  58  -8.560   3.826   3.423
  631    HZ3  TRP  58           HZ3      TRP  58  -6.018   1.613   0.787
  632    HH2  TRP  58           HH2      TRP  58  -6.448   2.575   2.975
  633    QB   TRP  58           QB       TRP  58 -10.687   2.541  -2.393
  634    H    LEU  59           HN       LEU  59  -7.629   2.470  -3.685
  635    HA   LEU  59           HA       LEU  59  -5.622   3.845  -2.201
  636   1HB   LEU  59          2HB       LEU  59  -5.642   1.714  -4.305
  637   2HB   LEU  59          3HB       LEU  59  -4.118   2.512  -4.016
  638    HG   LEU  59           HG       LEU  59  -5.760   1.116  -1.867
  639   1HD1  LEU  59          3HD1      LEU  59  -3.716   0.184  -3.824
  640   2HD1  LEU  59          1HD1      LEU  59  -3.460  -0.300  -2.146
  641   3HD1  LEU  59          2HD1      LEU  59  -4.975  -0.711  -2.953
  642   1HD2  LEU  59          1HD2      LEU  59  -2.957   2.326  -1.799
  643   2HD2  LEU  59          2HD2      LEU  59  -4.349   2.854  -0.830
  644   3HD2  LEU  59          3HD2      LEU  59  -3.646   1.276  -0.540
  645    QB   LEU  59           QB       LEU  59  -4.880   2.113  -4.160
  646    QD1  LEU  59           QD1      LEU  59  -4.051  -0.275  -2.975
  647    QD2  LEU  59           QD2      LEU  59  -3.651   2.152  -1.056
  648    QQD  LEU  59           QQD      LEU  59  -3.851   0.938  -2.015
  649    H    LEU  60           HN       LEU  60  -6.869   4.585  -5.394
  650    HA   LEU  60           HA       LEU  60  -4.699   6.558  -5.826
  651   1HB   LEU  60          2HB       LEU  60  -7.271   5.927  -7.272
  652   2HB   LEU  60          3HB       LEU  60  -6.180   7.233  -7.766
  653    HG   LEU  60           HG       LEU  60  -5.197   4.367  -7.451
  654   1HD1  LEU  60          2HD1      LEU  60  -7.051   5.363  -9.463
  655   2HD1  LEU  60          3HD1      LEU  60  -5.511   4.920 -10.213
  656   3HD1  LEU  60          1HD1      LEU  60  -6.386   3.742  -9.226
  657   1HD2  LEU  60          2HD2      LEU  60  -3.447   6.134  -7.584
  658   2HD2  LEU  60          3HD2      LEU  60  -3.444   5.091  -9.006
  659   3HD2  LEU  60          1HD2      LEU  60  -4.166   6.712  -9.101
  660    QB   LEU  60           QB       LEU  60  -6.726   6.580  -7.519
  661    QD1  LEU  60           QD1      LEU  60  -6.316   4.675  -9.634
  662    QD2  LEU  60           QD2      LEU  60  -3.686   5.978  -8.564
  663    QQD  LEU  60           QQD      LEU  60  -5.001   5.327  -9.099
  664    H    ASN  61           HN       ASN  61  -8.238   6.771  -5.201
  665    HA   ASN  61           HA       ASN  61  -7.930   9.270  -3.690
  666   1HB   ASN  61          2HB       ASN  61  -9.325  10.584  -5.133
  667   2HB   ASN  61          3HB       ASN  61  -7.862  10.101  -5.986
  668   1HD2  ASN  61          2HD2      ASN  61  -9.767   7.821  -8.185
  669   2HD2  ASN  61          1HD2      ASN  61  -8.272   7.823  -7.268
  670    QB   ASN  61           QB       ASN  61  -8.593  10.343  -5.559
  671    QD2  ASN  61           QD2      ASN  61  -9.019   7.822  -7.726
  672    H    GLY  62           HN       GLY  62  -8.787   7.279  -2.292
  673   1HA   GLY  62          1HA       GLY  62 -11.702   7.792  -2.062
  674   2HA   GLY  62          2HA       GLY  62 -11.056   6.170  -1.892
  675    QA   GLY  62           QA       GLY  62 -11.380   6.981  -1.977
  676    H    THR  63           HN       THR  63 -11.512   9.217  -0.493
  677    HA   THR  63           HA       THR  63 -10.948   7.982   2.127
  678    HB   THR  63           HB       THR  63  -9.772   9.772   3.031
  679    HG1  THR  63          1HG       THR  63 -10.837  11.371   1.491
  680   1HG2  THR  63          1HG2      THR  63  -8.322   8.203   1.821
  681   2HG2  THR  63          2HG2      THR  63  -8.460   9.208   0.342
  682   3HG2  THR  63          3HG2      THR  63  -7.649   9.847   1.772
  683    QG2  THR  63           QG2      THR  63  -8.144   9.086   1.312
  684    H    SER  64           HN       SER  64 -12.961   8.025   3.093
  685    HA   SER  64           HA       SER  64 -14.435  10.529   3.235
  686   1HB   SER  64          2HB       SER  64 -15.312   9.525   1.121
  687   2HB   SER  64          3HB       SER  64 -15.729   8.042   2.006
  688    HG   SER  64           HG       SER  64 -17.269   9.170   3.146
  689    QB   SER  64           QB       SER  64 -15.520   8.784   1.563
  690    H    ASP  65           HN       ASP  65 -16.196  10.319   4.774
  691    HA   ASP  65           HA       ASP  65 -15.535   8.543   7.024
  692   1HB   ASP  65          2HB       ASP  65 -17.664  10.712   6.752
  693   2HB   ASP  65          3HB       ASP  65 -17.169   9.909   8.246
  694    QB   ASP  65           QB       ASP  65 -17.416  10.311   7.499
  695    H    SER  66           HN       SER  66 -17.254   7.368   8.060
  696    HA   SER  66           HA       SER  66 -18.924   5.918   8.286
  697   1HB   SER  66          2HB       SER  66 -20.289   7.190   5.892
  698   2HB   SER  66          3HB       SER  66 -21.030   6.202   7.165
  699    HG   SER  66           HG       SER  66 -20.392   7.819   8.671
  700    QB   SER  66           QB       SER  66 -20.659   6.697   6.528
  701    H    ASN  67           HN       ASN  67 -19.002   3.774   7.878
  702    HA   ASN  67           HA       ASN  67 -18.043   2.786   5.205
  703   1HB   ASN  67          2HB       ASN  67 -17.132   1.811   7.927
  704   2HB   ASN  67          3HB       ASN  67 -16.661   1.152   6.352
  705   1HD2  ASN  67          2HD2      ASN  67 -14.464   3.929   5.594
  706   2HD2  ASN  67          1HD2      ASN  67 -15.470   2.719   4.821
  707    QB   ASN  67           QB       ASN  67 -16.896   1.482   7.139
  708    QD2  ASN  67           QD2      ASN  67 -14.967   3.324   5.207
  709    H    VAL  68           HN       VAL  68 -20.273   2.583   4.826
  710    HA   VAL  68           HA       VAL  68 -22.301   1.658   4.751
  711    HB   VAL  68           HB       VAL  68 -22.329  -0.736   4.291
  712   1HG1  VAL  68          1HG1      VAL  68 -21.725   0.889   2.550
  713   2HG1  VAL  68          2HG1      VAL  68 -20.009   0.737   2.979
  714   3HG1  VAL  68          3HG1      VAL  68 -20.886  -0.653   2.316
  715   1HG2  VAL  68          2HG2      VAL  68 -20.573  -1.506   5.932
  716   2HG2  VAL  68          3HG2      VAL  68 -20.353  -2.113   4.283
  717   3HG2  VAL  68          1HG2      VAL  68 -19.334  -0.791   4.869
  718    QG1  VAL  68           QG1      VAL  68 -20.873   0.324   2.615
  719    QG2  VAL  68           QG2      VAL  68 -20.087  -1.470   5.028
  720    QQG  VAL  68           QQG      VAL  68 -20.480  -0.572   3.822
  721    NH1  ARG  69           NH2      ARG  69 -18.071  -2.464  10.897
  722    NH2  ARG  69           NH1      ARG  69 -17.312  -1.777   8.815
  723    H    ARG  69           HN       ARG  69 -21.862   2.625   7.205
  724    HA   ARG  69           HA       ARG  69 -23.604   1.315   9.055
  725   1HB   ARG  69          2HB       ARG  69 -20.570   1.431   9.405
  726   2HB   ARG  69          3HB       ARG  69 -21.642   1.592  10.794
  727   1HG   ARG  69          2HG       ARG  69 -22.568  -0.567  10.557
  728   2HG   ARG  69          3HG       ARG  69 -21.834  -0.834   8.974
  729   1HD   ARG  69          2HD       ARG  69 -20.188  -0.383  11.479
  730   2HD   ARG  69          3HD       ARG  69 -20.707  -1.978  10.879
  731    HE   ARG  69           HE       ARG  69 -19.424  -0.397   8.797
  732   1HH1  ARG  69          2HH2      ARG  69 -18.760  -2.393  11.631
  733   2HH1  ARG  69          1HH2      ARG  69 -17.281  -3.076  11.036
  734   1HH2  ARG  69          2HH1      ARG  69 -17.455  -1.232   7.975
  735   2HH2  ARG  69          1HH1      ARG  69 -16.488  -2.355   8.892
  736    QB   ARG  69           QB       ARG  69 -21.106   1.512  10.100
  737    QG   ARG  69           QG       ARG  69 -22.200  -0.700   9.765
  738    QD   ARG  69           QD       ARG  69 -20.447  -1.180  11.180
  739    QH1  ARG  69           QH2      ARG  69 -18.021  -2.734  11.334
  740    QH2  ARG  69           QH1      ARG  69 -16.971  -1.793   8.433
   
  Start of MODEL          10
 Raw file had 740 H/Q atoms
  Start of MODEL   10
    1    H    SER   1           HN       SER   1  -1.147  11.247   0.228
    2    HA   SER   1           HA       SER   1  -1.828  10.806   2.421
    3   1HB   SER   1          2HB       SER   1  -4.632  10.608   1.349
    4   2HB   SER   1          3HB       SER   1  -4.083  10.697   3.045
    5    HG   SER   1           HG       SER   1  -4.199  12.859   2.664
    6    QB   SER   1           QB       SER   1  -4.356  10.653   2.197
    7    H    ILE   2           HN       ILE   2  -1.604   8.965  -0.201
    8    HA   ILE   2           HA       ILE   2  -2.660   6.482   0.502
    9    HB   ILE   2           HB       ILE   2   0.122   6.805  -0.668
   10   1HG1  ILE   2          2HG1      ILE   2  -1.596   6.192  -2.764
   11   2HG1  ILE   2          3HG1      ILE   2  -2.568   7.341  -1.860
   12   1HG2  ILE   2          3HG2      ILE   2  -1.933   4.594  -0.427
   13   2HG2  ILE   2          1HG2      ILE   2  -0.674   4.517  -1.643
   14   3HG2  ILE   2          2HG2      ILE   2  -0.236   4.584   0.056
   15   1HD1  ILE   2          1HD1      ILE   2  -0.621   8.957  -1.967
   16   2HD1  ILE   2          2HD1      ILE   2   0.296   7.735  -2.863
   17   3HD1  ILE   2          3HD1      ILE   2  -1.160   8.443  -3.576
   18    QG1  ILE   2           QG1      ILE   2  -2.082   6.766  -2.312
   19    QG2  ILE   2           QG2      ILE   2  -0.948   4.565  -0.672
   20    QD1  ILE   2           QD1      ILE   2  -0.495   8.379  -2.802
   21    H    SER   3           HN       SER   3   0.065   8.224   1.968
   22    HA   SER   3           HA       SER   3   1.147   6.263   3.606
   23   1HB   SER   3          2HB       SER   3   1.868   8.688   3.520
   24   2HB   SER   3          3HB       SER   3   0.475   9.101   4.505
   25    HG   SER   3           HG       SER   3   2.658   7.414   5.172
   26    QB   SER   3           QB       SER   3   1.172   8.894   4.012
   27    H    SER   4           HN       SER   4  -1.744   8.280   4.400
   28    HA   SER   4           HA       SER   4  -2.107   6.911   6.936
   29   1HB   SER   4          2HB       SER   4  -3.816   8.915   5.435
   30   2HB   SER   4          3HB       SER   4  -4.295   8.173   6.968
   31    HG   SER   4           HG       SER   4  -1.822   9.527   6.580
   32    QB   SER   4           QB       SER   4  -4.055   8.544   6.202
   33    NH1  ARG   5           NH2      ARG   5  -5.470   8.709  -1.287
   34    NH2  ARG   5           NH1      ARG   5  -6.653   7.176  -2.528
   35    H    ARG   5           HN       ARG   5  -3.613   6.672   3.697
   36    HA   ARG   5           HA       ARG   5  -5.680   4.848   4.437
   37   1HB   ARG   5          2HB       ARG   5  -4.157   5.321   1.889
   38   2HB   ARG   5          3HB       ARG   5  -5.357   4.174   1.876
   39   1HG   ARG   5          2HG       ARG   5  -7.102   5.759   1.977
   40   2HG   ARG   5          3HG       ARG   5  -6.205   6.757   3.099
   41   1HD   ARG   5          2HD       ARG   5  -6.363   8.093   1.278
   42   2HD   ARG   5          3HD       ARG   5  -4.736   7.410   1.099
   43    HE   ARG   5           HE       ARG   5  -6.568   5.805  -0.386
   44   1HH1  ARG   5          2HH2      ARG   5  -5.110   8.987  -0.392
   45   2HH1  ARG   5          1HH2      ARG   5  -5.467   9.355  -2.065
   46   1HH2  ARG   5          2HH1      ARG   5  -7.229   6.338  -2.603
   47   2HH2  ARG   5          1HH1      ARG   5  -6.559   7.747  -3.359
   48    QB   ARG   5           QB       ARG   5  -4.757   4.747   1.883
   49    QG   ARG   5           QG       ARG   5  -6.653   6.258   2.538
   50    QD   ARG   5           QD       ARG   5  -5.550   7.752   1.189
   51    QH1  ARG   5           QH2      ARG   5  -5.289   9.171  -1.229
   52    QH2  ARG   5           QH1      ARG   5  -6.894   7.043  -2.982
   53    H    VAL   6           HN       VAL   6  -2.388   4.170   3.095
   54    HA   VAL   6           HA       VAL   6  -2.576   1.366   3.415
   55    HB   VAL   6           HB       VAL   6  -0.225   3.264   3.143
   56   1HG1  VAL   6          1HG1      VAL   6  -0.139   0.356   3.886
   57   2HG1  VAL   6          2HG1      VAL   6   0.924   0.888   2.582
   58   3HG1  VAL   6          3HG1      VAL   6   1.016   1.659   4.172
   59   1HG2  VAL   6          3HG2      VAL   6  -1.517   1.174   1.335
   60   2HG2  VAL   6          1HG2      VAL   6  -1.694   2.923   1.197
   61   3HG2  VAL   6          2HG2      VAL   6  -0.121   2.172   0.904
   62    QG1  VAL   6           QG1      VAL   6   0.600   0.968   3.547
   63    QG2  VAL   6           QG2      VAL   6  -1.110   2.090   1.145
   64    QQG  VAL   6           QQG      VAL   6  -0.255   1.529   2.346
   65    H    LYS   7           HN       LYS   7  -0.922   3.772   5.537
   66    HA   LYS   7           HA       LYS   7  -0.093   2.084   7.550
   67   1HB   LYS   7          2HB       LYS   7   0.399   4.494   7.440
   68   2HB   LYS   7          3HB       LYS   7  -1.301   4.870   7.770
   69   1HG   LYS   7          2HG       LYS   7  -0.958   3.677  10.039
   70   2HG   LYS   7          3HG       LYS   7   0.763   3.695   9.651
   71   1HD   LYS   7          2HD       LYS   7   0.785   5.763  10.605
   72   2HD   LYS   7          3HD       LYS   7   0.020   6.315   9.106
   73   1HE   LYS   7          2HE       LYS   7  -2.247   5.652  10.265
   74   2HE   LYS   7          3HE       LYS   7  -1.296   5.554  11.760
   75   1HZ   LYS   7          2HZ       LYS   7  -0.702   7.876  11.429
   76   2HZ   LYS   7          3HZ       LYS   7  -1.601   7.939  10.049
   77   3HZ   LYS   7          1HZ       LYS   7  -2.331   7.684  11.496
   78    QB   LYS   7           QB       LYS   7  -0.451   4.681   7.605
   79    QG   LYS   7           QG       LYS   7  -0.097   3.686   9.846
   80    QD   LYS   7           QD       LYS   7   0.403   6.039   9.856
   81    QE   LYS   7           QE       LYS   7  -1.771   5.604  11.013
   82    QZ   LYS   7           QZ       LYS   7  -1.545   7.833  10.991
   83    H    SER   8           HN       SER   8  -3.268   3.806   7.493
   84    HA   SER   8           HA       SER   8  -4.345   2.791   9.867
   85   1HB   SER   8          2HB       SER   8  -5.334   4.625   8.516
   86   2HB   SER   8          3HB       SER   8  -5.806   3.456   7.267
   87    HG   SER   8           HG       SER   8  -7.559   3.352   8.475
   88    QB   SER   8           QB       SER   8  -5.570   4.041   7.892
   89    H    LYS   9           HN       LYS   9  -4.719   1.480   6.518
   90    HA   LYS   9           HA       LYS   9  -6.236  -0.752   7.401
   91   1HB   LYS   9          2HB       LYS   9  -6.117   0.237   5.077
   92   2HB   LYS   9          3HB       LYS   9  -4.557  -0.545   4.872
   93   1HG   LYS   9          2HG       LYS   9  -6.410  -1.761   3.852
   94   2HG   LYS   9          3HG       LYS   9  -5.618  -2.763   5.078
   95   1HD   LYS   9          2HD       LYS   9  -7.493  -2.501   6.606
   96   2HD   LYS   9          3HD       LYS   9  -8.064  -1.079   5.730
   97   1HE   LYS   9          2HE       LYS   9  -9.572  -2.917   5.304
   98   2HE   LYS   9          3HE       LYS   9  -8.754  -2.412   3.828
   99   1HZ   LYS   9          3HZ       LYS   9  -7.245  -4.367   4.235
  100   2HZ   LYS   9          1HZ       LYS   9  -8.368  -4.868   5.330
  101   3HZ   LYS   9          2HZ       LYS   9  -8.768  -4.620   3.729
  102    QB   LYS   9           QB       LYS   9  -5.337  -0.154   4.975
  103    QG   LYS   9           QG       LYS   9  -6.014  -2.262   4.466
  104    QD   LYS   9           QD       LYS   9  -7.778  -1.789   6.168
  105    QE   LYS   9           QE       LYS   9  -9.163  -2.665   4.566
  106    QZ   LYS   9           QZ       LYS   9  -8.127  -4.618   4.432
  107    NH1  ARG  10           NH2      ARG  10   1.765   0.885   9.613
  108    NH2  ARG  10           NH1      ARG  10   2.794   2.119   7.940
  109    H    ARG  10           HN       ARG  10  -2.745  -0.239   7.020
  110    HA   ARG  10           HA       ARG  10  -1.810  -2.864   7.376
  111   1HB   ARG  10          2HB       ARG  10  -0.589  -0.447   6.977
  112   2HB   ARG  10          3HB       ARG  10  -0.337  -0.624   8.717
  113   1HG   ARG  10          2HG       ARG  10   0.495  -3.046   7.960
  114   2HG   ARG  10          3HG       ARG  10   0.694  -2.242   6.403
  115   1HD   ARG  10          2HD       ARG  10   2.050  -1.642   9.062
  116   2HD   ARG  10          3HD       ARG  10   2.750  -2.107   7.524
  117    HE   ARG  10           HE       ARG  10   2.650  -0.005   6.647
  118   1HH1  ARG  10          2HH2      ARG  10   1.344   0.020   9.920
  119   2HH1  ARG  10          1HH2      ARG  10   1.836   1.643  10.273
  120   1HH2  ARG  10          2HH1      ARG  10   3.331   2.156   7.078
  121   2HH2  ARG  10          1HH1      ARG  10   2.816   2.942   8.520
  122    QB   ARG  10           QB       ARG  10  -0.463  -0.536   7.847
  123    QG   ARG  10           QG       ARG  10   0.595  -2.644   7.182
  124    QD   ARG  10           QD       ARG  10   2.400  -1.875   8.293
  125    QH1  ARG  10           QH2      ARG  10   1.589   0.831  10.096
  126    QH2  ARG  10           QH1      ARG  10   3.073   2.549   7.798
  127    H    ILE  11           HN       ILE  11  -2.538  -0.320   9.826
  128    HA   ILE  11           HA       ILE  11  -1.968  -1.916  12.146
  129    HB   ILE  11           HB       ILE  11  -3.827   0.463  11.781
  130   1HG1  ILE  11          2HG1      ILE  11  -2.178   1.330  13.559
  131   2HG1  ILE  11          3HG1      ILE  11  -1.116  -0.011  13.114
  132   1HG2  ILE  11          1HG2      ILE  11  -3.321  -1.193  14.273
  133   2HG2  ILE  11          2HG2      ILE  11  -4.015   0.430  14.299
  134   3HG2  ILE  11          3HG2      ILE  11  -4.885  -0.863  13.514
  135   1HD1  ILE  11          3HD1      ILE  11  -2.201   2.077  11.184
  136   2HD1  ILE  11          1HD1      ILE  11  -0.658   2.242  12.037
  137   3HD1  ILE  11          2HD1      ILE  11  -0.868   0.914  10.892
  138    QG1  ILE  11           QG1      ILE  11  -1.647   0.660  13.336
  139    QG2  ILE  11           QG2      ILE  11  -4.074  -0.542  14.028
  140    QD1  ILE  11           QD1      ILE  11  -1.242   1.744  11.371
  141    H    GLN  12           HN       GLN  12  -5.066  -1.261  10.453
  142    HA   GLN  12           HA       GLN  12  -6.598  -2.954  12.067
  143   1HB   GLN  12          2HB       GLN  12  -7.229  -1.265  10.093
  144   2HB   GLN  12          3HB       GLN  12  -7.336  -2.763   9.160
  145   1HG   GLN  12          2HG       GLN  12  -8.922  -3.655  10.900
  146   2HG   GLN  12          3HG       GLN  12  -8.787  -2.123  11.774
  147   1HE2  GLN  12          2HE2      GLN  12 -11.263  -0.556   9.809
  148   2HE2  GLN  12          1HE2      GLN  12 -10.288  -0.535  11.266
  149    QB   GLN  12           QB       GLN  12  -7.283  -2.015   9.626
  150    QG   GLN  12           QG       GLN  12  -8.855  -2.889  11.337
  151    QE2  GLN  12           QE2      GLN  12 -10.776  -0.546  10.537
  152    H    LEU  13           HN       LEU  13  -4.668  -3.816   9.249
  153    HA   LEU  13           HA       LEU  13  -5.339  -6.652   9.183
  154   1HB   LEU  13          2HB       LEU  13  -3.339  -4.779   7.905
  155   2HB   LEU  13          3HB       LEU  13  -2.973  -6.474   7.894
  156    HG   LEU  13           HG       LEU  13  -4.120  -5.575   5.855
  157   1HD1  LEU  13          1HD1      LEU  13  -3.993  -8.034   6.604
  158   2HD1  LEU  13          2HD1      LEU  13  -5.704  -7.832   7.065
  159   3HD1  LEU  13          3HD1      LEU  13  -5.200  -7.573   5.383
  160   1HD2  LEU  13          3HD2      LEU  13  -6.588  -5.609   7.662
  161   2HD2  LEU  13          1HD2      LEU  13  -5.943  -4.243   6.746
  162   3HD2  LEU  13          2HD2      LEU  13  -6.599  -5.659   5.909
  163    QB   LEU  13           QB       LEU  13  -3.156  -5.627   7.899
  164    QD1  LEU  13           QD1      LEU  13  -4.966  -7.813   6.351
  165    QD2  LEU  13           QD2      LEU  13  -6.377  -5.170   6.773
  166    QQD  LEU  13           QQD      LEU  13  -5.671  -6.492   6.562
  167    H    GLY  14           HN       GLY  14  -3.073  -4.678  11.012
  168   1HA   GLY  14          1HA       GLY  14  -1.762  -5.207  12.791
  169   2HA   GLY  14          2HA       GLY  14  -2.380  -6.870  12.764
  170    QA   GLY  14           QA       GLY  14  -2.072  -6.039  12.778
  171    H    LEU  15           HN       LEU  15  -0.875  -5.252   9.980
  172    HA   LEU  15           HA       LEU  15   1.468  -7.141  10.169
  173   1HB   LEU  15          2HB       LEU  15   0.194  -6.035   7.645
  174   2HB   LEU  15          3HB       LEU  15   1.551  -7.166   7.750
  175    HG   LEU  15           HG       LEU  15  -1.330  -7.734   8.551
  176   1HD1  LEU  15          1HD1      LEU  15  -0.869  -7.651   6.104
  177   2HD1  LEU  15          2HD1      LEU  15   0.426  -8.850   6.323
  178   3HD1  LEU  15          3HD1      LEU  15  -1.264  -9.292   6.656
  179   1HD2  LEU  15          3HD2      LEU  15   1.080  -9.589   8.666
  180   2HD2  LEU  15          1HD2      LEU  15   0.147  -8.998  10.055
  181   3HD2  LEU  15          2HD2      LEU  15  -0.613 -10.069   8.882
  182    QB   LEU  15           QB       LEU  15   0.873  -6.600   7.698
  183    QD1  LEU  15           QD1      LEU  15  -0.569  -8.598   6.361
  184    QD2  LEU  15           QD2      LEU  15   0.205  -9.552   9.201
  185    QQD  LEU  15           QQD      LEU  15  -0.182  -9.075   7.781
  186    H    ASN  16           HN       ASN  16   3.262  -6.243   8.678
  187    HA   ASN  16           HA       ASN  16   3.686  -3.327   9.229
  188   1HB   ASN  16          2HB       ASN  16   6.034  -3.742   9.573
  189   2HB   ASN  16          3HB       ASN  16   5.092  -4.712  10.715
  190   1HD2  ASN  16          2HD2      ASN  16   5.714  -7.852   9.145
  191   2HD2  ASN  16          1HD2      ASN  16   4.684  -6.912  10.149
  192    QB   ASN  16           QB       ASN  16   5.563  -4.227  10.145
  193    QD2  ASN  16           QD2      ASN  16   5.198  -7.383   9.647
  194    H    GLN  17           HN       GLN  17   5.495  -2.562   7.828
  195    HA   GLN  17           HA       GLN  17   4.556  -2.690   5.094
  196   1HB   GLN  17          2HB       GLN  17   6.776  -1.193   6.476
  197   2HB   GLN  17          3HB       GLN  17   6.663  -1.197   4.699
  198   1HG   GLN  17          2HG       GLN  17   4.342  -0.254   4.942
  199   2HG   GLN  17          3HG       GLN  17   4.590  -0.337   6.700
  200   1HE2  GLN  17          2HE2      GLN  17   6.972   2.480   4.836
  201   2HE2  GLN  17          1HE2      GLN  17   6.634   1.007   3.970
  202    QB   GLN  17           QB       GLN  17   6.720  -1.195   5.587
  203    QG   GLN  17           QG       GLN  17   4.466  -0.296   5.821
  204    QE2  GLN  17           QE2      GLN  17   6.803   1.743   4.402
  205    H    ALA  18           HN       ALA  18   7.122  -4.422   6.812
  206    HA   ALA  18           HA       ALA  18   8.585  -5.171   4.420
  207   1HB   ALA  18          3HB       ALA  18   9.384  -5.120   6.950
  208   2HB   ALA  18          1HB       ALA  18   8.718  -6.760   6.976
  209   3HB   ALA  18          2HB       ALA  18   9.986  -6.349   5.825
  210    QB   ALA  18           QB       ALA  18   9.362  -6.077   6.584
  211    H    GLU  19           HN       GLU  19   6.314  -6.832   6.676
  212    HA   GLU  19           HA       GLU  19   5.897  -9.190   5.134
  213   1HB   GLU  19          2HB       GLU  19   4.172  -7.641   7.088
  214   2HB   GLU  19          3HB       GLU  19   3.469  -8.950   6.141
  215   1HG   GLU  19          2HG       GLU  19   5.088 -10.556   6.939
  216   2HG   GLU  19          3HG       GLU  19   5.899  -9.334   7.920
  217    QB   GLU  19           QB       GLU  19   3.821  -8.295   6.615
  218    QG   GLU  19           QG       GLU  19   5.494  -9.946   7.430
  219    H    LEU  20           HN       LEU  20   4.142  -6.039   5.044
  220    HA   LEU  20           HA       LEU  20   2.405  -6.785   2.987
  221   1HB   LEU  20          2HB       LEU  20   2.618  -4.564   4.476
  222   2HB   LEU  20          3HB       LEU  20   3.501  -3.984   3.063
  223    HG   LEU  20           HG       LEU  20   1.416  -4.838   1.715
  224   1HD1  LEU  20          3HD1      LEU  20   0.433  -6.175   3.645
  225   2HD1  LEU  20          1HD1      LEU  20   0.215  -4.667   4.529
  226   3HD1  LEU  20          2HD1      LEU  20  -0.681  -4.967   3.028
  227   1HD2  LEU  20          1HD2      LEU  20   2.078  -2.470   2.184
  228   2HD2  LEU  20          2HD2      LEU  20   0.331  -2.691   2.067
  229   3HD2  LEU  20          3HD2      LEU  20   1.098  -2.512   3.663
  230    QB   LEU  20           QB       LEU  20   3.060  -4.274   3.770
  231    QD1  LEU  20           QD1      LEU  20  -0.011  -5.269   3.734
  232    QD2  LEU  20           QD2      LEU  20   1.169  -2.557   2.638
  233    QQD  LEU  20           QQD      LEU  20   0.579  -3.913   3.185
  234    H    ALA  21           HN       ALA  21   5.636  -5.221   2.647
  235    HA   ALA  21           HA       ALA  21   5.762  -5.182  -0.132
  236   1HB   ALA  21          3HB       ALA  21   7.955  -5.660   1.932
  237   2HB   ALA  21          1HB       ALA  21   8.260  -5.426   0.207
  238   3HB   ALA  21          2HB       ALA  21   7.497  -4.143   1.162
  239    QB   ALA  21           QB       ALA  21   7.904  -5.076   1.100
  240    H    GLN  22           HN       GLN  22   6.648  -7.883   2.080
  241    HA   GLN  22           HA       GLN  22   7.429  -9.751   0.070
  242   1HB   GLN  22          2HB       GLN  22   6.313 -10.044   2.874
  243   2HB   GLN  22          3HB       GLN  22   6.667 -11.448   1.888
  244   1HG   GLN  22          2HG       GLN  22   8.870  -9.423   1.996
  245   2HG   GLN  22          3HG       GLN  22   8.442 -10.149   3.546
  246   1HE2  GLN  22          2HE2      GLN  22  10.674 -12.762   2.730
  247   2HE2  GLN  22          1HE2      GLN  22  10.356 -11.392   3.780
  248    QB   GLN  22           QB       GLN  22   6.491 -10.746   2.381
  249    QG   GLN  22           QG       GLN  22   8.656  -9.786   2.771
  250    QE2  GLN  22           QE2      GLN  22  10.515 -12.078   3.256
  251    H    LYS  23           HN       LYS  23   4.197  -9.095   1.487
  252    HA   LYS  23           HA       LYS  23   2.816 -11.158   0.052
  253   1HB   LYS  23          2HB       LYS  23   1.786  -8.520   1.136
  254   2HB   LYS  23          3HB       LYS  23   0.769  -9.858   0.632
  255   1HG   LYS  23          2HG       LYS  23   2.871 -10.327   2.773
  256   2HG   LYS  23          3HG       LYS  23   1.427  -9.423   3.173
  257   1HD   LYS  23          2HD       LYS  23   0.516 -11.787   1.825
  258   2HD   LYS  23          3HD       LYS  23   1.881 -12.293   2.806
  259   1HE   LYS  23          2HE       LYS  23  -0.059 -12.548   4.165
  260   2HE   LYS  23          3HE       LYS  23   0.829 -11.177   4.823
  261   1HZ   LYS  23          3HZ       LYS  23  -1.187 -10.555   2.837
  262   2HZ   LYS  23          1HZ       LYS  23  -1.751 -11.140   4.267
  263   3HZ   LYS  23          2HZ       LYS  23  -0.831  -9.777   4.239
  264    QB   LYS  23           QB       LYS  23   1.278  -9.189   0.883
  265    QG   LYS  23           QG       LYS  23   2.149  -9.875   2.973
  266    QD   LYS  23           QD       LYS  23   1.198 -12.040   2.316
  267    QE   LYS  23           QE       LYS  23   0.386 -11.862   4.494
  268    QZ   LYS  23           QZ       LYS  23  -1.256 -10.490   3.781
  269    H    VAL  24           HN       VAL  24   3.602  -7.780  -0.754
  270    HA   VAL  24           HA       VAL  24   2.277  -7.791  -3.346
  271    HB   VAL  24           HB       VAL  24   4.475  -6.044  -2.163
  272   1HG1  VAL  24          2HG1      VAL  24   2.844  -5.686  -4.707
  273   2HG1  VAL  24          3HG1      VAL  24   3.819  -4.420  -3.949
  274   3HG1  VAL  24          1HG1      VAL  24   4.605  -5.858  -4.615
  275   1HG2  VAL  24          1HG2      VAL  24   2.190  -5.954  -1.048
  276   2HG2  VAL  24          2HG2      VAL  24   2.676  -4.461  -1.858
  277   3HG2  VAL  24          3HG2      VAL  24   1.523  -5.570  -2.639
  278    QG1  VAL  24           QG1      VAL  24   3.756  -5.321  -4.424
  279    QG2  VAL  24           QG2      VAL  24   2.130  -5.328  -1.848
  280    QQG  VAL  24           QQG      VAL  24   2.943  -5.325  -3.136
  281    H    GLY  25           HN       GLY  25   5.477  -8.778  -2.159
  282   1HA   GLY  25          1HA       GLY  25   6.990 -10.193  -3.214
  283   2HA   GLY  25          2HA       GLY  25   6.090 -10.094  -4.736
  284    QA   GLY  25           QA       GLY  25   6.540 -10.144  -3.975
  285    H    THR  26           HN       THR  26   7.197  -7.449  -2.629
  286    HA   THR  26           HA       THR  26   9.390  -6.736  -4.493
  287    HB   THR  26           HB       THR  26   7.449  -5.309  -5.110
  288    HG1  THR  26          1HG       THR  26   8.727  -3.267  -4.634
  289   1HG2  THR  26          3HG2      THR  26   6.906  -5.181  -2.350
  290   2HG2  THR  26          1HG2      THR  26   7.564  -3.602  -2.712
  291   3HG2  THR  26          2HG2      THR  26   6.164  -4.192  -3.613
  292    QG2  THR  26           QG2      THR  26   6.878  -4.325  -2.892
  293    H    THR  27           HN       THR  27   9.992  -4.398  -2.979
  294    HA   THR  27           HA       THR  27  10.918  -5.537  -0.371
  295    HB   THR  27           HB       THR  27  12.757  -3.783  -0.751
  296    HG1  THR  27          1HG       THR  27  12.970  -3.358  -3.099
  297   1HG2  THR  27          1HG2      THR  27  12.445  -6.460  -1.829
  298   2HG2  THR  27          2HG2      THR  27  13.357  -5.497  -2.998
  299   3HG2  THR  27          3HG2      THR  27  13.926  -5.635  -1.322
  300    QG2  THR  27           QG2      THR  27  13.243  -5.864  -2.049
  301    H    GLN  28           HN       GLN  28  10.907  -4.196   1.409
  302    HA   GLN  28           HA       GLN  28   8.820  -2.481   1.945
  303   1HB   GLN  28          2HB       GLN  28  10.335  -3.461   3.619
  304   2HB   GLN  28          3HB       GLN  28  11.633  -2.370   3.101
  305   1HG   GLN  28          2HG       GLN  28  10.254  -0.409   3.780
  306   2HG   GLN  28          3HG       GLN  28   8.947  -1.499   4.262
  307   1HE2  GLN  28          2HE2      GLN  28  10.692  -2.636   7.216
  308   2HE2  GLN  28          1HE2      GLN  28   9.554  -3.181   5.989
  309    QB   GLN  28           QB       GLN  28  10.984  -2.915   3.360
  310    QG   GLN  28           QG       GLN  28   9.600  -0.953   4.022
  311    QE2  GLN  28           QE2      GLN  28  10.123  -2.908   6.602
  312    H    GLN  29           HN       GLN  29  11.972  -1.636   0.517
  313    HA   GLN  29           HA       GLN  29  11.907   1.097   0.555
  314   1HB   GLN  29          2HB       GLN  29  13.558  -0.716  -0.554
  315   2HB   GLN  29          3HB       GLN  29  12.680  -0.295  -2.022
  316   1HG   GLN  29          2HG       GLN  29  14.611   1.106  -1.915
  317   2HG   GLN  29          3HG       GLN  29  13.243   2.153  -1.510
  318   1HE2  GLN  29          2HE2      GLN  29  14.672   2.970   1.645
  319   2HE2  GLN  29          1HE2      GLN  29  13.524   3.387   0.387
  320    QB   GLN  29           QB       GLN  29  13.119  -0.506  -1.288
  321    QG   GLN  29           QG       GLN  29  13.927   1.630  -1.712
  322    QE2  GLN  29           QE2      GLN  29  14.099   3.179   1.017
  323    H    SER  30           HN       SER  30  10.085  -1.020  -1.703
  324    HA   SER  30           HA       SER  30   9.168   1.166  -3.396
  325   1HB   SER  30          2HB       SER  30   7.854  -1.519  -2.955
  326   2HB   SER  30          3HB       SER  30   7.668  -0.452  -4.337
  327    HG   SER  30           HG       SER  30  10.241  -1.377  -3.723
  328    QB   SER  30           QB       SER  30   7.762  -0.986  -3.646
  329    H    ILE  31           HN       ILE  31   7.998  -0.499  -0.495
  330    HA   ILE  31           HA       ILE  31   5.326   0.612  -0.497
  331    HB   ILE  31           HB       ILE  31   6.947  -0.606   1.777
  332   1HG1  ILE  31          2HG1      ILE  31   6.907  -2.263   0.060
  333   2HG1  ILE  31          3HG1      ILE  31   5.671  -2.689   1.248
  334   1HG2  ILE  31          1HG2      ILE  31   3.949  -0.299   1.479
  335   2HG2  ILE  31          2HG2      ILE  31   4.798  -1.153   2.774
  336   3HG2  ILE  31          3HG2      ILE  31   5.003   0.593   2.592
  337   1HD1  ILE  31          1HD1      ILE  31   3.998  -1.530  -0.370
  338   2HD1  ILE  31          2HD1      ILE  31   5.306  -1.603  -1.563
  339   3HD1  ILE  31          3HD1      ILE  31   4.677  -3.093  -0.852
  340    QG1  ILE  31           QG1      ILE  31   6.289  -2.476   0.654
  341    QG2  ILE  31           QG2      ILE  31   4.583  -0.286   2.281
  342    QD1  ILE  31           QD1      ILE  31   4.660  -2.076  -0.928
  343    H    GLU  32           HN       GLU  32   8.346   1.329   1.302
  344    HA   GLU  32           HA       GLU  32   7.641   3.669   2.620
  345   1HB   GLU  32          2HB       GLU  32   9.844   2.395   2.722
  346   2HB   GLU  32          3HB       GLU  32  10.288   3.154   1.193
  347   1HG   GLU  32          2HG       GLU  32  11.297   4.453   2.931
  348   2HG   GLU  32          3HG       GLU  32   9.946   5.416   2.340
  349    QB   GLU  32           QB       GLU  32  10.067   2.774   1.958
  350    QG   GLU  32           QG       GLU  32  10.622   4.935   2.635
  351    H    GLN  33           HN       GLN  33   8.857   3.346  -0.795
  352    HA   GLN  33           HA       GLN  33   8.659   6.072  -1.474
  353   1HB   GLN  33          2HB       GLN  33   9.773   4.820  -2.996
  354   2HB   GLN  33          3HB       GLN  33   8.629   3.495  -3.018
  355   1HG   GLN  33          2HG       GLN  33   7.163   4.534  -4.478
  356   2HG   GLN  33          3HG       GLN  33   7.708   6.158  -4.037
  357   1HE2  GLN  33          2HE2      GLN  33   9.987   4.089  -6.768
  358   2HE2  GLN  33          1HE2      GLN  33   9.026   3.178  -5.613
  359    QB   GLN  33           QB       GLN  33   9.202   4.157  -3.007
  360    QG   GLN  33           QG       GLN  33   7.436   5.345  -4.257
  361    QE2  GLN  33           QE2      GLN  33   9.506   3.633  -6.190
  362    H    LEU  34           HN       LEU  34   6.111   3.529  -1.815
  363    HA   LEU  34           HA       LEU  34   4.217   5.396  -2.815
  364   1HB   LEU  34          2HB       LEU  34   3.913   3.006  -3.112
  365   2HB   LEU  34          3HB       LEU  34   3.758   2.775  -1.365
  366    HG   LEU  34           HG       LEU  34   1.702   4.161  -1.368
  367   1HD1  LEU  34          2HD1      LEU  34   2.289   5.355  -3.684
  368   2HD1  LEU  34          3HD1      LEU  34   1.530   3.920  -4.377
  369   3HD1  LEU  34          1HD1      LEU  34   0.623   4.968  -3.306
  370   1HD2  LEU  34          3HD2      LEU  34   1.697   1.764  -3.245
  371   2HD2  LEU  34          1HD2      LEU  34   1.585   1.738  -1.470
  372   3HD2  LEU  34          2HD2      LEU  34   0.270   2.440  -2.433
  373    QB   LEU  34           QB       LEU  34   3.836   2.890  -2.238
  374    QD1  LEU  34           QD1      LEU  34   1.481   4.748  -3.789
  375    QD2  LEU  34           QD2      LEU  34   1.184   1.981  -2.383
  376    QQD  LEU  34           QQD      LEU  34   1.333   3.364  -3.086
  377    H    GLU  35           HN       GLU  35   4.792   4.330   0.539
  378    HA   GLU  35           HA       GLU  35   2.840   5.973   1.803
  379   1HB   GLU  35          2HB       GLU  35   5.265   4.390   2.641
  380   2HB   GLU  35          3HB       GLU  35   4.585   5.514   3.801
  381   1HG   GLU  35          2HG       GLU  35   3.704   3.165   3.971
  382   2HG   GLU  35          3HG       GLU  35   2.467   4.408   3.831
  383    QB   GLU  35           QB       GLU  35   4.925   4.952   3.221
  384    QG   GLU  35           QG       GLU  35   3.086   3.787   3.901
  385    H    ASN  36           HN       ASN  36   6.089   6.743   0.710
  386    HA   ASN  36           HA       ASN  36   6.122   9.420   1.864
  387   1HB   ASN  36          2HB       ASN  36   7.659   7.891  -0.201
  388   2HB   ASN  36          3HB       ASN  36   7.599   9.635  -0.408
  389   1HD2  ASN  36          2HD2      ASN  36  10.443   8.378   1.863
  390   2HD2  ASN  36          1HD2      ASN  36   9.577   7.364   0.737
  391    QB   ASN  36           QB       ASN  36   7.629   8.762  -0.305
  392    QD2  ASN  36           QD2      ASN  36  10.009   7.871   1.300
  393    H    GLY  37           HN       GLY  37   4.060   8.071  -0.553
  394   1HA   GLY  37          1HA       GLY  37   2.480   9.061  -1.850
  395   2HA   GLY  37          2HA       GLY  37   2.724  10.521  -0.873
  396    QA   GLY  37           QA       GLY  37   2.602   9.790  -1.361
  397    H    LYS  38           HN       LYS  38   5.244   9.011  -2.807
  398    HA   LYS  38           HA       LYS  38   5.413  11.463  -4.498
  399   1HB   LYS  38          2HB       LYS  38   7.693  10.794  -4.965
  400   2HB   LYS  38          3HB       LYS  38   7.372  10.982  -3.237
  401   1HG   LYS  38          2HG       LYS  38   7.226   8.505  -3.006
  402   2HG   LYS  38          3HG       LYS  38   7.498   8.344  -4.752
  403   1HD   LYS  38          2HD       LYS  38   9.556   7.845  -3.669
  404   2HD   LYS  38          3HD       LYS  38   9.739   9.429  -4.450
  405   1HE   LYS  38          2HE       LYS  38   9.217  10.444  -2.118
  406   2HE   LYS  38          3HE       LYS  38   9.322   8.773  -1.513
  407   1HZ   LYS  38          1HZ       LYS  38  11.502  10.177  -2.862
  408   2HZ   LYS  38          2HZ       LYS  38  11.345   9.980  -1.237
  409   3HZ   LYS  38          3HZ       LYS  38  11.563   8.670  -2.200
  410    QB   LYS  38           QB       LYS  38   7.532  10.888  -4.101
  411    QG   LYS  38           QG       LYS  38   7.362   8.424  -3.879
  412    QD   LYS  38           QD       LYS  38   9.648   8.637  -4.059
  413    QE   LYS  38           QE       LYS  38   9.269   9.609  -1.815
  414    QZ   LYS  38           QZ       LYS  38  11.470   9.609  -2.100
  415    H    THR  39           HN       THR  39   3.914   8.513  -4.768
  416    HA   THR  39           HA       THR  39   4.347   8.433  -7.723
  417    HB   THR  39           HB       THR  39   3.721   6.017  -5.990
  418    HG1  THR  39          1HG       THR  39   5.810   6.917  -5.562
  419   1HG2  THR  39          1HG2      THR  39   4.663   6.401  -8.877
  420   2HG2  THR  39          2HG2      THR  39   4.530   4.845  -8.059
  421   3HG2  THR  39          3HG2      THR  39   3.071   5.813  -8.344
  422    QG2  THR  39           QG2      THR  39   4.089   5.687  -8.427
  423    H    LYS  40           HN       LYS  40   2.519   8.833  -8.809
  424    HA   LYS  40           HA       LYS  40  -0.057   8.991  -7.422
  425   1HB   LYS  40          2HB       LYS  40  -0.914   9.652  -9.661
  426   2HB   LYS  40          3HB       LYS  40   0.321  10.697  -8.947
  427   1HG   LYS  40          2HG       LYS  40   1.995  10.014 -10.512
  428   2HG   LYS  40          3HG       LYS  40   1.101   8.563 -10.945
  429   1HD   LYS  40          2HD       LYS  40   0.815   9.803 -12.800
  430   2HD   LYS  40          3HD       LYS  40  -0.703  10.097 -11.969
  431   1HE   LYS  40          2HE       LYS  40   1.765  11.930 -11.967
  432   2HE   LYS  40          3HE       LYS  40   0.387  12.123 -13.055
  433   1HZ   LYS  40          1HZ       LYS  40  -0.073  12.130 -10.178
  434   2HZ   LYS  40          2HZ       LYS  40   0.494  13.481 -10.920
  435   3HZ   LYS  40          3HZ       LYS  40  -0.946  12.840 -11.376
  436    QB   LYS  40           QB       LYS  40  -0.297  10.174  -9.304
  437    QG   LYS  40           QG       LYS  40   1.549   9.288 -10.729
  438    QD   LYS  40           QD       LYS  40   0.056   9.950 -12.384
  439    QE   LYS  40           QE       LYS  40   1.076  12.027 -12.511
  440    QZ   LYS  40           QZ       LYS  40  -0.175  12.817 -10.825
  441    NH1  ARG  41           NH2      ARG  41  -2.769   3.461 -14.802
  442    NH2  ARG  41           NH1      ARG  41  -3.318   5.575 -15.577
  443    H    ARG  41           HN       ARG  41   1.475   6.795  -9.794
  444    HA   ARG  41           HA       ARG  41  -0.603   4.774  -9.262
  445   1HB   ARG  41          2HB       ARG  41  -1.457   6.188 -11.100
  446   2HB   ARG  41          3HB       ARG  41  -0.055   5.771 -12.084
  447   1HG   ARG  41          2HG       ARG  41  -0.882   3.696 -12.589
  448   2HG   ARG  41          3HG       ARG  41  -1.395   3.394 -10.931
  449   1HD   ARG  41          2HD       ARG  41  -3.415   3.413 -12.200
  450   2HD   ARG  41          3HD       ARG  41  -3.365   4.873 -11.247
  451    HE   ARG  41           HE       ARG  41  -3.296   6.171 -13.127
  452   1HH1  ARG  41          2HH2      ARG  41  -2.551   2.855 -14.026
  453   2HH1  ARG  41          1HH2      ARG  41  -2.760   3.079 -15.735
  454   1HH2  ARG  41          2HH1      ARG  41  -3.552   6.543 -15.407
  455   2HH2  ARG  41          1HH1      ARG  41  -3.307   5.250 -16.532
  456    QB   ARG  41           QB       ARG  41  -0.756   5.980 -11.591
  457    QG   ARG  41           QG       ARG  41  -1.138   3.545 -11.759
  458    QD   ARG  41           QD       ARG  41  -3.390   4.143 -11.723
  459    QH1  ARG  41           QH2      ARG  41  -2.656   2.967 -14.881
  460    QH2  ARG  41           QH1      ARG  41  -3.429   5.897 -15.970
  461    HA   PRO  42           HA       PRO  42   3.686   3.038  -9.753
  462   1HB   PRO  42          2HB       PRO  42   3.471   1.109  -7.774
  463   2HB   PRO  42          3HB       PRO  42   3.982   2.767  -7.450
  464   1HG   PRO  42          2HG       PRO  42   1.325   1.484  -7.006
  465   2HG   PRO  42          3HG       PRO  42   2.139   2.739  -6.045
  466   1HD   PRO  42          2HD       PRO  42   0.097   3.132  -7.990
  467   2HD   PRO  42          3HD       PRO  42   1.092   4.427  -7.326
  468    QB   PRO  42           QB       PRO  42   3.727   1.937  -7.612
  469    QG   PRO  42           QG       PRO  42   1.732   2.112  -6.525
  470    QD   PRO  42           QD       PRO  42   0.594   3.780  -7.658
  471    NH1  ARG  43           NH2      ARG  43   5.445  -4.643 -14.651
  472    NH2  ARG  43           NH1      ARG  43   3.614  -5.989 -15.094
  473    H    ARG  43           HN       ARG  43   4.276   0.753 -10.208
  474    HA   ARG  43           HA       ARG  43   2.341  -0.476 -11.938
  475   1HB   ARG  43          2HB       ARG  43   4.875  -0.449 -12.188
  476   2HB   ARG  43          3HB       ARG  43   4.983  -1.645 -10.893
  477   1HG   ARG  43          2HG       ARG  43   3.146  -2.222 -13.214
  478   2HG   ARG  43          3HG       ARG  43   4.879  -2.223 -13.531
  479   1HD   ARG  43          2HD       ARG  43   5.272  -4.004 -11.901
  480   2HD   ARG  43          3HD       ARG  43   3.639  -3.853 -11.268
  481    HE   ARG  43           HE       ARG  43   2.854  -5.233 -12.804
  482   1HH1  ARG  43          2HH2      ARG  43   5.927  -4.020 -14.020
  483   2HH1  ARG  43          1HH2      ARG  43   5.882  -4.883 -15.528
  484   1HH2  ARG  43          2HH1      ARG  43   2.715  -6.365 -14.825
  485   2HH2  ARG  43          1HH1      ARG  43   3.999  -6.262 -15.986
  486    QB   ARG  43           QB       ARG  43   4.928  -1.047 -11.540
  487    QG   ARG  43           QG       ARG  43   4.012  -2.223 -13.372
  488    QD   ARG  43           QD       ARG  43   4.455  -3.928 -11.585
  489    QH1  ARG  43           QH2      ARG  43   5.904  -4.451 -14.774
  490    QH2  ARG  43           QH1      ARG  43   3.357  -6.314 -15.405
  491    H    PHE  44           HN       PHE  44   3.459  -1.080  -8.635
  492    HA   PHE  44           HA       PHE  44   1.836  -3.537  -8.452
  493   1HB   PHE  44          2HB       PHE  44   2.876  -3.645  -6.169
  494   2HB   PHE  44          3HB       PHE  44   3.999  -3.692  -7.498
  495    HD1  PHE  44          1HD       PHE  44   2.541  -1.403  -4.898
  496    HD2  PHE  44          2HD       PHE  44   5.763  -2.084  -7.674
  497    HE1  PHE  44          1HE       PHE  44   3.755   0.528  -3.953
  498    HE2  PHE  44          2HE       PHE  44   6.927  -0.080  -6.804
  499    HZ   PHE  44           HZ       PHE  44   5.940   1.202  -4.899
  500    QB   PHE  44           QB       PHE  44   3.437  -3.669  -6.833
  501    QR   PHE  44           QR       PHE  44   4.747  -0.760  -5.833
  502    H    LEU  45           HN       LEU  45   0.591  -0.713  -8.708
  503    HA   LEU  45           HA       LEU  45  -0.564  -0.114  -6.200
  504   1HB   LEU  45          2HB       LEU  45  -0.562   1.170  -8.461
  505   2HB   LEU  45          3HB       LEU  45  -2.034   0.319  -8.811
  506    HG   LEU  45           HG       LEU  45  -2.463   2.543  -8.026
  507   1HD1  LEU  45          2HD1      LEU  45  -3.967   0.650  -7.537
  508   2HD1  LEU  45          3HD1      LEU  45  -3.395   0.676  -5.862
  509   3HD1  LEU  45          1HD1      LEU  45  -4.203   2.098  -6.541
  510   1HD2  LEU  45          2HD2      LEU  45  -0.569   2.076  -5.848
  511   2HD2  LEU  45          3HD2      LEU  45  -1.333   3.580  -6.402
  512   3HD2  LEU  45          1HD2      LEU  45  -2.143   2.565  -5.229
  513    QB   LEU  45           QB       LEU  45  -1.298   0.745  -8.635
  514    QD1  LEU  45           QD1      LEU  45  -3.855   1.141  -6.647
  515    QD2  LEU  45           QD2      LEU  45  -1.349   2.740  -5.826
  516    QQD  LEU  45           QQD      LEU  45  -2.602   1.941  -6.236
  517    HA   PRO  46           HA       PRO  46  -4.227  -3.092  -7.044
  518   1HB   PRO  46          2HB       PRO  46  -3.830  -5.236  -8.741
  519   2HB   PRO  46          3HB       PRO  46  -4.618  -3.717  -9.214
  520   1HG   PRO  46          2HG       PRO  46  -1.841  -4.640  -9.806
  521   2HG   PRO  46          3HG       PRO  46  -2.908  -3.597 -10.778
  522   1HD   PRO  46          2HD       PRO  46  -0.793  -2.777  -9.197
  523   2HD   PRO  46          3HD       PRO  46  -2.100  -1.700  -9.735
  524    QB   PRO  46           QB       PRO  46  -4.224  -4.477  -8.977
  525    QG   PRO  46           QG       PRO  46  -2.375  -4.118 -10.292
  526    QD   PRO  46           QD       PRO  46  -1.446  -2.239  -9.465
  527    H    GLU  47           HN       GLU  47  -1.023  -4.550  -7.428
  528    HA   GLU  47           HA       GLU  47  -1.413  -6.819  -5.828
  529   1HB   GLU  47          2HB       GLU  47   1.060  -5.124  -6.294
  530   2HB   GLU  47          3HB       GLU  47   1.077  -6.789  -5.706
  531   1HG   GLU  47          2HG       GLU  47   0.500  -7.693  -7.769
  532   2HG   GLU  47          3HG       GLU  47  -0.287  -6.236  -8.364
  533    QB   GLU  47           QB       GLU  47   1.069  -5.956  -6.000
  534    QG   GLU  47           QG       GLU  47   0.107  -6.965  -8.066
  535    H    LEU  48           HN       LEU  48  -0.256  -3.527  -4.948
  536    HA   LEU  48           HA       LEU  48   0.056  -4.047  -2.152
  537   1HB   LEU  48          2HB       LEU  48   1.161  -2.300  -3.439
  538   2HB   LEU  48          3HB       LEU  48  -0.353  -1.423  -3.656
  539    HG   LEU  48           HG       LEU  48   1.279  -0.551  -1.981
  540   1HD1  LEU  48          3HD1      LEU  48  -1.534  -1.111  -1.044
  541   2HD1  LEU  48          1HD1      LEU  48  -0.377  -0.201  -0.087
  542   3HD1  LEU  48          2HD1      LEU  48  -0.811   0.371  -1.696
  543   1HD2  LEU  48          2HD2      LEU  48   2.071  -2.628  -1.022
  544   2HD2  LEU  48          3HD2      LEU  48   1.498  -1.510   0.205
  545   3HD2  LEU  48          1HD2      LEU  48   0.491  -2.909  -0.246
  546    QB   LEU  48           QB       LEU  48   0.404  -1.862  -3.547
  547    QD1  LEU  48           QD1      LEU  48  -0.908  -0.314  -0.942
  548    QD2  LEU  48           QD2      LEU  48   1.353  -2.349  -0.354
  549    QQD  LEU  48           QQD      LEU  48   0.223  -1.331  -0.649
  550    H    ALA  49           HN       ALA  49  -2.566  -2.443  -4.003
  551    HA   ALA  49           HA       ALA  49  -4.310  -1.940  -1.898
  552   1HB   ALA  49          1HB       ALA  49  -4.668  -1.233  -4.287
  553   2HB   ALA  49          2HB       ALA  49  -5.120  -2.892  -4.683
  554   3HB   ALA  49          3HB       ALA  49  -6.099  -1.942  -3.552
  555    QB   ALA  49           QB       ALA  49  -5.295  -2.022  -4.174
  556    H    SER  50           HN       SER  50  -4.038  -4.936  -3.839
  557    HA   SER  50           HA       SER  50  -5.994  -6.428  -2.379
  558   1HB   SER  50          2HB       SER  50  -3.667  -7.330  -4.117
  559   2HB   SER  50          3HB       SER  50  -4.960  -8.378  -3.522
  560    HG   SER  50           HG       SER  50  -5.247  -6.053  -5.142
  561    QB   SER  50           QB       SER  50  -4.313  -7.855  -3.820
  562    H    ALA  51           HN       ALA  51  -2.408  -6.190  -1.998
  563    HA   ALA  51           HA       ALA  51  -2.090  -8.166  -0.042
  564   1HB   ALA  51          1HB       ALA  51  -0.210  -7.032  -1.152
  565   2HB   ALA  51          2HB       ALA  51  -0.585  -5.528  -0.280
  566   3HB   ALA  51          3HB       ALA  51  -0.054  -6.959   0.613
  567    QB   ALA  51           QB       ALA  51  -0.283  -6.507  -0.273
  568    H    LEU  52           HN       LEU  52  -3.031  -4.743   0.350
  569    HA   LEU  52           HA       LEU  52  -3.446  -5.020   3.249
  570   1HB   LEU  52          2HB       LEU  52  -4.004  -2.900   1.162
  571   2HB   LEU  52          3HB       LEU  52  -4.714  -2.753   2.765
  572    HG   LEU  52           HG       LEU  52  -1.768  -3.175   2.329
  573   1HD1  LEU  52          3HD1      LEU  52  -3.347  -0.609   2.676
  574   2HD1  LEU  52          1HD1      LEU  52  -1.568  -0.747   2.724
  575   3HD1  LEU  52          2HD1      LEU  52  -2.443  -1.119   1.234
  576   1HD2  LEU  52          2HD2      LEU  52  -3.318  -3.322   4.714
  577   2HD2  LEU  52          3HD2      LEU  52  -1.562  -3.143   4.607
  578   3HD2  LEU  52          1HD2      LEU  52  -2.582  -1.716   4.746
  579    QB   LEU  52           QB       LEU  52  -4.360  -2.826   1.964
  580    QD1  LEU  52           QD1      LEU  52  -2.453  -0.825   2.211
  581    QD2  LEU  52           QD2      LEU  52  -2.487  -2.727   4.689
  582    QQD  LEU  52           QQD      LEU  52  -2.470  -1.776   3.451
  583    H    GLY  53           HN       GLY  53  -5.426  -5.335   0.344
  584   1HA   GLY  53          1HA       GLY  53  -7.516  -6.339   0.155
  585   2HA   GLY  53          2HA       GLY  53  -7.704  -6.371   1.916
  586    QA   GLY  53           QA       GLY  53  -7.610  -6.355   1.036
  587    H    VAL  54           HN       VAL  54  -7.190  -3.990  -0.709
  588    HA   VAL  54           HA       VAL  54  -9.732  -2.654  -0.206
  589    HB   VAL  54           HB       VAL  54  -8.788  -0.413  -0.336
  590   1HG1  VAL  54          1HG1      VAL  54  -9.115  -1.391   1.877
  591   2HG1  VAL  54          2HG1      VAL  54  -7.412  -1.947   1.873
  592   3HG1  VAL  54          3HG1      VAL  54  -7.793  -0.216   1.875
  593   1HG2  VAL  54          3HG2      VAL  54  -6.122  -1.826  -0.527
  594   2HG2  VAL  54          1HG2      VAL  54  -6.788  -0.570  -1.585
  595   3HG2  VAL  54          2HG2      VAL  54  -6.224  -0.175   0.044
  596    QG1  VAL  54           QG1      VAL  54  -8.107  -1.184   1.875
  597    QG2  VAL  54           QG2      VAL  54  -6.378  -0.857  -0.690
  598    QQG  VAL  54           QQG      VAL  54  -7.242  -1.021   0.593
  599    H    SER  55           HN       SER  55  -9.993  -1.021  -2.238
  600    HA   SER  55           HA       SER  55  -9.232  -2.576  -4.628
  601   1HB   SER  55          2HB       SER  55 -10.923  -0.998  -5.665
  602   2HB   SER  55          3HB       SER  55 -11.561  -2.042  -4.381
  603    HG   SER  55           HG       SER  55 -12.184   0.157  -4.079
  604    QB   SER  55           QB       SER  55 -11.242  -1.520  -5.023
  605    H    VAL  56           HN       VAL  56  -8.190  -1.601  -6.399
  606    HA   VAL  56           HA       VAL  56  -6.278   0.503  -6.048
  607    HB   VAL  56           HB       VAL  56  -7.757  -0.603  -8.510
  608   1HG1  VAL  56          1HG1      VAL  56  -5.773   1.635  -8.301
  609   2HG1  VAL  56          2HG1      VAL  56  -5.585   0.485  -9.634
  610   3HG1  VAL  56          3HG1      VAL  56  -7.102   1.367  -9.427
  611   1HG2  VAL  56          1HG2      VAL  56  -5.115  -1.151  -7.172
  612   2HG2  VAL  56          2HG2      VAL  56  -6.417  -2.289  -7.542
  613   3HG2  VAL  56          3HG2      VAL  56  -5.433  -1.626  -8.854
  614    QG1  VAL  56           QG1      VAL  56  -6.154   1.163  -9.121
  615    QG2  VAL  56           QG2      VAL  56  -5.654  -1.689  -7.856
  616    QQG  VAL  56           QQG      VAL  56  -5.904  -0.263  -8.488
  617    H    ASP  57           HN       ASP  57  -9.657   0.492  -7.207
  618    HA   ASP  57           HA       ASP  57  -9.850   3.183  -7.865
  619   1HB   ASP  57          2HB       ASP  57 -11.589   1.302  -8.167
  620   2HB   ASP  57          3HB       ASP  57 -12.092   1.658  -6.497
  621    QB   ASP  57           QB       ASP  57 -11.840   1.480  -7.332
  622    CH2  TRP  58           CH2      TRP  58  -7.433   3.039   2.476
  623    H    TRP  58           HN       TRP  58  -9.993   1.642  -4.622
  624    HA   TRP  58           HA       TRP  58 -10.567   4.151  -3.276
  625   1HB   TRP  58          2HB       TRP  58 -11.164   1.954  -2.308
  626   2HB   TRP  58          3HB       TRP  58  -9.469   1.549  -2.188
  627    HD1  TRP  58           HD1      TRP  58 -11.876   4.251  -0.871
  628    HE1  TRP  58           HE1      TRP  58 -11.120   5.047   1.417
  629    HE3  TRP  58           HE3      TRP  58  -7.498   1.716  -0.662
  630    HZ2  TRP  58           HZ2      TRP  58  -8.857   4.442   3.251
  631    HZ3  TRP  58           HZ3      TRP  58  -6.028   1.881   1.334
  632    HH2  TRP  58           HH2      TRP  58  -6.724   3.191   3.275
  633    QB   TRP  58           QB       TRP  58 -10.316   1.752  -2.247
  634    H    LEU  59           HN       LEU  59  -7.584   2.187  -3.908
  635    HA   LEU  59           HA       LEU  59  -5.932   4.073  -2.512
  636   1HB   LEU  59          2HB       LEU  59  -5.445   1.750  -4.302
  637   2HB   LEU  59          3HB       LEU  59  -4.179   2.945  -4.288
  638    HG   LEU  59           HG       LEU  59  -5.268   1.365  -1.927
  639   1HD1  LEU  59          2HD1      LEU  59  -3.487   0.415  -3.543
  640   2HD1  LEU  59          3HD1      LEU  59  -2.404   1.654  -2.897
  641   3HD1  LEU  59          1HD1      LEU  59  -3.108   0.425  -1.816
  642   1HD2  LEU  59          3HD2      LEU  59  -3.450   3.793  -1.908
  643   2HD2  LEU  59          1HD2      LEU  59  -4.817   3.441  -0.815
  644   3HD2  LEU  59          2HD2      LEU  59  -3.321   2.536  -0.656
  645    QB   LEU  59           QB       LEU  59  -4.813   2.348  -4.295
  646    QD1  LEU  59           QD1      LEU  59  -3.000   0.831  -2.752
  647    QD2  LEU  59           QD2      LEU  59  -3.862   3.257  -1.126
  648    QQD  LEU  59           QQD      LEU  59  -3.431   2.044  -1.939
  649    H    LEU  60           HN       LEU  60  -7.305   4.290  -5.694
  650    HA   LEU  60           HA       LEU  60  -5.687   6.674  -6.312
  651   1HB   LEU  60          2HB       LEU  60  -7.866   5.178  -7.780
  652   2HB   LEU  60          3HB       LEU  60  -7.229   6.721  -8.365
  653    HG   LEU  60           HG       LEU  60  -5.435   4.346  -7.725
  654   1HD1  LEU  60          1HD1      LEU  60  -7.034   3.722  -9.493
  655   2HD1  LEU  60          2HD1      LEU  60  -6.563   5.147 -10.436
  656   3HD1  LEU  60          3HD1      LEU  60  -5.380   3.855 -10.119
  657   1HD2  LEU  60          3HD2      LEU  60  -4.789   7.060  -8.262
  658   2HD2  LEU  60          1HD2      LEU  60  -3.697   5.666  -8.322
  659   3HD2  LEU  60          2HD2      LEU  60  -4.520   6.235  -9.786
  660    QB   LEU  60           QB       LEU  60  -7.547   5.950  -8.072
  661    QD1  LEU  60           QD1      LEU  60  -6.326   4.241 -10.016
  662    QD2  LEU  60           QD2      LEU  60  -4.335   6.321  -8.790
  663    QQD  LEU  60           QQD      LEU  60  -5.331   5.280  -9.403
  664    H    ASN  61           HN       ASN  61  -9.159   6.009  -5.534
  665    HA   ASN  61           HA       ASN  61  -9.725   8.850  -5.292
  666   1HB   ASN  61          2HB       ASN  61 -11.403   6.418  -4.549
  667   2HB   ASN  61          3HB       ASN  61 -11.915   8.093  -4.389
  668   1HD2  ASN  61          2HD2      ASN  61 -12.265   6.321  -7.989
  669   2HD2  ASN  61          1HD2      ASN  61 -11.764   5.450  -6.580
  670    QB   ASN  61           QB       ASN  61 -11.659   7.256  -4.468
  671    QD2  ASN  61           QD2      ASN  61 -12.014   5.886  -7.284
  672    H    GLY  62           HN       GLY  62  -9.905   6.242  -2.779
  673   1HA   GLY  62          1HA       GLY  62  -8.789   6.482  -0.681
  674   2HA   GLY  62          2HA       GLY  62  -8.976   8.239  -0.729
  675    QA   GLY  62           QA       GLY  62  -8.883   7.360  -0.705
  676    H    THR  63           HN       THR  63 -11.890   7.024  -1.841
  677    HA   THR  63           HA       THR  63 -13.122   6.409   0.714
  678    HB   THR  63           HB       THR  63 -14.838   8.115   0.181
  679    HG1  THR  63          1HG       THR  63 -14.100   9.854  -1.252
  680   1HG2  THR  63          2HG2      THR  63 -13.026   8.600   1.859
  681   2HG2  THR  63          3HG2      THR  63 -12.098   9.409   0.579
  682   3HG2  THR  63          1HG2      THR  63 -13.661  10.061   1.079
  683    QG2  THR  63           QG2      THR  63 -12.928   9.357   1.172
  684    H    SER  64           HN       SER  64 -14.787   5.000   0.214
  685    HA   SER  64           HA       SER  64 -15.519   4.255  -2.502
  686   1HB   SER  64          2HB       SER  64 -13.626   2.466  -0.917
  687   2HB   SER  64          3HB       SER  64 -14.673   1.867  -2.200
  688    HG   SER  64           HG       SER  64 -13.697   3.467  -3.601
  689    QB   SER  64           QB       SER  64 -14.149   2.166  -1.559
  690    H    ASP  65           HN       ASP  65 -17.154   5.167  -0.984
  691    HA   ASP  65           HA       ASP  65 -18.890   3.114   0.164
  692   1HB   ASP  65          2HB       ASP  65 -18.879   4.384   2.360
  693   2HB   ASP  65          3HB       ASP  65 -17.483   3.360   2.035
  694    QB   ASP  65           QB       ASP  65 -18.181   3.872   2.197
  695    H    SER  66           HN       SER  66 -20.364   3.736  -1.335
  696    HA   SER  66           HA       SER  66 -22.018   4.918  -2.344
  697   1HB   SER  66          2HB       SER  66 -21.984   6.520   0.245
  698   2HB   SER  66          3HB       SER  66 -23.327   6.384  -0.898
  699    HG   SER  66           HG       SER  66 -23.274   4.081  -0.484
  700    QB   SER  66           QB       SER  66 -22.655   6.452  -0.326
  701    H    ASN  67           HN       ASN  67 -20.028   5.629  -3.699
  702    HA   ASN  67           HA       ASN  67 -19.211   8.387  -3.570
  703   1HB   ASN  67          2HB       ASN  67 -17.742   6.820  -4.610
  704   2HB   ASN  67          3HB       ASN  67 -18.998   6.265  -5.727
  705   1HD2  ASN  67          2HD2      ASN  67 -17.882   8.572  -8.146
  706   2HD2  ASN  67          1HD2      ASN  67 -18.398   6.938  -7.782
  707    QB   ASN  67           QB       ASN  67 -18.370   6.542  -5.169
  708    QD2  ASN  67           QD2      ASN  67 -18.141   7.755  -7.964
  709    H    VAL  68           HN       VAL  68 -21.038   6.868  -6.290
  710    HA   VAL  68           HA       VAL  68 -22.072   9.480  -7.033
  711    HB   VAL  68           HB       VAL  68 -23.324   8.264  -8.777
  712   1HG1  VAL  68          1HG1      VAL  68 -20.908   9.077  -9.016
  713   2HG1  VAL  68          2HG1      VAL  68 -20.439   7.376  -8.843
  714   3HG1  VAL  68          3HG1      VAL  68 -21.488   7.874 -10.176
  715   1HG2  VAL  68          2HG2      VAL  68 -23.661   6.094  -7.609
  716   2HG2  VAL  68          3HG2      VAL  68 -22.941   5.908  -9.216
  717   3HG2  VAL  68          1HG2      VAL  68 -21.927   5.745  -7.771
  718    QG1  VAL  68           QG1      VAL  68 -20.945   8.109  -9.344
  719    QG2  VAL  68           QG2      VAL  68 -22.843   5.916  -8.199
  720    QQG  VAL  68           QQG      VAL  68 -21.894   7.013  -8.771
  721    NH1  ARG  69           NH2      ARG  69 -27.711  14.306  -3.756
  722    NH2  ARG  69           NH1      ARG  69 -29.730  14.346  -4.894
  723    H    ARG  69           HN       ARG  69 -24.415   9.729  -7.500
  724    HA   ARG  69           HA       ARG  69 -26.056   9.111  -5.100
  725   1HB   ARG  69          2HB       ARG  69 -25.865  11.339  -7.114
  726   2HB   ARG  69          3HB       ARG  69 -27.488  10.908  -6.609
  727   1HG   ARG  69          2HG       ARG  69 -25.357  11.278  -4.500
  728   2HG   ARG  69          3HG       ARG  69 -26.076  12.702  -5.256
  729   1HD   ARG  69          2HD       ARG  69 -27.804  10.449  -4.150
  730   2HD   ARG  69          3HD       ARG  69 -27.237  11.719  -3.082
  731    HE   ARG  69           HE       ARG  69 -29.327  11.848  -5.098
  732   1HH1  ARG  69          2HH2      ARG  69 -26.919  13.774  -3.428
  733   2HH1  ARG  69          1HH2      ARG  69 -27.729  15.302  -3.600
  734   1HH2  ARG  69          2HH1      ARG  69 -30.464  13.870  -5.399
  735   2HH2  ARG  69          1HH1      ARG  69 -29.801  15.346  -4.774
  736    QB   ARG  69           QB       ARG  69 -26.677  11.124  -6.861
  737    QG   ARG  69           QG       ARG  69 -25.716  11.990  -4.877
  738    QD   ARG  69           QD       ARG  69 -27.521  11.084  -3.616
  739    QH1  ARG  69           QH2      ARG  69 -27.324  14.538  -3.513
  740    QH2  ARG  69           QH1      ARG  69 -30.132  14.608  -5.087
   
  Start of MODEL          11
 Raw file had 740 H/Q atoms
  Start of MODEL   11
    1    H    SER   1           HN       SER   1  -4.681  11.923   3.306
    2    HA   SER   1           HA       SER   1  -3.253  11.598   1.513
    3   1HB   SER   1          2HB       SER   1  -0.923  10.862   2.590
    4   2HB   SER   1          3HB       SER   1  -1.686  12.355   3.177
    5    HG   SER   1           HG       SER   1  -1.072  10.716   4.827
    6    QB   SER   1           QB       SER   1  -1.304  11.608   2.883
    7    H    ILE   2           HN       ILE   2  -1.625   9.865   0.498
    8    HA   ILE   2           HA       ILE   2  -3.030   7.406   0.104
    9    HB   ILE   2           HB       ILE   2  -1.675   8.485  -1.578
   10   1HG1  ILE   2          2HG1      ILE   2  -0.449   5.772  -1.018
   11   2HG1  ILE   2          3HG1      ILE   2  -2.146   5.964  -1.486
   12   1HG2  ILE   2          1HG2      ILE   2   0.243   9.262  -0.110
   13   2HG2  ILE   2          2HG2      ILE   2   0.841   7.590  -0.110
   14   3HG2  ILE   2          3HG2      ILE   2   0.724   8.498  -1.621
   15   1HD1  ILE   2          3HD1      ILE   2  -1.447   7.187  -3.544
   16   2HD1  ILE   2          1HD1      ILE   2   0.247   6.844  -3.143
   17   3HD1  ILE   2          2HD1      ILE   2  -0.881   5.515  -3.479
   18    QG1  ILE   2           QG1      ILE   2  -1.298   5.867  -1.252
   19    QG2  ILE   2           QG2      ILE   2   0.602   8.450  -0.614
   20    QD1  ILE   2           QD1      ILE   2  -0.693   6.515  -3.389
   21    H    SER   3           HN       SER   3  -0.039   8.194   1.907
   22    HA   SER   3           HA       SER   3   0.578   5.733   2.958
   23   1HB   SER   3          2HB       SER   3   1.470   7.123   4.924
   24   2HB   SER   3          3HB       SER   3   2.002   7.634   3.335
   25    HG   SER   3           HG       SER   3   1.299   9.415   4.535
   26    QB   SER   3           QB       SER   3   1.736   7.378   4.130
   27    H    SER   4           HN       SER   4  -1.513   8.202   4.436
   28    HA   SER   4           HA       SER   4  -2.267   6.780   6.676
   29   1HB   SER   4          2HB       SER   4  -2.847   9.140   6.225
   30   2HB   SER   4          3HB       SER   4  -4.155   8.594   5.139
   31    HG   SER   4           HG       SER   4  -5.302   8.281   6.915
   32    QB   SER   4           QB       SER   4  -3.501   8.867   5.683
   33    NH1  ARG   5           NH2      ARG   5  -5.415   8.404  -0.099
   34    NH2  ARG   5           NH1      ARG   5  -4.857   7.413  -2.087
   35    H    ARG   5           HN       ARG   5  -3.567   6.216   3.345
   36    HA   ARG   5           HA       ARG   5  -5.729   4.536   4.356
   37   1HB   ARG   5          2HB       ARG   5  -4.692   4.111   1.568
   38   2HB   ARG   5          3HB       ARG   5  -6.283   4.060   2.260
   39   1HG   ARG   5          2HG       ARG   5  -6.091   6.578   2.641
   40   2HG   ARG   5          3HG       ARG   5  -4.788   6.479   1.444
   41   1HD   ARG   5          2HD       ARG   5  -7.344   5.072   0.658
   42   2HD   ARG   5          3HD       ARG   5  -7.535   6.773   1.001
   43    HE   ARG   5           HE       ARG   5  -6.905   5.901  -1.415
   44   1HH1  ARG   5          2HH2      ARG   5  -5.793   8.316   0.834
   45   2HH1  ARG   5          1HH2      ARG   5  -4.894   9.225  -0.367
   46   1HH2  ARG   5          1HH1      ARG   5  -5.105   6.853  -2.908
   47   2HH2  ARG   5          2HH1      ARG   5  -4.078   8.041  -2.216
   48    QB   ARG   5           QB       ARG   5  -5.488   4.085   1.914
   49    QG   ARG   5           QG       ARG   5  -5.440   6.528   2.042
   50    QD   ARG   5           QD       ARG   5  -7.439   5.923   0.829
   51    QH1  ARG   5           QH2      ARG   5  -5.343   8.770   0.233
   52    QH2  ARG   5           QH1      ARG   5  -4.592   7.447  -2.562
   53    H    VAL   6           HN       VAL   6  -2.606   3.857   2.751
   54    HA   VAL   6           HA       VAL   6  -2.691   1.042   2.955
   55    HB   VAL   6           HB       VAL   6  -0.306   2.959   2.869
   56   1HG1  VAL   6          3HG1      VAL   6  -0.480  -0.052   2.512
   57   2HG1  VAL   6          1HG1      VAL   6   0.871   0.917   1.886
   58   3HG1  VAL   6          2HG1      VAL   6   0.572   0.853   3.625
   59   1HG2  VAL   6          1HG2      VAL   6  -1.747   1.392   0.693
   60   2HG2  VAL   6          2HG2      VAL   6  -1.824   3.153   0.910
   61   3HG2  VAL   6          3HG2      VAL   6  -0.297   2.389   0.460
   62    QG1  VAL   6           QG1      VAL   6   0.321   0.573   2.675
   63    QG2  VAL   6           QG2      VAL   6  -1.289   2.311   0.688
   64    QQG  VAL   6           QQG      VAL   6  -0.484   1.442   1.680
   65    H    LYS   7           HN       LYS   7  -1.111   3.408   5.084
   66    HA   LYS   7           HA       LYS   7  -0.162   1.584   6.985
   67   1HB   LYS   7          2HB       LYS   7   0.601   3.905   6.594
   68   2HB   LYS   7          3HB       LYS   7  -0.805   4.522   7.462
   69   1HG   LYS   7          2HG       LYS   7  -0.044   3.747   9.523
   70   2HG   LYS   7          3HG       LYS   7   0.872   2.403   8.817
   71   1HD   LYS   7          2HD       LYS   7   2.552   3.993   7.929
   72   2HD   LYS   7          3HD       LYS   7   1.659   5.340   8.669
   73   1HE   LYS   7          2HE       LYS   7   2.021   4.418  10.913
   74   2HE   LYS   7          3HE       LYS   7   2.790   2.970  10.255
   75   1HZ   LYS   7          2HZ       LYS   7   4.045   5.410   9.421
   76   2HZ   LYS   7          3HZ       LYS   7   4.079   5.177  11.046
   77   3HZ   LYS   7          1HZ       LYS   7   4.715   4.048  10.043
   78    QB   LYS   7           QB       LYS   7  -0.102   4.214   7.028
   79    QG   LYS   7           QG       LYS   7   0.414   3.075   9.170
   80    QD   LYS   7           QD       LYS   7   2.105   4.667   8.299
   81    QE   LYS   7           QE       LYS   7   2.406   3.694  10.584
   82    QZ   LYS   7           QZ       LYS   7   4.279   4.878  10.170
   83    H    SER   8           HN       SER   8  -3.221   3.630   7.036
   84    HA   SER   8           HA       SER   8  -4.158   2.734   9.543
   85   1HB   SER   8          2HB       SER   8  -5.803   3.405   7.066
   86   2HB   SER   8          3HB       SER   8  -6.465   3.097   8.676
   87    HG   SER   8           HG       SER   8  -4.794   5.207   7.867
   88    QB   SER   8           QB       SER   8  -6.134   3.252   7.870
   89    H    LYS   9           HN       LYS   9  -4.608   1.141   6.272
   90    HA   LYS   9           HA       LYS   9  -6.286  -0.860   7.495
   91   1HB   LYS   9          2HB       LYS   9  -6.285  -0.041   5.070
   92   2HB   LYS   9          3HB       LYS   9  -4.831  -1.012   4.858
   93   1HG   LYS   9          2HG       LYS   9  -6.609  -2.413   4.141
   94   2HG   LYS   9          3HG       LYS   9  -6.285  -2.962   5.808
   95   1HD   LYS   9          2HD       LYS   9  -8.206  -1.265   6.440
   96   2HD   LYS   9          3HD       LYS   9  -8.615  -1.327   4.731
   97   1HE   LYS   9          2HE       LYS   9  -8.402  -3.696   6.667
   98   2HE   LYS   9          3HE       LYS   9  -9.902  -2.948   6.126
   99   1HZ   LYS   9          2HZ       LYS   9  -8.011  -4.393   4.328
  100   2HZ   LYS   9          3HZ       LYS   9  -9.428  -4.955   4.917
  101   3HZ   LYS   9          1HZ       LYS   9  -9.425  -3.688   3.884
  102    QB   LYS   9           QB       LYS   9  -5.558  -0.527   4.963
  103    QG   LYS   9           QG       LYS   9  -6.447  -2.688   4.975
  104    QD   LYS   9           QD       LYS   9  -8.411  -1.296   5.585
  105    QE   LYS   9           QE       LYS   9  -9.152  -3.323   6.396
  106    QZ   LYS   9           QZ       LYS   9  -8.955  -4.345   4.376
  107    NH1  ARG  10           NH2      ARG  10   2.958  -1.140   9.969
  108    NH2  ARG  10           NH1      ARG  10   4.044   0.605   8.939
  109    H    ARG  10           HN       ARG  10  -2.811  -0.567   6.724
  110    HA   ARG  10           HA       ARG  10  -1.998  -3.150   7.542
  111   1HB   ARG  10          2HB       ARG  10  -0.547  -1.615   6.316
  112   2HB   ARG  10          3HB       ARG  10  -0.517  -0.486   7.685
  113   1HG   ARG  10          2HG       ARG  10   0.622  -1.998   9.094
  114   2HG   ARG  10          3HG       ARG  10   0.383  -3.323   7.953
  115   1HD   ARG  10          2HD       ARG  10   2.570  -2.845   7.633
  116   2HD   ARG  10          3HD       ARG  10   1.808  -2.070   6.267
  117    HE   ARG  10           HE       ARG  10   2.930  -0.203   6.880
  118   1HH1  ARG  10          2HH2      ARG  10   2.424  -2.008   9.915
  119   2HH1  ARG  10          1HH2      ARG  10   3.334  -0.893  10.871
  120   1HH2  ARG  10          2HH1      ARG  10   4.244   1.163   8.121
  121   2HH2  ARG  10          1HH1      ARG  10   4.595   0.754   9.772
  122    QB   ARG  10           QB       ARG  10  -0.532  -1.050   7.001
  123    QG   ARG  10           QG       ARG  10   0.502  -2.660   8.524
  124    QD   ARG  10           QD       ARG  10   2.189  -2.457   6.950
  125    QH1  ARG  10           QH2      ARG  10   2.879  -1.451  10.393
  126    QH2  ARG  10           QH1      ARG  10   4.419   0.959   8.946
  127    H    ILE  11           HN       ILE  11  -2.669  -0.227   9.542
  128    HA   ILE  11           HA       ILE  11  -1.795  -1.396  12.036
  129    HB   ILE  11           HB       ILE  11  -3.490   0.988  11.289
  130   1HG1  ILE  11          2HG1      ILE  11  -1.972   2.007  13.009
  131   2HG1  ILE  11          3HG1      ILE  11  -1.114   0.470  13.141
  132   1HG2  ILE  11          1HG2      ILE  11  -3.425  -0.227  14.083
  133   2HG2  ILE  11          2HG2      ILE  11  -3.984   1.408  13.694
  134   3HG2  ILE  11          3HG2      ILE  11  -4.875   0.031  13.084
  135   1HD1  ILE  11          2HD1      ILE  11  -0.486   0.713  10.708
  136   2HD1  ILE  11          3HD1      ILE  11  -1.372   2.270  10.708
  137   3HD1  ILE  11          1HD1      ILE  11   0.076   2.069  11.707
  138    QG1  ILE  11           QG1      ILE  11  -1.543   1.238  13.076
  139    QG2  ILE  11           QG2      ILE  11  -4.095   0.404  13.620
  140    QD1  ILE  11           QD1      ILE  11  -0.594   1.684  11.042
  141    H    GLN  12           HN       GLN  12  -5.033  -1.034  10.545
  142    HA   GLN  12           HA       GLN  12  -6.475  -2.516  12.399
  143   1HB   GLN  12          2HB       GLN  12  -7.603  -1.271  10.741
  144   2HB   GLN  12          3HB       GLN  12  -6.883  -2.189   9.406
  145   1HG   GLN  12          2HG       GLN  12  -8.095  -4.182  10.016
  146   2HG   GLN  12          3HG       GLN  12  -8.687  -3.421  11.514
  147   1HE2  GLN  12          2HE2      GLN  12 -11.561  -3.240   9.268
  148   2HE2  GLN  12          1HE2      GLN  12 -10.695  -4.438  10.210
  149    QB   GLN  12           QB       GLN  12  -7.243  -1.730  10.074
  150    QG   GLN  12           QG       GLN  12  -8.391  -3.802  10.766
  151    QE2  GLN  12           QE2      GLN  12 -11.128  -3.839   9.740
  152    H    LEU  13           HN       LEU  13  -4.718  -3.864   9.546
  153    HA   LEU  13           HA       LEU  13  -5.281  -6.619  10.343
  154   1HB   LEU  13          2HB       LEU  13  -3.417  -5.302   8.352
  155   2HB   LEU  13          3HB       LEU  13  -3.209  -6.989   8.776
  156    HG   LEU  13           HG       LEU  13  -6.031  -6.612   8.311
  157   1HD1  LEU  13          2HD1      LEU  13  -4.707  -4.794   6.675
  158   2HD1  LEU  13          3HD1      LEU  13  -4.881  -6.228   5.651
  159   3HD1  LEU  13          1HD1      LEU  13  -6.306  -5.500   6.410
  160   1HD2  LEU  13          3HD2      LEU  13  -4.726  -8.717   8.181
  161   2HD2  LEU  13          1HD2      LEU  13  -5.664  -8.408   6.704
  162   3HD2  LEU  13          2HD2      LEU  13  -3.911  -8.108   6.723
  163    QB   LEU  13           QB       LEU  13  -3.313  -6.146   8.564
  164    QD1  LEU  13           QD1      LEU  13  -5.298  -5.507   6.245
  165    QD2  LEU  13           QD2      LEU  13  -4.767  -8.411   7.202
  166    QQD  LEU  13           QQD      LEU  13  -5.033  -6.960   6.724
  167    H    GLY  14           HN       GLY  14  -2.662  -4.342  11.105
  168   1HA   GLY  14          1HA       GLY  14  -1.205  -4.430  12.876
  169   2HA   GLY  14          2HA       GLY  14  -1.807  -6.031  13.326
  170    QA   GLY  14           QA       GLY  14  -1.506  -5.231  13.101
  171    H    LEU  15           HN       LEU  15  -0.223  -4.586  10.421
  172    HA   LEU  15           HA       LEU  15   1.888  -6.739  10.530
  173   1HB   LEU  15          2HB       LEU  15   0.373  -5.633   8.137
  174   2HB   LEU  15          3HB       LEU  15   1.817  -6.636   7.988
  175    HG   LEU  15           HG       LEU  15  -0.691  -7.569   9.455
  176   1HD1  LEU  15          3HD1      LEU  15  -1.163  -7.019   7.045
  177   2HD1  LEU  15          1HD1      LEU  15   0.103  -8.183   6.590
  178   3HD1  LEU  15          2HD1      LEU  15  -1.351  -8.735   7.458
  179   1HD2  LEU  15          2HD2      LEU  15   1.679  -9.089   8.250
  180   2HD2  LEU  15          3HD2      LEU  15   1.388  -8.848   9.984
  181   3HD2  LEU  15          1HD2      LEU  15   0.265  -9.819   9.028
  182    QB   LEU  15           QB       LEU  15   1.095  -6.135   8.062
  183    QD1  LEU  15           QD1      LEU  15  -0.803  -7.979   7.031
  184    QD2  LEU  15           QD2      LEU  15   1.110  -9.252   9.088
  185    QQD  LEU  15           QQD      LEU  15   0.154  -8.616   8.059
  186    H    ASN  16           HN       ASN  16   3.851  -6.083   9.141
  187    HA   ASN  16           HA       ASN  16   4.427  -3.187   9.563
  188   1HB   ASN  16          2HB       ASN  16   6.750  -3.677   9.583
  189   2HB   ASN  16          3HB       ASN  16   5.904  -4.560  10.851
  190   1HD2  ASN  16          2HD2      ASN  16   8.290  -6.973   9.409
  191   2HD2  ASN  16          1HD2      ASN  16   8.348  -5.537  10.411
  192    QB   ASN  16           QB       ASN  16   6.326  -4.119  10.217
  193    QD2  ASN  16           QD2      ASN  16   8.320  -6.256   9.910
  194    H    GLN  17           HN       GLN  17   5.816  -2.187   7.939
  195    HA   GLN  17           HA       GLN  17   4.696  -2.276   5.349
  196   1HB   GLN  17          2HB       GLN  17   7.134  -1.071   6.590
  197   2HB   GLN  17          3HB       GLN  17   7.110  -1.272   4.816
  198   1HG   GLN  17          2HG       GLN  17   5.023   0.148   4.848
  199   2HG   GLN  17          3HG       GLN  17   5.290   0.363   6.577
  200   1HE2  GLN  17          2HE2      GLN  17   7.135   3.285   5.575
  201   2HE2  GLN  17          1HE2      GLN  17   5.459   2.785   5.710
  202    QB   GLN  17           QB       GLN  17   7.122  -1.171   5.703
  203    QG   GLN  17           QG       GLN  17   5.157   0.255   5.713
  204    QE2  GLN  17           QE2      GLN  17   6.297   3.035   5.643
  205    H    ALA  18           HN       ALA  18   7.430  -4.101   6.760
  206    HA   ALA  18           HA       ALA  18   8.489  -5.128   4.336
  207   1HB   ALA  18          2HB       ALA  18   9.667  -5.192   6.518
  208   2HB   ALA  18          3HB       ALA  18   8.522  -6.432   7.082
  209   3HB   ALA  18          1HB       ALA  18   9.599  -6.776   5.719
  210    QB   ALA  18           QB       ALA  18   9.263  -6.134   6.440
  211    H    GLU  19           HN       GLU  19   6.153  -6.702   6.646
  212    HA   GLU  19           HA       GLU  19   5.515  -8.925   5.029
  213   1HB   GLU  19          2HB       GLU  19   4.021  -7.354   7.141
  214   2HB   GLU  19          3HB       GLU  19   3.213  -8.656   6.264
  215   1HG   GLU  19          2HG       GLU  19   5.896  -9.191   7.562
  216   2HG   GLU  19          3HG       GLU  19   4.392  -9.250   8.490
  217    QB   GLU  19           QB       GLU  19   3.617  -8.005   6.702
  218    QG   GLU  19           QG       GLU  19   5.143  -9.220   8.027
  219    H    LEU  20           HN       LEU  20   4.070  -5.674   5.095
  220    HA   LEU  20           HA       LEU  20   2.194  -6.185   3.030
  221   1HB   LEU  20          2HB       LEU  20   2.036  -4.302   4.440
  222   2HB   LEU  20          3HB       LEU  20   3.537  -3.598   3.848
  223    HG   LEU  20           HG       LEU  20   1.470  -4.277   1.777
  224   1HD1  LEU  20          3HD1      LEU  20   0.063  -3.320   3.569
  225   2HD1  LEU  20          1HD1      LEU  20   1.130  -1.906   3.668
  226   3HD1  LEU  20          2HD1      LEU  20   0.207  -2.225   2.180
  227   1HD2  LEU  20          1HD2      LEU  20   3.827  -3.062   1.590
  228   2HD2  LEU  20          2HD2      LEU  20   2.464  -2.475   0.650
  229   3HD2  LEU  20          3HD2      LEU  20   2.907  -1.648   2.147
  230    QB   LEU  20           QB       LEU  20   2.786  -3.950   4.144
  231    QD1  LEU  20           QD1      LEU  20   0.466  -2.483   3.139
  232    QD2  LEU  20           QD2      LEU  20   3.066  -2.395   1.463
  233    QQD  LEU  20           QQD      LEU  20   1.766  -2.439   2.301
  234    H    ALA  21           HN       ALA  21   5.641  -5.140   2.765
  235    HA   ALA  21           HA       ALA  21   5.737  -5.029  -0.045
  236   1HB   ALA  21          3HB       ALA  21   7.542  -4.418   1.852
  237   2HB   ALA  21          1HB       ALA  21   8.173  -6.014   1.395
  238   3HB   ALA  21          2HB       ALA  21   7.975  -4.752   0.170
  239    QB   ALA  21           QB       ALA  21   7.897  -5.061   1.139
  240    H    GLN  22           HN       GLN  22   6.313  -7.781   2.175
  241    HA   GLN  22           HA       GLN  22   7.021  -9.719   0.227
  242   1HB   GLN  22          2HB       GLN  22   5.769  -9.947   2.995
  243   2HB   GLN  22          3HB       GLN  22   6.039 -11.348   1.973
  244   1HG   GLN  22          2HG       GLN  22   8.165 -11.489   2.547
  245   2HG   GLN  22          3HG       GLN  22   8.483  -9.880   1.915
  246   1HE2  GLN  22          2HE2      GLN  22   7.778 -10.048   5.976
  247   2HE2  GLN  22          1HE2      GLN  22   6.613 -10.892   5.029
  248    QB   GLN  22           QB       GLN  22   5.904 -10.648   2.483
  249    QG   GLN  22           QG       GLN  22   8.325 -10.685   2.230
  250    QE2  GLN  22           QE2      GLN  22   7.195 -10.470   5.502
  251    H    LYS  23           HN       LYS  23   3.720  -9.171   1.659
  252    HA   LYS  23           HA       LYS  23   2.609 -10.981  -0.300
  253   1HB   LYS  23          2HB       LYS  23   0.374 -10.129   0.376
  254   2HB   LYS  23          3HB       LYS  23   1.358 -10.921   1.595
  255   1HG   LYS  23          2HG       LYS  23   1.834  -8.064   1.685
  256   2HG   LYS  23          3HG       LYS  23   0.108  -8.355   1.717
  257   1HD   LYS  23          2HD       LYS  23   2.008  -9.877   3.545
  258   2HD   LYS  23          3HD       LYS  23   1.410  -8.288   3.982
  259   1HE   LYS  23          2HE       LYS  23  -0.320 -10.764   3.515
  260   2HE   LYS  23          3HE       LYS  23   0.121 -10.040   5.053
  261   1HZ   LYS  23          1HZ       LYS  23  -0.992  -7.963   4.122
  262   2HZ   LYS  23          2HZ       LYS  23  -1.731  -8.949   3.038
  263   3HZ   LYS  23          3HZ       LYS  23  -1.944  -9.192   4.647
  264    QB   LYS  23           QB       LYS  23   0.866 -10.526   0.986
  265    QG   LYS  23           QG       LYS  23   0.971  -8.209   1.701
  266    QD   LYS  23           QD       LYS  23   1.709  -9.082   3.764
  267    QE   LYS  23           QE       LYS  23  -0.100 -10.402   4.284
  268    QZ   LYS  23           QZ       LYS  23  -1.556  -8.701   3.936
  269    H    VAL  24           HN       VAL  24   3.307  -7.522  -0.541
  270    HA   VAL  24           HA       VAL  24   1.855  -7.221  -3.048
  271    HB   VAL  24           HB       VAL  24   4.119  -5.656  -1.757
  272   1HG1  VAL  24          3HG1      VAL  24   2.471  -5.068  -4.244
  273   2HG1  VAL  24          1HG1      VAL  24   3.400  -3.832  -3.378
  274   3HG1  VAL  24          2HG1      VAL  24   4.243  -5.177  -4.160
  275   1HG2  VAL  24          3HG2      VAL  24   1.673  -5.707  -0.748
  276   2HG2  VAL  24          1HG2      VAL  24   2.455  -4.149  -1.085
  277   3HG2  VAL  24          2HG2      VAL  24   1.262  -4.830  -2.217
  278    QG1  VAL  24           QG1      VAL  24   3.371  -4.692  -3.927
  279    QG2  VAL  24           QG2      VAL  24   1.797  -4.895  -1.350
  280    QQG  VAL  24           QQG      VAL  24   2.584  -4.794  -2.639
  281    H    GLY  25           HN       GLY  25   5.033  -8.509  -2.136
  282   1HA   GLY  25          1HA       GLY  25   6.634  -9.547  -3.405
  283   2HA   GLY  25          2HA       GLY  25   5.622  -9.409  -4.854
  284    QA   GLY  25           QA       GLY  25   6.128  -9.478  -4.130
  285    H    THR  26           HN       THR  26   7.019  -7.061  -2.497
  286    HA   THR  26           HA       THR  26   8.865  -6.047  -4.520
  287    HB   THR  26           HB       THR  26   6.769  -4.718  -4.879
  288    HG1  THR  26          1HG       THR  26   8.750  -3.865  -5.418
  289   1HG2  THR  26          1HG2      THR  26   6.178  -4.623  -2.363
  290   2HG2  THR  26          2HG2      THR  26   7.362  -3.305  -2.260
  291   3HG2  THR  26          3HG2      THR  26   5.957  -3.149  -3.325
  292    QG2  THR  26           QG2      THR  26   6.499  -3.692  -2.650
  293    H    THR  27           HN       THR  27   9.566  -3.747  -3.070
  294    HA   THR  27           HA       THR  27  10.912  -5.043  -0.715
  295    HB   THR  27           HB       THR  27  12.757  -3.533  -1.102
  296    HG1  THR  27          1HG       THR  27  12.751  -2.051  -2.677
  297   1HG2  THR  27          2HG2      THR  27  12.713  -5.728  -2.272
  298   2HG2  THR  27          3HG2      THR  27  11.976  -4.959  -3.691
  299   3HG2  THR  27          1HG2      THR  27  13.614  -4.504  -3.185
  300    QG2  THR  27           QG2      THR  27  12.768  -5.064  -3.049
  301    H    GLN  28           HN       GLN  28  10.917  -4.017   1.242
  302    HA   GLN  28           HA       GLN  28   8.937  -2.282   2.027
  303   1HB   GLN  28          2HB       GLN  28  10.487  -3.575   3.532
  304   2HB   GLN  28          3HB       GLN  28  11.735  -2.368   3.192
  305   1HG   GLN  28          2HG       GLN  28   9.612  -0.749   3.987
  306   2HG   GLN  28          3HG       GLN  28   9.286  -2.214   4.905
  307   1HE2  GLN  28          2HE2      GLN  28  11.661  -1.172   7.316
  308   2HE2  GLN  28          1HE2      GLN  28  10.155  -2.008   6.975
  309    QB   GLN  28           QB       GLN  28  11.112  -2.971   3.363
  310    QG   GLN  28           QG       GLN  28   9.449  -1.482   4.446
  311    QE2  GLN  28           QE2      GLN  28  10.908  -1.591   7.146
  312    H    GLN  29           HN       GLN  29  12.213  -1.370   0.804
  313    HA   GLN  29           HA       GLN  29  12.004   1.378   1.203
  314   1HB   GLN  29          2HB       GLN  29  13.712  -0.378  -0.351
  315   2HB   GLN  29          3HB       GLN  29  13.183   0.926  -1.408
  316   1HG   GLN  29          2HG       GLN  29  13.835   2.466   0.677
  317   2HG   GLN  29          3HG       GLN  29  14.818   1.067   1.116
  318   1HE2  GLN  29          2HE2      GLN  29  15.929   3.578  -1.894
  319   2HE2  GLN  29          1HE2      GLN  29  14.481   3.841  -0.916
  320    QB   GLN  29           QB       GLN  29  13.448   0.274  -0.880
  321    QG   GLN  29           QG       GLN  29  14.326   1.767   0.896
  322    QE2  GLN  29           QE2      GLN  29  15.205   3.710  -1.405
  323    H    SER  30           HN       SER  30  10.657  -0.534  -1.532
  324    HA   SER  30           HA       SER  30   9.746   1.787  -3.001
  325   1HB   SER  30          2HB       SER  30   8.785  -1.113  -3.101
  326   2HB   SER  30          3HB       SER  30   8.308   0.215  -4.170
  327    HG   SER  30           HG       SER  30  10.869  -0.957  -3.893
  328    QB   SER  30           QB       SER  30   8.547  -0.449  -3.635
  329    H    ILE  31           HN       ILE  31   8.405  -0.286  -0.447
  330    HA   ILE  31           HA       ILE  31   5.757   0.836  -0.480
  331    HB   ILE  31           HB       ILE  31   7.278  -0.623   1.714
  332   1HG1  ILE  31          2HG1      ILE  31   7.113  -2.084  -0.173
  333   2HG1  ILE  31          3HG1      ILE  31   5.930  -2.567   1.016
  334   1HG2  ILE  31          1HG2      ILE  31   4.340   0.049   1.507
  335   2HG2  ILE  31          2HG2      ILE  31   5.083  -1.088   2.672
  336   3HG2  ILE  31          3HG2      ILE  31   5.512   0.623   2.698
  337   1HD1  ILE  31          2HD1      ILE  31   4.203  -1.227  -0.401
  338   2HD1  ILE  31          3HD1      ILE  31   5.471  -1.148  -1.640
  339   3HD1  ILE  31          1HD1      ILE  31   4.848  -2.716  -1.106
  340    QG1  ILE  31           QG1      ILE  31   6.521  -2.326   0.421
  341    QG2  ILE  31           QG2      ILE  31   4.978  -0.138   2.293
  342    QD1  ILE  31           QD1      ILE  31   4.840  -1.697  -1.049
  343    H    GLU  32           HN       GLU  32   8.542   1.532   1.735
  344    HA   GLU  32           HA       GLU  32   7.393   3.649   3.121
  345   1HB   GLU  32          2HB       GLU  32   9.651   2.597   3.574
  346   2HB   GLU  32          3HB       GLU  32  10.303   3.484   2.186
  347   1HG   GLU  32          2HG       GLU  32  10.844   4.769   4.128
  348   2HG   GLU  32          3HG       GLU  32   9.504   5.644   3.390
  349    QB   GLU  32           QB       GLU  32   9.977   3.040   2.879
  350    QG   GLU  32           QG       GLU  32  10.174   5.206   3.759
  351    H    GLN  33           HN       GLN  33   9.271   3.787   0.049
  352    HA   GLN  33           HA       GLN  33   8.877   6.580  -0.315
  353   1HB   GLN  33          2HB       GLN  33   9.538   4.351  -2.263
  354   2HB   GLN  33          3HB       GLN  33   9.304   6.028  -2.762
  355   1HG   GLN  33          2HG       GLN  33  11.381   6.534  -2.301
  356   2HG   GLN  33          3HG       GLN  33  11.064   6.283  -0.592
  357   1HE2  GLN  33          2HE2      GLN  33  12.959   3.255  -2.684
  358   2HE2  GLN  33          1HE2      GLN  33  11.682   4.148  -3.493
  359    QB   GLN  33           QB       GLN  33   9.421   5.190  -2.512
  360    QG   GLN  33           QG       GLN  33  11.223   6.408  -1.447
  361    QE2  GLN  33           QE2      GLN  33  12.321   3.702  -3.088
  362    H    LEU  34           HN       LEU  34   6.558   3.952  -0.711
  363    HA   LEU  34           HA       LEU  34   4.851   5.526  -2.462
  364   1HB   LEU  34          2HB       LEU  34   4.960   2.927  -2.252
  365   2HB   LEU  34          3HB       LEU  34   3.946   3.131  -0.824
  366    HG   LEU  34           HG       LEU  34   2.569   2.581  -2.671
  367   1HD1  LEU  34          1HD1      LEU  34   1.597   4.422  -1.260
  368   2HD1  LEU  34          2HD1      LEU  34   2.138   5.566  -2.531
  369   3HD1  LEU  34          3HD1      LEU  34   0.986   4.288  -2.923
  370   1HD2  LEU  34          3HD2      LEU  34   3.949   4.815  -4.237
  371   2HD2  LEU  34          1HD2      LEU  34   4.036   3.077  -4.523
  372   3HD2  LEU  34          2HD2      LEU  34   2.522   3.961  -4.781
  373    QB   LEU  34           QB       LEU  34   4.453   3.030  -1.539
  374    QD1  LEU  34           QD1      LEU  34   1.574   4.758  -2.238
  375    QD2  LEU  34           QD2      LEU  34   3.503   3.951  -4.514
  376    QQD  LEU  34           QQD      LEU  34   2.538   4.355  -3.376
  377    H    GLU  35           HN       GLU  35   4.974   4.575   0.968
  378    HA   GLU  35           HA       GLU  35   2.876   6.170   1.866
  379   1HB   GLU  35          2HB       GLU  35   5.404   5.141   3.147
  380   2HB   GLU  35          3HB       GLU  35   4.500   6.412   3.963
  381   1HG   GLU  35          2HG       GLU  35   3.696   4.410   4.869
  382   2HG   GLU  35          3HG       GLU  35   2.418   4.963   3.801
  383    QB   GLU  35           QB       GLU  35   4.953   5.777   3.555
  384    QG   GLU  35           QG       GLU  35   3.057   4.687   4.334
  385    H    ASN  36           HN       ASN  36   6.277   7.279   1.134
  386    HA   ASN  36           HA       ASN  36   5.429  10.017   1.747
  387   1HB   ASN  36          2HB       ASN  36   7.454  10.845   1.324
  388   2HB   ASN  36          3HB       ASN  36   7.771   9.255   2.012
  389   1HD2  ASN  36          2HD2      ASN  36  10.120   8.796  -0.571
  390   2HD2  ASN  36          1HD2      ASN  36   9.696   8.640   1.124
  391    QB   ASN  36           QB       ASN  36   7.612  10.050   1.668
  392    QD2  ASN  36           QD2      ASN  36   9.908   8.718   0.276
  393    H    GLY  37           HN       GLY  37   4.407   8.189  -0.752
  394   1HA   GLY  37          1HA       GLY  37   3.147   8.721  -2.555
  395   2HA   GLY  37          2HA       GLY  37   3.214  10.411  -2.054
  396    QA   GLY  37           QA       GLY  37   3.181   9.566  -2.306
  397    H    LYS  38           HN       LYS  38   5.895   8.186  -3.064
  398    HA   LYS  38           HA       LYS  38   6.976  10.158  -4.800
  399   1HB   LYS  38          2HB       LYS  38   8.579   8.574  -5.469
  400   2HB   LYS  38          3HB       LYS  38   8.319   8.411  -3.734
  401   1HG   LYS  38          2HG       LYS  38   7.445   6.302  -3.908
  402   2HG   LYS  38          3HG       LYS  38   6.646   6.563  -5.417
  403   1HD   LYS  38          2HD       LYS  38   9.676   6.577  -5.406
  404   2HD   LYS  38          3HD       LYS  38   8.860   5.042  -5.147
  405   1HE   LYS  38          2HE       LYS  38   8.382   4.782  -7.311
  406   2HE   LYS  38          3HE       LYS  38   7.551   6.337  -7.397
  407   1HZ   LYS  38          2HZ       LYS  38  10.452   6.011  -7.711
  408   2HZ   LYS  38          3HZ       LYS  38   9.363   6.193  -8.928
  409   3HZ   LYS  38          1HZ       LYS  38   9.588   7.412  -7.853
  410    QB   LYS  38           QB       LYS  38   8.449   8.492  -4.601
  411    QG   LYS  38           QG       LYS  38   7.046   6.433  -4.663
  412    QD   LYS  38           QD       LYS  38   9.268   5.809  -5.277
  413    QE   LYS  38           QE       LYS  38   7.966   5.560  -7.354
  414    QZ   LYS  38           QZ       LYS  38   9.802   6.539  -8.164
  415    H    THR  39           HN       THR  39   4.168   8.386  -5.537
  416    HA   THR  39           HA       THR  39   4.275   9.297  -8.252
  417    HB   THR  39           HB       THR  39   5.481   7.241  -8.554
  418    HG1  THR  39          1HG       THR  39   3.817   6.139  -9.930
  419   1HG2  THR  39          3HG2      THR  39   4.659   5.943  -6.573
  420   2HG2  THR  39          1HG2      THR  39   3.124   5.685  -7.423
  421   3HG2  THR  39          2HG2      THR  39   4.635   5.029  -8.087
  422    QG2  THR  39           QG2      THR  39   4.139   5.552  -7.361
  423    H    LYS  40           HN       LYS  40   2.239   8.829  -9.348
  424    HA   LYS  40           HA       LYS  40  -0.077   9.041  -7.537
  425   1HB   LYS  40          2HB       LYS  40  -1.350   9.649  -9.430
  426   2HB   LYS  40          3HB       LYS  40   0.164  10.558  -9.470
  427   1HG   LYS  40          2HG       LYS  40   1.011   8.867 -11.193
  428   2HG   LYS  40          3HG       LYS  40  -0.640   8.182 -11.197
  429   1HD   LYS  40          2HD       LYS  40  -1.423  10.625 -11.637
  430   2HD   LYS  40          3HD       LYS  40   0.250  10.952 -12.076
  431   1HE   LYS  40          2HE       LYS  40  -1.707   8.982 -13.373
  432   2HE   LYS  40          3HE       LYS  40  -1.070  10.477 -14.067
  433   1HZ   LYS  40          1HZ       LYS  40   1.153   9.408 -13.961
  434   2HZ   LYS  40          2HZ       LYS  40   0.414   7.989 -13.563
  435   3HZ   LYS  40          3HZ       LYS  40   0.099   8.705 -15.007
  436    QB   LYS  40           QB       LYS  40  -0.593  10.104  -9.450
  437    QG   LYS  40           QG       LYS  40   0.186   8.525 -11.196
  438    QD   LYS  40           QD       LYS  40  -0.587  10.789 -11.856
  439    QE   LYS  40           QE       LYS  40  -1.388   9.730 -13.720
  440    QZ   LYS  40           QZ       LYS  40   0.555   8.701 -14.177
  441    NH1  ARG  41           NH2      ARG  41  -5.090   4.525 -13.465
  442    NH2  ARG  41           NH1      ARG  41  -3.870   4.401 -15.423
  443    H    ARG  41           HN       ARG  41   1.200   6.809 -10.035
  444    HA   ARG  41           HA       ARG  41  -0.569   4.681  -9.009
  445   1HB   ARG  41          2HB       ARG  41  -1.741   5.665 -10.885
  446   2HB   ARG  41          3HB       ARG  41  -0.374   5.350 -11.966
  447   1HG   ARG  41          2HG       ARG  41  -0.729   3.001 -11.922
  448   2HG   ARG  41          3HG       ARG  41  -1.535   3.074 -10.360
  449   1HD   ARG  41          2HD       ARG  41  -3.242   2.541 -11.846
  450   2HD   ARG  41          3HD       ARG  41  -3.473   4.237 -11.403
  451    HE   ARG  41           HE       ARG  41  -1.993   3.680 -13.899
  452   1HH1  ARG  41          2HH2      ARG  41  -5.165   4.389 -12.469
  453   2HH1  ARG  41          1HH2      ARG  41  -5.914   4.828 -13.965
  454   1HH2  ARG  41          2HH1      ARG  41  -3.030   4.159 -15.929
  455   2HH2  ARG  41          1HH1      ARG  41  -4.679   4.684 -15.959
  456    QB   ARG  41           QB       ARG  41  -1.057   5.508 -11.425
  457    QG   ARG  41           QG       ARG  41  -1.132   3.038 -11.140
  458    QD   ARG  41           QD       ARG  41  -3.357   3.388 -11.625
  459    QH1  ARG  41           QH2      ARG  41  -5.539   4.608 -13.217
  460    QH2  ARG  41           QH1      ARG  41  -3.854   4.421 -15.944
  461    HA   PRO  42           HA       PRO  42   3.688   3.003  -9.619
  462   1HB   PRO  42          2HB       PRO  42   3.621   1.077  -7.680
  463   2HB   PRO  42          3HB       PRO  42   3.803   2.787  -7.258
  464   1HG   PRO  42          2HG       PRO  42   1.297   1.115  -7.270
  465   2HG   PRO  42          3HG       PRO  42   1.843   2.216  -5.994
  466   1HD   PRO  42          2HD       PRO  42   0.006   2.900  -7.982
  467   2HD   PRO  42          3HD       PRO  42   1.014   4.102  -7.173
  468    QB   PRO  42           QB       PRO  42   3.713   1.933  -7.468
  469    QG   PRO  42           QG       PRO  42   1.570   1.665  -6.632
  470    QD   PRO  42           QD       PRO  42   0.509   3.500  -7.577
  471    NH1  ARG  43           NH2      ARG  43   7.310   0.779  -8.929
  472    NH2  ARG  43           NH1      ARG  43   8.780  -0.212  -7.438
  473    H    ARG  43           HN       ARG  43   4.383   0.763 -10.059
  474    HA   ARG  43           HA       ARG  43   2.678  -0.670 -11.842
  475   1HB   ARG  43          2HB       ARG  43   4.546  -2.299 -11.905
  476   2HB   ARG  43          3HB       ARG  43   5.157  -0.643 -11.973
  477   1HG   ARG  43          2HG       ARG  43   5.339  -0.943  -9.315
  478   2HG   ARG  43          3HG       ARG  43   5.295  -2.654  -9.703
  479   1HD   ARG  43          2HD       ARG  43   7.325  -2.584 -10.884
  480   2HD   ARG  43          3HD       ARG  43   7.287  -0.848 -11.138
  481    HE   ARG  43           HE       ARG  43   8.395  -2.258  -8.891
  482   1HH1  ARG  43          2HH2      ARG  43   6.769   0.703  -9.776
  483   2HH1  ARG  43          1HH2      ARG  43   7.312   1.647  -8.418
  484   1HH2  ARG  43          2HH1      ARG  43   9.303  -1.011  -7.103
  485   2HH2  ARG  43          1HH1      ARG  43   8.893   0.650  -6.927
  486    QB   ARG  43           QB       ARG  43   4.851  -1.471 -11.939
  487    QG   ARG  43           QG       ARG  43   5.317  -1.798  -9.509
  488    QD   ARG  43           QD       ARG  43   7.306  -1.716 -11.012
  489    QH1  ARG  43           QH2      ARG  43   7.040   1.175  -9.097
  490    QH2  ARG  43           QH1      ARG  43   9.097  -0.181  -7.015
  491    H    PHE  44           HN       PHE  44   3.389  -1.105  -8.381
  492    HA   PHE  44           HA       PHE  44   1.969  -3.702  -8.425
  493   1HB   PHE  44          2HB       PHE  44   2.688  -3.744  -6.021
  494   2HB   PHE  44          3HB       PHE  44   3.954  -3.774  -7.219
  495    HD1  PHE  44          1HD       PHE  44   2.040  -1.240  -5.108
  496    HD2  PHE  44          2HD       PHE  44   5.841  -2.506  -6.705
  497    HE1  PHE  44          1HE       PHE  44   3.118   0.707  -4.073
  498    HE2  PHE  44          2HE       PHE  44   6.919  -0.596  -5.609
  499    HZ   PHE  44           HZ       PHE  44   5.564   1.062  -4.314
  500    QB   PHE  44           QB       PHE  44   3.321  -3.759  -6.620
  501    QR   PHE  44           QR       PHE  44   4.480  -0.909  -5.373
  502    H    LEU  45           HN       LEU  45   0.571  -0.984  -8.830
  503    HA   LEU  45           HA       LEU  45  -0.778  -0.411  -6.406
  504   1HB   LEU  45          2HB       LEU  45  -0.577   0.922  -8.601
  505   2HB   LEU  45          3HB       LEU  45  -2.023   0.110  -9.111
  506    HG   LEU  45           HG       LEU  45  -2.321   2.394  -8.174
  507   1HD1  LEU  45          3HD1      LEU  45  -4.080   0.708  -8.288
  508   2HD1  LEU  45          1HD1      LEU  45  -3.792   0.290  -6.582
  509   3HD1  LEU  45          2HD1      LEU  45  -4.342   1.924  -7.012
  510   1HD2  LEU  45          2HD2      LEU  45  -0.700   2.171  -6.134
  511   2HD2  LEU  45          3HD2      LEU  45  -2.266   2.946  -5.884
  512   3HD2  LEU  45          1HD2      LEU  45  -1.990   1.270  -5.385
  513    QB   LEU  45           QB       LEU  45  -1.300   0.516  -8.856
  514    QD1  LEU  45           QD1      LEU  45  -4.071   0.974  -7.294
  515    QD2  LEU  45           QD2      LEU  45  -1.652   2.128  -5.801
  516    QQD  LEU  45           QQD      LEU  45  -2.861   1.551  -6.547
  517    HA   PRO  46           HA       PRO  46  -4.278  -3.429  -7.717
  518   1HB   PRO  46          2HB       PRO  46  -3.403  -5.600  -9.317
  519   2HB   PRO  46          3HB       PRO  46  -4.491  -4.270  -9.786
  520   1HG   PRO  46          2HG       PRO  46  -1.701  -4.710 -10.558
  521   2HG   PRO  46          3HG       PRO  46  -2.876  -3.552 -11.229
  522   1HD   PRO  46          2HD       PRO  46  -0.693  -3.079  -9.453
  523   2HD   PRO  46          3HD       PRO  46  -1.840  -1.875 -10.070
  524    QB   PRO  46           QB       PRO  46  -3.948  -4.935  -9.552
  525    QG   PRO  46           QG       PRO  46  -2.289  -4.130 -10.893
  526    QD   PRO  46           QD       PRO  46  -1.267  -2.478  -9.762
  527    H    GLU  47           HN       GLU  47  -0.989  -4.939  -7.743
  528    HA   GLU  47           HA       GLU  47  -1.483  -7.073  -6.048
  529   1HB   GLU  47          2HB       GLU  47   0.980  -5.324  -6.398
  530   2HB   GLU  47          3HB       GLU  47   0.961  -6.781  -5.398
  531   1HG   GLU  47          2HG       GLU  47   1.867  -7.292  -7.589
  532   2HG   GLU  47          3HG       GLU  47   0.354  -8.164  -7.327
  533    QB   GLU  47           QB       GLU  47   0.971  -6.052  -5.897
  534    QG   GLU  47           QG       GLU  47   1.111  -7.727  -7.458
  535    H    LEU  48           HN       LEU  48  -0.576  -3.729  -5.095
  536    HA   LEU  48           HA       LEU  48  -0.690  -4.112  -2.262
  537   1HB   LEU  48          2HB       LEU  48   0.274  -2.190  -3.640
  538   2HB   LEU  48          3HB       LEU  48  -1.354  -1.607  -3.809
  539    HG   LEU  48           HG       LEU  48  -0.551  -0.300  -2.075
  540   1HD1  LEU  48          2HD1      LEU  48  -2.495  -1.466  -0.933
  541   2HD1  LEU  48          3HD1      LEU  48  -1.354  -2.694  -0.363
  542   3HD1  LEU  48          1HD1      LEU  48  -1.206  -1.013   0.163
  543   1HD2  LEU  48          2HD2      LEU  48   1.675  -1.482  -2.010
  544   2HD2  LEU  48          3HD2      LEU  48   1.082  -0.939  -0.430
  545   3HD2  LEU  48          1HD2      LEU  48   0.913  -2.644  -0.895
  546    QB   LEU  48           QB       LEU  48  -0.540  -1.899  -3.724
  547    QD1  LEU  48           QD1      LEU  48  -1.685  -1.725  -0.378
  548    QD2  LEU  48           QD2      LEU  48   1.224  -1.688  -1.112
  549    QQD  LEU  48           QQD      LEU  48  -0.231  -1.706  -0.744
  550    H    ALA  49           HN       ALA  49  -3.202  -3.091  -4.622
  551    HA   ALA  49           HA       ALA  49  -5.226  -2.665  -2.740
  552   1HB   ALA  49          2HB       ALA  49  -5.074  -2.496  -5.507
  553   2HB   ALA  49          3HB       ALA  49  -6.247  -3.797  -5.273
  554   3HB   ALA  49          1HB       ALA  49  -6.500  -2.214  -4.521
  555    QB   ALA  49           QB       ALA  49  -5.941  -2.835  -5.100
  556    H    SER  50           HN       SER  50  -4.590  -5.645  -4.601
  557    HA   SER  50           HA       SER  50  -6.410  -7.354  -3.233
  558   1HB   SER  50          2HB       SER  50  -3.822  -7.867  -4.746
  559   2HB   SER  50          3HB       SER  50  -4.816  -9.171  -4.065
  560    HG   SER  50           HG       SER  50  -5.797  -7.154  -5.816
  561    QB   SER  50           QB       SER  50  -4.320  -8.519  -4.405
  562    H    ALA  51           HN       ALA  51  -2.966  -6.616  -2.492
  563    HA   ALA  51           HA       ALA  51  -2.566  -8.477  -0.464
  564   1HB   ALA  51          2HB       ALA  51  -1.369  -5.697  -0.761
  565   2HB   ALA  51          3HB       ALA  51  -0.734  -6.965   0.275
  566   3HB   ALA  51          1HB       ALA  51  -0.746  -7.202  -1.478
  567    QB   ALA  51           QB       ALA  51  -0.950  -6.622  -0.655
  568    H    LEU  52           HN       LEU  52  -4.121  -5.297  -0.244
  569    HA   LEU  52           HA       LEU  52  -4.626  -5.690   2.663
  570   1HB   LEU  52          2HB       LEU  52  -4.654  -3.345   0.778
  571   2HB   LEU  52          3HB       LEU  52  -5.929  -3.384   1.964
  572    HG   LEU  52           HG       LEU  52  -4.499  -2.097   2.999
  573   1HD1  LEU  52          1HD1      LEU  52  -5.096  -4.184   4.390
  574   2HD1  LEU  52          2HD1      LEU  52  -3.407  -4.684   4.174
  575   3HD1  LEU  52          3HD1      LEU  52  -3.762  -3.163   4.991
  576   1HD2  LEU  52          2HD2      LEU  52  -2.622  -2.326   1.512
  577   2HD2  LEU  52          3HD2      LEU  52  -2.165  -2.207   3.218
  578   3HD2  LEU  52          1HD2      LEU  52  -2.092  -3.792   2.389
  579    QB   LEU  52           QB       LEU  52  -5.292  -3.364   1.371
  580    QD1  LEU  52           QD1      LEU  52  -4.089  -4.010   4.519
  581    QD2  LEU  52           QD2      LEU  52  -2.293  -2.775   2.373
  582    QQD  LEU  52           QQD      LEU  52  -3.191  -3.393   3.446
  583    H    GLY  53           HN       GLY  53  -6.176  -6.316  -0.317
  584   1HA   GLY  53          1HA       GLY  53  -8.246  -7.086  -0.837
  585   2HA   GLY  53          2HA       GLY  53  -8.656  -7.189   0.884
  586    QA   GLY  53           QA       GLY  53  -8.451  -7.137   0.023
  587    H    VAL  54           HN       VAL  54  -7.704  -4.537  -1.347
  588    HA   VAL  54           HA       VAL  54 -10.310  -3.176  -0.976
  589    HB   VAL  54           HB       VAL  54  -9.228  -1.010  -0.768
  590   1HG1  VAL  54          3HG1      VAL  54  -9.670  -2.392   1.318
  591   2HG1  VAL  54          1HG1      VAL  54  -7.956  -2.818   1.312
  592   3HG1  VAL  54          2HG1      VAL  54  -8.446  -1.121   1.487
  593   1HG2  VAL  54          2HG2      VAL  54  -6.622  -2.583  -0.918
  594   2HG2  VAL  54          3HG2      VAL  54  -7.174  -1.274  -1.992
  595   3HG2  VAL  54          1HG2      VAL  54  -6.702  -0.940  -0.320
  596    QG1  VAL  54           QG1      VAL  54  -8.690  -2.110   1.373
  597    QG2  VAL  54           QG2      VAL  54  -6.832  -1.599  -1.077
  598    QQG  VAL  54           QQG      VAL  54  -7.761  -1.855   0.148
  599    H    SER  55           HN       SER  55 -10.519  -1.430  -2.801
  600    HA   SER  55           HA       SER  55  -9.777  -2.728  -5.311
  601   1HB   SER  55          2HB       SER  55 -11.326  -0.804  -6.125
  602   2HB   SER  55          3HB       SER  55 -12.028  -2.104  -5.145
  603    HG   SER  55           HG       SER  55 -12.696  -0.186  -4.235
  604    QB   SER  55           QB       SER  55 -11.676  -1.454  -5.635
  605    H    VAL  56           HN       VAL  56  -8.630  -1.742  -6.936
  606    HA   VAL  56           HA       VAL  56  -6.429  -0.049  -6.459
  607    HB   VAL  56           HB       VAL  56  -8.094  -0.844  -8.875
  608   1HG1  VAL  56          2HG1      VAL  56  -6.015   1.349  -8.899
  609   2HG1  VAL  56          3HG1      VAL  56  -6.348   0.327 -10.313
  610   3HG1  VAL  56          1HG1      VAL  56  -7.632   1.315  -9.604
  611   1HG2  VAL  56          3HG2      VAL  56  -5.187  -1.248  -8.056
  612   2HG2  VAL  56          1HG2      VAL  56  -6.491  -2.444  -7.978
  613   3HG2  VAL  56          2HG2      VAL  56  -5.917  -1.859  -9.550
  614    QG1  VAL  56           QG1      VAL  56  -6.665   0.997  -9.605
  615    QG2  VAL  56           QG2      VAL  56  -5.866  -1.851  -8.528
  616    QQG  VAL  56           QQG      VAL  56  -6.266  -0.427  -9.067
  617    H    ASP  57           HN       ASP  57  -9.777   0.852  -7.511
  618    HA   ASP  57           HA       ASP  57  -9.484   3.564  -7.759
  619   1HB   ASP  57          2HB       ASP  57 -11.844   2.167  -6.454
  620   2HB   ASP  57          3HB       ASP  57 -11.851   3.671  -7.394
  621    QB   ASP  57           QB       ASP  57 -11.847   2.919  -6.925
  622    CH2  TRP  58           CH2      TRP  58  -7.193   1.794   2.560
  623    H    TRP  58           HN       TRP  58  -9.641   1.755  -4.642
  624    HA   TRP  58           HA       TRP  58  -9.954   4.250  -3.185
  625   1HB   TRP  58          2HB       TRP  58 -11.026   2.341  -2.278
  626   2HB   TRP  58          3HB       TRP  58  -9.511   1.444  -2.210
  627    HD1  TRP  58           HD1      TRP  58 -11.380   4.304  -0.292
  628    HE1  TRP  58           HE1      TRP  58 -10.438   4.608   1.898
  629    HE3  TRP  58           HE3      TRP  58  -7.353   1.188  -0.798
  630    HZ2  TRP  58           HZ2      TRP  58  -8.530   3.099   3.648
  631    HZ3  TRP  58           HZ3      TRP  58  -5.914   0.744   1.189
  632    HH2  TRP  58           HH2      TRP  58  -6.526   1.636   3.390
  633    QB   TRP  58           QB       TRP  58 -10.268   1.893  -2.243
  634    H    LEU  59           HN       LEU  59  -7.382   1.979  -3.979
  635    HA   LEU  59           HA       LEU  59  -5.308   3.227  -2.421
  636   1HB   LEU  59          2HB       LEU  59  -5.568   1.136  -4.536
  637   2HB   LEU  59          3HB       LEU  59  -4.037   1.973  -4.547
  638    HG   LEU  59           HG       LEU  59  -5.261   0.429  -2.232
  639   1HD1  LEU  59          2HD1      LEU  59  -4.113  -0.640  -4.287
  640   2HD1  LEU  59          3HD1      LEU  59  -2.627   0.132  -3.685
  641   3HD1  LEU  59          1HD1      LEU  59  -3.487  -1.055  -2.692
  642   1HD2  LEU  59          2HD2      LEU  59  -2.889   2.339  -2.278
  643   2HD2  LEU  59          3HD2      LEU  59  -4.095   2.091  -0.989
  644   3HD2  LEU  59          1HD2      LEU  59  -2.842   0.887  -1.265
  645    QB   LEU  59           QB       LEU  59  -4.802   1.554  -4.542
  646    QD1  LEU  59           QD1      LEU  59  -3.409  -0.521  -3.554
  647    QD2  LEU  59           QD2      LEU  59  -3.275   1.772  -1.511
  648    QQD  LEU  59           QQD      LEU  59  -3.342   0.625  -2.533
  649    H    LEU  60           HN       LEU  60  -6.506   3.710  -5.682
  650    HA   LEU  60           HA       LEU  60  -4.925   6.058  -6.155
  651   1HB   LEU  60          2HB       LEU  60  -7.623   5.254  -7.256
  652   2HB   LEU  60          3HB       LEU  60  -6.695   6.676  -7.771
  653    HG   LEU  60           HG       LEU  60  -5.543   3.857  -7.881
  654   1HD1  LEU  60          3HD1      LEU  60  -6.973   5.410 -10.065
  655   2HD1  LEU  60          1HD1      LEU  60  -6.095   3.877 -10.279
  656   3HD1  LEU  60          2HD1      LEU  60  -7.549   3.931  -9.270
  657   1HD2  LEU  60          1HD2      LEU  60  -3.913   5.855  -7.977
  658   2HD2  LEU  60          2HD2      LEU  60  -3.896   4.762  -9.337
  659   3HD2  LEU  60          3HD2      LEU  60  -4.734   6.325  -9.472
  660    QB   LEU  60           QB       LEU  60  -7.159   5.965  -7.514
  661    QD1  LEU  60           QD1      LEU  60  -6.872   4.406  -9.872
  662    QD2  LEU  60           QD2      LEU  60  -4.181   5.647  -8.929
  663    QQD  LEU  60           QQD      LEU  60  -5.527   5.026  -9.400
  664    H    ASN  61           HN       ASN  61  -8.481   6.085  -4.936
  665    HA   ASN  61           HA       ASN  61  -7.451   8.104  -3.038
  666   1HB   ASN  61          2HB       ASN  61  -9.288   9.645  -4.683
  667   2HB   ASN  61          3HB       ASN  61  -7.631   9.952  -4.202
  668   1HD2  ASN  61          2HD2      ASN  61  -8.437   8.268  -7.896
  669   2HD2  ASN  61          1HD2      ASN  61  -9.491   7.854  -6.559
  670    QB   ASN  61           QB       ASN  61  -8.459   9.799  -4.443
  671    QD2  ASN  61           QD2      ASN  61  -8.964   8.061  -7.228
  672    H    GLY  62           HN       GLY  62  -9.056   5.844  -2.428
  673   1HA   GLY  62          1HA       GLY  62 -11.720   6.960  -2.339
  674   2HA   GLY  62          2HA       GLY  62 -11.384   5.366  -2.011
  675    QA   GLY  62           QA       GLY  62 -11.552   6.162  -2.175
  676    H    THR  63           HN       THR  63  -9.365   7.027  -0.142
  677    HA   THR  63           HA       THR  63  -9.198   7.272   2.014
  678    HB   THR  63           HB       THR  63  -9.657   9.455   2.642
  679    HG1  THR  63          1HG       THR  63 -11.068  10.412   0.573
  680   1HG2  THR  63          1HG2      THR  63  -8.061   8.882   0.674
  681   2HG2  THR  63          2HG2      THR  63  -9.349   9.403  -0.416
  682   3HG2  THR  63          3HG2      THR  63  -8.595  10.572   0.679
  683    QG2  THR  63           QG2      THR  63  -8.668   9.618   0.313
  684    H    SER  64           HN       SER  64 -11.952   6.287   1.781
  685    HA   SER  64           HA       SER  64 -11.645   4.856   4.228
  686   1HB   SER  64          2HB       SER  64 -12.707   7.319   4.839
  687   2HB   SER  64          3HB       SER  64 -14.177   6.374   4.611
  688    HG   SER  64           HG       SER  64 -13.208   6.312   6.779
  689    QB   SER  64           QB       SER  64 -13.442   6.846   4.724
  690    H    ASP  65           HN       ASP  65 -12.661   2.948   3.993
  691    HA   ASP  65           HA       ASP  65 -13.858   1.254   3.229
  692   1HB   ASP  65          2HB       ASP  65 -15.860   2.699   3.758
  693   2HB   ASP  65          3HB       ASP  65 -15.934   3.110   2.037
  694    QB   ASP  65           QB       ASP  65 -15.897   2.904   2.897
  695    H    SER  66           HN       SER  66 -14.278   0.069   1.239
  696    HA   SER  66           HA       SER  66 -11.981   0.632  -0.555
  697   1HB   SER  66          2HB       SER  66 -13.835  -1.756  -0.236
  698   2HB   SER  66          3HB       SER  66 -12.452  -1.700  -1.342
  699    HG   SER  66           HG       SER  66 -12.087  -0.971   1.345
  700    QB   SER  66           QB       SER  66 -13.144  -1.728  -0.789
  701    H    ASN  67           HN       ASN  67 -13.353   2.546  -1.267
  702    HA   ASN  67           HA       ASN  67 -14.103   3.631  -3.126
  703   1HB   ASN  67          2HB       ASN  67 -13.230   1.898  -4.616
  704   2HB   ASN  67          3HB       ASN  67 -14.713   0.947  -4.439
  705   1HD2  ASN  67          2HD2      ASN  67 -14.804   4.328  -6.743
  706   2HD2  ASN  67          1HD2      ASN  67 -13.506   4.142  -5.576
  707    QB   ASN  67           QB       ASN  67 -13.971   1.422  -4.528
  708    QD2  ASN  67           QD2      ASN  67 -14.155   4.234  -6.159
  709    H    VAL  68           HN       VAL  68 -15.514   4.228  -1.351
  710    HA   VAL  68           HA       VAL  68 -18.128   3.140  -1.056
  711    HB   VAL  68           HB       VAL  68 -16.906   4.632   0.547
  712   1HG1  VAL  68          3HG1      VAL  68 -16.104   6.363  -1.053
  713   2HG1  VAL  68          1HG1      VAL  68 -17.778   6.914  -1.278
  714   3HG1  VAL  68          2HG1      VAL  68 -17.002   7.050   0.309
  715   1HG2  VAL  68          1HG2      VAL  68 -19.350   4.167   0.722
  716   2HG2  VAL  68          2HG2      VAL  68 -18.849   5.712   1.424
  717   3HG2  VAL  68          3HG2      VAL  68 -19.671   5.689  -0.142
  718    QG1  VAL  68           QG1      VAL  68 -16.961   6.776  -0.674
  719    QG2  VAL  68           QG2      VAL  68 -19.290   5.189   0.668
  720    QQG  VAL  68           QQG      VAL  68 -18.126   5.982  -0.003
  721    NH1  ARG  69           NH2      ARG  69 -22.782   1.364  -8.208
  722    NH2  ARG  69           NH1      ARG  69 -24.672   2.614  -7.713
  723    H    ARG  69           HN       ARG  69 -20.237   4.349  -1.740
  724    HA   ARG  69           HA       ARG  69 -20.138   5.926  -4.112
  725   1HB   ARG  69          2HB       ARG  69 -19.844   3.180  -4.582
  726   2HB   ARG  69          3HB       ARG  69 -21.597   3.358  -4.553
  727   1HG   ARG  69          2HG       ARG  69 -21.174   5.376  -6.199
  728   2HG   ARG  69          3HG       ARG  69 -19.540   4.697  -6.344
  729   1HD   ARG  69          2HD       ARG  69 -20.801   3.722  -8.124
  730   2HD   ARG  69          3HD       ARG  69 -20.653   2.463  -6.873
  731    HE   ARG  69           HE       ARG  69 -23.016   4.116  -6.530
  732   1HH1  ARG  69          2HH2      ARG  69 -21.783   1.247  -8.140
  733   2HH1  ARG  69          1HH2      ARG  69 -23.329   0.640  -8.648
  734   1HH2  ARG  69          2HH1      ARG  69 -25.092   3.443  -7.314
  735   2HH2  ARG  69          1HH1      ARG  69 -25.271   1.943  -8.168
  736    QB   ARG  69           QB       ARG  69 -20.721   3.269  -4.567
  737    QG   ARG  69           QG       ARG  69 -20.357   5.037  -6.272
  738    QD   ARG  69           QD       ARG  69 -20.728   3.092  -7.498
  739    QH1  ARG  69           QH2      ARG  69 -22.556   0.944  -8.394
  740    QH2  ARG  69           QH1      ARG  69 -25.182   2.693  -7.742
   
  Start of MODEL          12
 Raw file had 740 H/Q atoms
  Start of MODEL   12
    1    H    SER   1           HN       SER   1  -5.186  11.518   3.316
    2    HA   SER   1           HA       SER   1  -3.629  11.660   1.617
    3   1HB   SER   1          2HB       SER   1  -1.692  10.733   3.822
    4   2HB   SER   1          3HB       SER   1  -1.180  11.134   2.165
    5    HG   SER   1           HG       SER   1  -1.445  13.191   2.628
    6    QB   SER   1           QB       SER   1  -1.436  10.934   2.993
    7    H    ILE   2           HN       ILE   2  -2.197   9.976   0.395
    8    HA   ILE   2           HA       ILE   2  -2.908   7.283   0.463
    9    HB   ILE   2           HB       ILE   2  -1.884   8.187  -1.391
   10   1HG1  ILE   2          2HG1      ILE   2  -1.669   5.838  -1.178
   11   2HG1  ILE   2          3HG1      ILE   2  -0.300   6.535  -2.022
   12   1HG2  ILE   2          1HG2      ILE   2   0.173   9.284   0.346
   13   2HG2  ILE   2          2HG2      ILE   2   0.851   8.439  -1.057
   14   3HG2  ILE   2          3HG2      ILE   2  -0.342   9.725  -1.277
   15   1HD1  ILE   2          2HD1      ILE   2   1.050   6.278   0.134
   16   2HD1  ILE   2          3HD1      ILE   2  -0.298   5.291   0.756
   17   3HD1  ILE   2          1HD1      ILE   2   0.523   4.774  -0.669
   18    QG1  ILE   2           QG1      ILE   2  -0.984   6.187  -1.600
   19    QG2  ILE   2           QG2      ILE   2   0.227   9.149  -0.663
   20    QD1  ILE   2           QD1      ILE   2   0.425   5.448   0.074
   21    H    SER   3           HN       SER   3   0.246   8.466   2.080
   22    HA   SER   3           HA       SER   3   0.866   6.097   3.211
   23   1HB   SER   3          2HB       SER   3   2.335   7.893   3.668
   24   2HB   SER   3          3HB       SER   3   1.095   8.856   4.509
   25    HG   SER   3           HG       SER   3   2.251   6.387   5.350
   26    QB   SER   3           QB       SER   3   1.714   8.375   4.089
   27    H    SER   4           HN       SER   4  -1.360   8.379   4.804
   28    HA   SER   4           HA       SER   4  -1.995   6.923   7.032
   29   1HB   SER   4          2HB       SER   4  -2.766   9.287   6.342
   30   2HB   SER   4          3HB       SER   4  -4.136   8.464   5.545
   31    HG   SER   4           HG       SER   4  -4.412   7.443   7.717
   32    QB   SER   4           QB       SER   4  -3.451   8.876   5.943
   33    NH1  ARG   5           NH2      ARG   5  -5.079   4.587  -0.519
   34    NH2  ARG   5           NH1      ARG   5  -4.515   6.345  -1.924
   35    H    ARG   5           HN       ARG   5  -3.297   6.256   3.748
   36    HA   ARG   5           HA       ARG   5  -5.520   4.624   4.785
   37   1HB   ARG   5          2HB       ARG   5  -4.479   4.433   1.974
   38   2HB   ARG   5          3HB       ARG   5  -6.113   4.255   2.615
   39   1HG   ARG   5          2HG       ARG   5  -5.934   6.755   3.251
   40   2HG   ARG   5          3HG       ARG   5  -4.579   6.722   2.084
   41   1HD   ARG   5          2HD       ARG   5  -7.196   5.607   1.164
   42   2HD   ARG   5          3HD       ARG   5  -7.095   7.336   1.455
   43    HE   ARG   5           HE       ARG   5  -6.008   7.641  -0.476
   44   1HH1  ARG   5          2HH2      ARG   5  -5.656   4.241   0.234
   45   2HH1  ARG   5          1HH2      ARG   5  -4.483   3.952  -1.026
   46   1HH2  ARG   5          2HH1      ARG   5  -4.545   7.324  -2.163
   47   2HH2  ARG   5          1HH1      ARG   5  -4.204   5.710  -2.662
   48    QB   ARG   5           QB       ARG   5  -5.297   4.344   2.294
   49    QG   ARG   5           QG       ARG   5  -5.256   6.738   2.668
   50    QD   ARG   5           QD       ARG   5  -7.145   6.471   1.310
   51    QH1  ARG   5           QH2      ARG   5  -5.069   4.097  -0.396
   52    QH2  ARG   5           QH1      ARG   5  -4.374   6.517  -2.412
   53    H    VAL   6           HN       VAL   6  -2.363   4.087   3.218
   54    HA   VAL   6           HA       VAL   6  -2.659   1.200   3.190
   55    HB   VAL   6           HB       VAL   6  -0.317   3.083   2.760
   56   1HG1  VAL   6          2HG1      VAL   6  -0.468   0.060   2.323
   57   2HG1  VAL   6          3HG1      VAL   6   0.882   1.124   1.844
   58   3HG1  VAL   6          1HG1      VAL   6   0.462   0.927   3.556
   59   1HG2  VAL   6          1HG2      VAL   6  -2.037   1.457   0.843
   60   2HG2  VAL   6          2HG2      VAL   6  -2.011   3.227   0.991
   61   3HG2  VAL   6          3HG2      VAL   6  -0.585   2.367   0.386
   62    QG1  VAL   6           QG1      VAL   6   0.292   0.704   2.574
   63    QG2  VAL   6           QG2      VAL   6  -1.544   2.350   0.740
   64    QQG  VAL   6           QQG      VAL   6  -0.626   1.527   1.657
   65    H    LYS   7           HN       LYS   7  -0.980   3.570   5.263
   66    HA   LYS   7           HA       LYS   7   0.113   1.880   7.199
   67   1HB   LYS   7          2HB       LYS   7   0.500   4.333   6.840
   68   2HB   LYS   7          3HB       LYS   7  -1.084   4.645   7.546
   69   1HG   LYS   7          2HG       LYS   7   0.339   5.099   9.260
   70   2HG   LYS   7          3HG       LYS   7  -0.159   3.444   9.664
   71   1HD   LYS   7          2HD       LYS   7   2.010   2.589   8.796
   72   2HD   LYS   7          3HD       LYS   7   2.382   4.167   8.108
   73   1HE   LYS   7          2HE       LYS   7   3.697   3.922  10.102
   74   2HE   LYS   7          3HE       LYS   7   2.505   5.198  10.355
   75   1HZ   LYS   7          1HZ       LYS   7   1.476   2.723  11.190
   76   2HZ   LYS   7          2HZ       LYS   7   2.932   2.972  11.905
   77   3HZ   LYS   7          3HZ       LYS   7   1.738   4.084  12.081
   78    QB   LYS   7           QB       LYS   7  -0.292   4.489   7.192
   79    QG   LYS   7           QG       LYS   7   0.090   4.271   9.462
   80    QD   LYS   7           QD       LYS   7   2.196   3.377   8.452
   81    QE   LYS   7           QE       LYS   7   3.101   4.559  10.228
   82    QZ   LYS   7           QZ       LYS   7   2.048   3.259  11.726
   83    H    SER   8           HN       SER   8  -3.200   3.505   7.284
   84    HA   SER   8           HA       SER   8  -3.889   2.424   9.798
   85   1HB   SER   8          2HB       SER   8  -6.199   2.914   9.223
   86   2HB   SER   8          3HB       SER   8  -5.132   4.247   8.719
   87    HG   SER   8           HG       SER   8  -6.563   3.747   7.047
   88    QB   SER   8           QB       SER   8  -5.666   3.580   8.971
   89    H    LYS   9           HN       LYS   9  -4.272   1.041   6.500
   90    HA   LYS   9           HA       LYS   9  -5.678  -1.222   7.429
   91   1HB   LYS   9          2HB       LYS   9  -5.623  -0.196   5.111
   92   2HB   LYS   9          3HB       LYS   9  -4.034  -0.941   4.889
   93   1HG   LYS   9          2HG       LYS   9  -5.793  -2.296   3.898
   94   2HG   LYS   9          3HG       LYS   9  -5.028  -3.136   5.282
   95   1HD   LYS   9          2HD       LYS   9  -6.863  -3.356   6.401
   96   2HD   LYS   9          3HD       LYS   9  -7.412  -1.687   6.138
   97   1HE   LYS   9          2HE       LYS   9  -7.635  -3.791   3.942
   98   2HE   LYS   9          3HE       LYS   9  -8.816  -3.724   5.252
   99   1HZ   LYS   9          1HZ       LYS   9  -8.188  -1.442   3.520
  100   2HZ   LYS   9          2HZ       LYS   9  -9.501  -2.427   3.371
  101   3HZ   LYS   9          3HZ       LYS   9  -9.323  -1.488   4.711
  102    QB   LYS   9           QB       LYS   9  -4.829  -0.569   5.000
  103    QG   LYS   9           QG       LYS   9  -5.411  -2.716   4.590
  104    QD   LYS   9           QD       LYS   9  -7.138  -2.522   6.270
  105    QE   LYS   9           QE       LYS   9  -8.225  -3.757   4.597
  106    QZ   LYS   9           QZ       LYS   9  -9.003  -1.786   3.868
  107    NH1  ARG  10           NH2      ARG  10   2.153  -0.996   3.628
  108    NH2  ARG  10           NH1      ARG  10   2.848   1.032   4.486
  109    H    ARG  10           HN       ARG  10  -2.201  -0.599   6.869
  110    HA   ARG  10           HA       ARG  10  -1.102  -3.079   7.569
  111   1HB   ARG  10          2HB       ARG  10  -0.084  -0.554   7.057
  112   2HB   ARG  10          3HB       ARG  10   0.115  -0.588   8.797
  113   1HG   ARG  10          2HG       ARG  10   2.100  -1.566   8.414
  114   2HG   ARG  10          3HG       ARG  10   1.169  -3.033   8.089
  115   1HD   ARG  10          2HD       ARG  10   2.524  -2.797   6.197
  116   2HD   ARG  10          3HD       ARG  10   0.934  -2.207   5.718
  117    HE   ARG  10           HE       ARG  10   2.880  -0.159   6.645
  118   1HH1  ARG  10          2HH2      ARG  10   1.793  -1.925   3.776
  119   2HH1  ARG  10          1HH2      ARG  10   2.268  -0.654   2.686
  120   1HH2  ARG  10          2HH1      ARG  10   3.051   1.611   5.294
  121   2HH2  ARG  10          1HH1      ARG  10   2.555   1.610   3.689
  122    QB   ARG  10           QB       ARG  10   0.016  -0.571   7.928
  123    QG   ARG  10           QG       ARG  10   1.634  -2.299   8.251
  124    QD   ARG  10           QD       ARG  10   1.728  -2.502   5.957
  125    QH1  ARG  10           QH2      ARG  10   2.030  -1.290   3.231
  126    QH2  ARG  10           QH1      ARG  10   2.803   1.611   4.491
  127    H    ILE  11           HN       ILE  11  -2.054  -0.388   9.784
  128    HA   ILE  11           HA       ILE  11  -1.513  -1.761  12.217
  129    HB   ILE  11           HB       ILE  11  -3.411   0.518  11.577
  130   1HG1  ILE  11          2HG1      ILE  11  -1.922   1.517  13.426
  131   2HG1  ILE  11          3HG1      ILE  11  -0.831   0.174  13.154
  132   1HG2  ILE  11          1HG2      ILE  11  -3.043  -0.844  14.276
  133   2HG2  ILE  11          2HG2      ILE  11  -3.849   0.723  14.022
  134   3HG2  ILE  11          3HG2      ILE  11  -4.573  -0.730  13.361
  135   1HD1  ILE  11          1HD1      ILE  11  -1.728   2.218  11.077
  136   2HD1  ILE  11          2HD1      ILE  11  -0.240   2.309  12.041
  137   3HD1  ILE  11          3HD1      ILE  11  -0.436   0.982  10.864
  138    QG1  ILE  11           QG1      ILE  11  -1.376   0.845  13.290
  139    QG2  ILE  11           QG2      ILE  11  -3.821  -0.284  13.886
  140    QD1  ILE  11           QD1      ILE  11  -0.801   1.837  11.327
  141    H    GLN  12           HN       GLN  12  -4.704  -1.447  10.554
  142    HA   GLN  12           HA       GLN  12  -5.949  -3.163  12.390
  143   1HB   GLN  12          2HB       GLN  12  -7.850  -3.180  11.189
  144   2HB   GLN  12          3HB       GLN  12  -7.081  -1.718  10.567
  145   1HG   GLN  12          2HG       GLN  12  -6.387  -2.973   8.565
  146   2HG   GLN  12          3HG       GLN  12  -7.089  -4.461   9.199
  147   1HE2  GLN  12          2HE2      GLN  12 -10.311  -3.785   7.998
  148   2HE2  GLN  12          1HE2      GLN  12  -9.183  -4.948   8.660
  149    QB   GLN  12           QB       GLN  12  -7.465  -2.449  10.878
  150    QG   GLN  12           QG       GLN  12  -6.738  -3.717   8.882
  151    QE2  GLN  12           QE2      GLN  12  -9.746  -4.367   8.329
  152    H    LEU  13           HN       LEU  13  -4.171  -4.096   9.461
  153    HA   LEU  13           HA       LEU  13  -4.594  -6.939   9.706
  154   1HB   LEU  13          2HB       LEU  13  -2.605  -5.122   8.328
  155   2HB   LEU  13          3HB       LEU  13  -2.243  -6.834   8.475
  156    HG   LEU  13           HG       LEU  13  -4.989  -6.115   7.492
  157   1HD1  LEU  13          2HD1      LEU  13  -3.442  -4.669   6.147
  158   2HD1  LEU  13          3HD1      LEU  13  -2.550  -6.128   5.660
  159   3HD1  LEU  13          1HD1      LEU  13  -4.264  -5.939   5.209
  160   1HD2  LEU  13          3HD2      LEU  13  -4.197  -8.479   7.940
  161   2HD2  LEU  13          1HD2      LEU  13  -4.665  -8.204   6.246
  162   3HD2  LEU  13          2HD2      LEU  13  -2.950  -8.248   6.700
  163    QB   LEU  13           QB       LEU  13  -2.425  -5.979   8.402
  164    QD1  LEU  13           QD1      LEU  13  -3.418  -5.579   5.672
  165    QD2  LEU  13           QD2      LEU  13  -3.937  -8.310   6.962
  166    QQD  LEU  13           QQD      LEU  13  -3.678  -6.944   6.317
  167    H    GLY  14           HN       GLY  14  -2.338  -4.693  11.290
  168   1HA   GLY  14          1HA       GLY  14  -1.123  -5.010  13.209
  169   2HA   GLY  14          2HA       GLY  14  -1.703  -6.678  13.318
  170    QA   GLY  14           QA       GLY  14  -1.413  -5.844  13.264
  171    H    LEU  15           HN       LEU  15   0.050  -4.949  10.707
  172    HA   LEU  15           HA       LEU  15   2.384  -6.809  10.971
  173   1HB   LEU  15          2HB       LEU  15   0.874  -6.025   8.454
  174   2HB   LEU  15          3HB       LEU  15   2.382  -6.934   8.469
  175    HG   LEU  15           HG       LEU  15  -0.128  -7.982   9.844
  176   1HD1  LEU  15          3HD1      LEU  15  -0.502  -7.495   7.376
  177   2HD1  LEU  15          1HD1      LEU  15   0.813  -8.607   7.022
  178   3HD1  LEU  15          2HD1      LEU  15  -0.667  -9.194   7.845
  179   1HD2  LEU  15          2HD2      LEU  15   2.128  -9.072  10.381
  180   2HD2  LEU  15          3HD2      LEU  15   0.939 -10.151   9.635
  181   3HD2  LEU  15          1HD2      LEU  15   2.246  -9.477   8.664
  182    QB   LEU  15           QB       LEU  15   1.628  -6.480   8.462
  183    QD1  LEU  15           QD1      LEU  15  -0.118  -8.432   7.414
  184    QD2  LEU  15           QD2      LEU  15   1.771  -9.567   9.560
  185    QQD  LEU  15           QQD      LEU  15   0.826  -8.999   8.487
  186    H    ASN  16           HN       ASN  16   4.294  -5.906   9.699
  187    HA   ASN  16           HA       ASN  16   4.395  -2.949  10.012
  188   1HB   ASN  16          2HB       ASN  16   6.771  -3.116  10.017
  189   2HB   ASN  16          3HB       ASN  16   6.120  -4.237  11.214
  190   1HD2  ASN  16          2HD2      ASN  16   8.798  -6.063   9.414
  191   2HD2  ASN  16          1HD2      ASN  16   8.713  -4.696  10.507
  192    QB   ASN  16           QB       ASN  16   6.446  -3.676  10.616
  193    QD2  ASN  16           QD2      ASN  16   8.756  -5.380   9.961
  194    H    GLN  17           HN       GLN  17   6.031  -1.971   8.338
  195    HA   GLN  17           HA       GLN  17   4.517  -1.999   5.939
  196   1HB   GLN  17          2HB       GLN  17   7.147  -0.654   6.443
  197   2HB   GLN  17          3HB       GLN  17   5.989  -0.233   5.193
  198   1HG   GLN  17          2HG       GLN  17   4.611  -0.113   7.705
  199   2HG   GLN  17          3HG       GLN  17   6.195   0.595   7.971
  200   1HE2  GLN  17          2HE2      GLN  17   5.517   3.311   5.552
  201   2HE2  GLN  17          1HE2      GLN  17   6.812   2.174   5.849
  202    QB   GLN  17           QB       GLN  17   6.568  -0.444   5.818
  203    QG   GLN  17           QG       GLN  17   5.403   0.241   7.838
  204    QE2  GLN  17           QE2      GLN  17   6.164   2.742   5.701
  205    H    ALA  18           HN       ALA  18   7.670  -3.363   6.692
  206    HA   ALA  18           HA       ALA  18   8.351  -4.523   4.265
  207   1HB   ALA  18          2HB       ALA  18   8.922  -5.187   7.144
  208   2HB   ALA  18          3HB       ALA  18   9.570  -6.193   5.827
  209   3HB   ALA  18          1HB       ALA  18   9.980  -4.465   5.915
  210    QB   ALA  18           QB       ALA  18   9.490  -5.282   6.295
  211    H    GLU  19           HN       GLU  19   6.466  -6.190   6.912
  212    HA   GLU  19           HA       GLU  19   5.829  -8.546   5.518
  213   1HB   GLU  19          2HB       GLU  19   4.472  -6.924   7.652
  214   2HB   GLU  19          3HB       GLU  19   3.464  -8.067   6.765
  215   1HG   GLU  19          2HG       GLU  19   6.046  -8.928   8.045
  216   2HG   GLU  19          3HG       GLU  19   4.484  -9.019   8.852
  217    QB   GLU  19           QB       GLU  19   3.967  -7.496   7.208
  218    QG   GLU  19           QG       GLU  19   5.265  -8.973   8.449
  219    H    LEU  20           HN       LEU  20   4.048  -5.377   5.394
  220    HA   LEU  20           HA       LEU  20   2.204  -6.545   3.540
  221   1HB   LEU  20          2HB       LEU  20   1.859  -4.545   4.955
  222   2HB   LEU  20          3HB       LEU  20   2.760  -3.589   3.760
  223    HG   LEU  20           HG       LEU  20   0.488  -5.416   2.879
  224   1HD1  LEU  20          2HD1      LEU  20  -0.433  -4.270   4.884
  225   2HD1  LEU  20          3HD1      LEU  20  -0.211  -2.711   4.025
  226   3HD1  LEU  20          1HD1      LEU  20  -1.214  -3.957   3.327
  227   1HD2  LEU  20          1HD2      LEU  20   1.953  -3.296   1.606
  228   2HD2  LEU  20          2HD2      LEU  20   0.622  -4.303   0.986
  229   3HD2  LEU  20          3HD2      LEU  20   0.264  -2.777   1.770
  230    QB   LEU  20           QB       LEU  20   2.309  -4.067   4.358
  231    QD1  LEU  20           QD1      LEU  20  -0.619  -3.646   4.078
  232    QD2  LEU  20           QD2      LEU  20   0.947  -3.458   1.454
  233    QQD  LEU  20           QQD      LEU  20   0.163  -3.553   2.766
  234    H    ALA  21           HN       ALA  21   5.244  -4.684   2.993
  235    HA   ALA  21           HA       ALA  21   5.224  -4.661   0.187
  236   1HB   ALA  21          1HB       ALA  21   6.922  -3.589   1.770
  237   2HB   ALA  21          2HB       ALA  21   7.729  -5.170   1.823
  238   3HB   ALA  21          3HB       ALA  21   7.549  -4.326   0.282
  239    QB   ALA  21           QB       ALA  21   7.400  -4.361   1.292
  240    H    GLN  22           HN       GLN  22   6.342  -7.313   2.342
  241    HA   GLN  22           HA       GLN  22   7.066  -9.086   0.196
  242   1HB   GLN  22          2HB       GLN  22   6.313  -9.632   3.107
  243   2HB   GLN  22          3HB       GLN  22   6.691 -10.885   1.928
  244   1HG   GLN  22          2HG       GLN  22   8.757 -10.703   2.761
  245   2HG   GLN  22          3HG       GLN  22   8.905  -9.485   1.502
  246   1HE2  GLN  22          2HE2      GLN  22   8.712  -8.367   5.495
  247   2HE2  GLN  22          1HE2      GLN  22   7.868  -9.809   4.979
  248    QB   GLN  22           QB       GLN  22   6.503 -10.258   2.517
  249    QG   GLN  22           QG       GLN  22   8.831 -10.094   2.132
  250    QE2  GLN  22           QE2      GLN  22   8.290  -9.088   5.237
  251    H    LYS  23           HN       LYS  23   3.976  -8.721   2.045
  252    HA   LYS  23           HA       LYS  23   2.625 -10.818   0.637
  253   1HB   LYS  23          2HB       LYS  23   1.584  -8.368   2.110
  254   2HB   LYS  23          3HB       LYS  23   0.552  -9.628   1.414
  255   1HG   LYS  23          2HG       LYS  23   1.654 -11.345   2.739
  256   2HG   LYS  23          3HG       LYS  23   2.705 -10.158   3.523
  257   1HD   LYS  23          2HD       LYS  23   0.959  -9.176   4.745
  258   2HD   LYS  23          3HD       LYS  23  -0.262  -9.653   3.571
  259   1HE   LYS  23          2HE       LYS  23  -0.858 -11.192   5.089
  260   2HE   LYS  23          3HE       LYS  23   0.428 -12.146   4.378
  261   1HZ   LYS  23          2HZ       LYS  23   1.920 -11.168   6.238
  262   2HZ   LYS  23          3HZ       LYS  23   0.519 -10.594   6.863
  263   3HZ   LYS  23          1HZ       LYS  23   0.694 -12.201   6.673
  264    QB   LYS  23           QB       LYS  23   1.067  -8.998   1.762
  265    QG   LYS  23           QG       LYS  23   2.180 -10.752   3.131
  266    QD   LYS  23           QD       LYS  23   0.348  -9.415   4.158
  267    QE   LYS  23           QE       LYS  23  -0.214 -11.668   4.733
  268    QZ   LYS  23           QZ       LYS  23   1.044 -11.321   6.591
  269    H    VAL  24           HN       VAL  24   3.105  -7.423  -0.171
  270    HA   VAL  24           HA       VAL  24   1.466  -7.393  -2.561
  271    HB   VAL  24           HB       VAL  24   3.868  -5.757  -1.699
  272   1HG1  VAL  24          3HG1      VAL  24   1.748  -5.189  -3.797
  273   2HG1  VAL  24          1HG1      VAL  24   2.939  -4.002  -3.218
  274   3HG1  VAL  24          2HG1      VAL  24   3.485  -5.435  -4.104
  275   1HG2  VAL  24          3HG2      VAL  24   1.413  -5.798  -0.427
  276   2HG2  VAL  24          1HG2      VAL  24   2.608  -4.473  -0.413
  277   3HG2  VAL  24          2HG2      VAL  24   1.264  -4.449  -1.542
  278    QG1  VAL  24           QG1      VAL  24   2.724  -4.875  -3.707
  279    QG2  VAL  24           QG2      VAL  24   1.762  -4.907  -0.794
  280    QQG  VAL  24           QQG      VAL  24   2.242  -4.891  -2.250
  281    H    GLY  25           HN       GLY  25   4.723  -8.547  -1.766
  282   1HA   GLY  25          1HA       GLY  25   6.193  -9.766  -3.024
  283   2HA   GLY  25          2HA       GLY  25   5.074  -9.735  -4.399
  284    QA   GLY  25           QA       GLY  25   5.633  -9.751  -3.711
  285    H    THR  26           HN       THR  26   6.345  -6.960  -2.565
  286    HA   THR  26           HA       THR  26   8.259  -6.311  -4.753
  287    HB   THR  26           HB       THR  26   6.392  -4.791  -5.087
  288    HG1  THR  26          1HG       THR  26   7.681  -2.843  -4.824
  289   1HG2  THR  26          3HG2      THR  26   5.430  -4.791  -2.833
  290   2HG2  THR  26          1HG2      THR  26   6.824  -3.909  -2.196
  291   3HG2  THR  26          2HG2      THR  26   5.730  -3.140  -3.381
  292    QG2  THR  26           QG2      THR  26   5.994  -3.947  -2.804
  293    H    THR  27           HN       THR  27   9.231  -4.073  -3.255
  294    HA   THR  27           HA       THR  27  10.653  -5.412  -0.996
  295    HB   THR  27           HB       THR  27  12.355  -3.495  -1.758
  296    HG1  THR  27          1HG       THR  27  11.989  -3.376  -4.174
  297   1HG2  THR  27          2HG2      THR  27  11.785  -5.963  -3.490
  298   2HG2  THR  27          3HG2      THR  27  13.307  -5.042  -3.480
  299   3HG2  THR  27          1HG2      THR  27  12.800  -5.934  -2.033
  300    QG2  THR  27           QG2      THR  27  12.631  -5.646  -3.001
  301    H    GLN  28           HN       GLN  28  11.140  -4.064   0.831
  302    HA   GLN  28           HA       GLN  28   9.122  -2.480   1.813
  303   1HB   GLN  28          2HB       GLN  28  10.922  -3.412   3.198
  304   2HB   GLN  28          3HB       GLN  28  12.111  -2.373   2.405
  305   1HG   GLN  28          2HG       GLN  28  11.623  -1.562   4.627
  306   2HG   GLN  28          3HG       GLN  28  11.099  -0.365   3.439
  307   1HE2  GLN  28          2HE2      GLN  28   7.572  -0.891   4.134
  308   2HE2  GLN  28          1HE2      GLN  28   8.694  -0.498   2.842
  309    QB   GLN  28           QB       GLN  28  11.517  -2.892   2.802
  310    QG   GLN  28           QG       GLN  28  11.361  -0.963   4.033
  311    QE2  GLN  28           QE2      GLN  28   8.133  -0.694   3.488
  312    H    GLN  29           HN       GLN  29  11.843  -1.443  -0.202
  313    HA   GLN  29           HA       GLN  29  11.649   1.308   0.016
  314   1HB   GLN  29          2HB       GLN  29  12.808   1.451  -1.946
  315   2HB   GLN  29          3HB       GLN  29  13.350  -0.064  -1.227
  316   1HG   GLN  29          2HG       GLN  29  13.152  -0.684  -3.406
  317   2HG   GLN  29          3HG       GLN  29  11.515  -1.056  -2.851
  318   1HE2  GLN  29          2HE2      GLN  29  12.004   2.306  -5.240
  319   2HE2  GLN  29          1HE2      GLN  29  13.128   2.042  -3.921
  320    QB   GLN  29           QB       GLN  29  13.079   0.693  -1.586
  321    QG   GLN  29           QG       GLN  29  12.333  -0.870  -3.128
  322    QE2  GLN  29           QE2      GLN  29  12.566   2.174  -4.580
  323    H    SER  30           HN       SER  30   9.760  -0.825  -2.046
  324    HA   SER  30           HA       SER  30   8.415   1.181  -3.615
  325   1HB   SER  30          2HB       SER  30   7.748  -1.675  -2.873
  326   2HB   SER  30          3HB       SER  30   6.561  -0.696  -3.704
  327    HG   SER  30           HG       SER  30   9.199  -0.752  -4.712
  328    QB   SER  30           QB       SER  30   7.155  -1.186  -3.289
  329    H    ILE  31           HN       ILE  31   7.403  -0.507  -0.587
  330    HA   ILE  31           HA       ILE  31   5.083   1.042  -0.171
  331    HB   ILE  31           HB       ILE  31   6.911  -0.701   1.511
  332   1HG1  ILE  31          2HG1      ILE  31   5.026  -2.163   1.489
  333   2HG1  ILE  31          3HG1      ILE  31   4.002  -0.882   0.777
  334   1HG2  ILE  31          1HG2      ILE  31   4.438   0.842   2.379
  335   2HG2  ILE  31          2HG2      ILE  31   5.103  -0.561   3.245
  336   3HG2  ILE  31          3HG2      ILE  31   6.056   0.937   3.111
  337   1HD1  ILE  31          1HD1      ILE  31   6.225  -2.278  -0.701
  338   2HD1  ILE  31          2HD1      ILE  31   4.505  -2.723  -0.773
  339   3HD1  ILE  31          3HD1      ILE  31   5.005  -1.156  -1.378
  340    QG1  ILE  31           QG1      ILE  31   4.515  -1.522   1.132
  341    QG2  ILE  31           QG2      ILE  31   5.199   0.406   2.912
  342    QD1  ILE  31           QD1      ILE  31   5.245  -2.052  -0.951
  343    H    GLU  32           HN       GLU  32   8.374   1.439   1.252
  344    HA   GLU  32           HA       GLU  32   7.899   3.849   2.603
  345   1HB   GLU  32          2HB       GLU  32   9.892   2.586   2.913
  346   2HB   GLU  32          3HB       GLU  32  10.436   2.862   1.260
  347   1HG   GLU  32          2HG       GLU  32   9.955   5.324   2.915
  348   2HG   GLU  32          3HG       GLU  32  11.285   4.277   3.424
  349    QB   GLU  32           QB       GLU  32  10.164   2.724   2.086
  350    QG   GLU  32           QG       GLU  32  10.620   4.800   3.170
  351    H    GLN  33           HN       GLN  33   9.077   3.625  -0.827
  352    HA   GLN  33           HA       GLN  33   9.098   6.364  -1.317
  353   1HB   GLN  33          2HB       GLN  33   9.902   4.310  -2.772
  354   2HB   GLN  33          3HB       GLN  33   8.272   4.403  -3.466
  355   1HG   GLN  33          2HG       GLN  33   9.008   7.005  -3.640
  356   2HG   GLN  33          3HG       GLN  33  10.621   6.293  -3.624
  357   1HE2  GLN  33          2HE2      GLN  33   9.614   4.364  -6.738
  358   2HE2  GLN  33          1HE2      GLN  33   9.981   3.872  -5.092
  359    QB   GLN  33           QB       GLN  33   9.087   4.356  -3.119
  360    QG   GLN  33           QG       GLN  33   9.815   6.649  -3.632
  361    QE2  GLN  33           QE2      GLN  33   9.797   4.118  -5.916
  362    H    LEU  34           HN       LEU  34   6.368   4.050  -1.671
  363    HA   LEU  34           HA       LEU  34   4.605   6.022  -2.814
  364   1HB   LEU  34          2HB       LEU  34   4.463   3.535  -3.157
  365   2HB   LEU  34          3HB       LEU  34   3.881   3.391  -1.497
  366    HG   LEU  34           HG       LEU  34   1.999   5.003  -2.184
  367   1HD1  LEU  34          1HD1      LEU  34   3.135   4.438  -4.929
  368   2HD1  LEU  34          2HD1      LEU  34   1.467   4.990  -4.656
  369   3HD1  LEU  34          3HD1      LEU  34   2.812   6.025  -4.171
  370   1HD2  LEU  34          2HD2      LEU  34   1.725   2.500  -1.990
  371   2HD2  LEU  34          3HD2      LEU  34   0.639   3.255  -3.170
  372   3HD2  LEU  34          1HD2      LEU  34   2.081   2.390  -3.731
  373    QB   LEU  34           QB       LEU  34   4.172   3.463  -2.328
  374    QD1  LEU  34           QD1      LEU  34   2.471   5.151  -4.585
  375    QD2  LEU  34           QD2      LEU  34   1.481   2.715  -2.964
  376    QQD  LEU  34           QQD      LEU  34   1.976   3.933  -3.774
  377    H    GLU  35           HN       GLU  35   5.148   4.792   0.491
  378    HA   GLU  35           HA       GLU  35   3.118   6.225   1.864
  379   1HB   GLU  35          2HB       GLU  35   5.881   5.256   2.667
  380   2HB   GLU  35          3HB       GLU  35   4.757   5.977   3.813
  381   1HG   GLU  35          2HG       GLU  35   3.900   3.630   2.058
  382   2HG   GLU  35          3HG       GLU  35   4.825   3.358   3.536
  383    QB   GLU  35           QB       GLU  35   5.319   5.616   3.240
  384    QG   GLU  35           QG       GLU  35   4.362   3.494   2.797
  385    H    ASN  36           HN       ASN  36   6.478   7.149   0.944
  386    HA   ASN  36           HA       ASN  36   6.204   9.863   1.941
  387   1HB   ASN  36          2HB       ASN  36   8.013   8.795  -0.237
  388   2HB   ASN  36          3HB       ASN  36   8.169  10.360   0.581
  389   1HD2  ASN  36          2HD2      ASN  36  10.530   7.679   1.779
  390   2HD2  ASN  36          1HD2      ASN  36  10.163   8.490   0.340
  391    QB   ASN  36           QB       ASN  36   8.091   9.577   0.172
  392    QD2  ASN  36           QD2      ASN  36  10.347   8.084   1.060
  393    H    GLY  37           HN       GLY  37   4.441   8.422  -0.529
  394   1HA   GLY  37          1HA       GLY  37   3.080   9.259  -2.128
  395   2HA   GLY  37          2HA       GLY  37   3.244  10.820  -1.308
  396    QA   GLY  37           QA       GLY  37   3.162  10.040  -1.718
  397    H    LYS  38           HN       LYS  38   5.983   9.062  -2.727
  398    HA   LYS  38           HA       LYS  38   6.567  11.408  -4.421
  399   1HB   LYS  38          2HB       LYS  38   8.048   8.876  -3.723
  400   2HB   LYS  38          3HB       LYS  38   8.692  10.105  -4.825
  401   1HG   LYS  38          2HG       LYS  38   8.525  11.796  -3.013
  402   2HG   LYS  38          3HG       LYS  38   7.914  10.569  -1.903
  403   1HD   LYS  38          2HD       LYS  38   9.987   9.286  -2.053
  404   2HD   LYS  38          3HD       LYS  38  10.583  10.352  -3.346
  405   1HE   LYS  38          2HE       LYS  38  10.483  12.289  -1.694
  406   2HE   LYS  38          3HE       LYS  38  10.131  11.124  -0.416
  407   1HZ   LYS  38          2HZ       LYS  38  12.547  11.099  -2.099
  408   2HZ   LYS  38          3HZ       LYS  38  12.463  11.697  -0.572
  409   3HZ   LYS  38          1HZ       LYS  38  12.243  10.089  -0.834
  410    QB   LYS  38           QB       LYS  38   8.370   9.491  -4.274
  411    QG   LYS  38           QG       LYS  38   8.219  11.183  -2.458
  412    QD   LYS  38           QD       LYS  38  10.285   9.820  -2.699
  413    QE   LYS  38           QE       LYS  38  10.306  11.707  -1.055
  414    QZ   LYS  38           QZ       LYS  38  12.418  10.961  -1.168
  415    H    THR  39           HN       THR  39   5.281   8.169  -4.789
  416    HA   THR  39           HA       THR  39   5.657   8.170  -7.710
  417    HB   THR  39           HB       THR  39   4.239   6.151  -5.956
  418    HG1  THR  39          1HG       THR  39   6.993   6.590  -6.355
  419   1HG2  THR  39          2HG2      THR  39   5.549   5.969  -8.708
  420   2HG2  THR  39          3HG2      THR  39   4.968   4.584  -7.761
  421   3HG2  THR  39          1HG2      THR  39   3.817   5.817  -8.310
  422    QG2  THR  39           QG2      THR  39   4.778   5.457  -8.260
  423    H    LYS  40           HN       LYS  40   4.037   8.672  -9.128
  424    HA   LYS  40           HA       LYS  40   1.418   9.568  -8.105
  425   1HB   LYS  40          2HB       LYS  40   1.046  10.151 -10.528
  426   2HB   LYS  40          3HB       LYS  40   2.166  11.128  -9.601
  427   1HG   LYS  40          2HG       LYS  40   3.111   8.909 -11.493
  428   2HG   LYS  40          3HG       LYS  40   2.732  10.551 -11.997
  429   1HD   LYS  40          2HD       LYS  40   4.399  11.167  -9.946
  430   2HD   LYS  40          3HD       LYS  40   5.095   9.604 -10.415
  431   1HE   LYS  40          2HE       LYS  40   5.331  10.364 -12.742
  432   2HE   LYS  40          3HE       LYS  40   4.581  11.916 -12.333
  433   1HZ   LYS  40          3HZ       LYS  40   7.122  10.926 -11.222
  434   2HZ   LYS  40          1HZ       LYS  40   6.951  12.082 -12.379
  435   3HZ   LYS  40          2HZ       LYS  40   6.405  12.362 -10.854
  436    QB   LYS  40           QB       LYS  40   1.607  10.640 -10.065
  437    QG   LYS  40           QG       LYS  40   2.921   9.730 -11.746
  438    QD   LYS  40           QD       LYS  40   4.747  10.386 -10.181
  439    QE   LYS  40           QE       LYS  40   4.956  11.140 -12.538
  440    QZ   LYS  40           QZ       LYS  40   6.826  11.790 -11.485
  441    NH1  ARG  41           NH2      ARG  41  -4.053   7.131 -13.747
  442    NH2  ARG  41           NH1      ARG  41  -3.267   6.498 -15.831
  443    H    ARG  41           HN       ARG  41   2.762   6.978 -10.188
  444    HA   ARG  41           HA       ARG  41   0.251   5.495  -9.789
  445   1HB   ARG  41          2HB       ARG  41   0.383   6.841 -12.079
  446   2HB   ARG  41          3HB       ARG  41   1.425   5.523 -12.572
  447   1HG   ARG  41          2HG       ARG  41  -0.396   4.254 -13.002
  448   2HG   ARG  41          3HG       ARG  41  -0.822   4.295 -11.305
  449   1HD   ARG  41          2HD       ARG  41  -2.737   5.172 -12.151
  450   2HD   ARG  41          3HD       ARG  41  -1.854   6.688 -11.908
  451    HE   ARG  41           HE       ARG  41  -1.281   5.668 -14.519
  452   1HH1  ARG  41          2HH2      ARG  41  -3.919   7.195 -12.749
  453   2HH1  ARG  41          1HH2      ARG  41  -4.886   7.536 -14.148
  454   1HH2  ARG  41          2HH1      ARG  41  -2.584   6.035 -16.412
  455   2HH2  ARG  41          1HH1      ARG  41  -4.088   6.879 -16.279
  456    QB   ARG  41           QB       ARG  41   0.904   6.183 -12.325
  457    QG   ARG  41           QG       ARG  41  -0.610   4.274 -12.153
  458    QD   ARG  41           QD       ARG  41  -2.295   5.930 -12.030
  459    QH1  ARG  41           QH2      ARG  41  -4.403   7.366 -13.449
  460    QH2  ARG  41           QH1      ARG  41  -3.336   6.457 -16.346
  461    HA   PRO  42           HA       PRO  42   3.958   2.806  -9.241
  462   1HB   PRO  42          2HB       PRO  42   2.949   1.143  -7.300
  463   2HB   PRO  42          3HB       PRO  42   3.614   2.741  -6.934
  464   1HG   PRO  42          2HG       PRO  42   0.772   1.876  -7.207
  465   2HG   PRO  42          3HG       PRO  42   1.432   3.042  -6.045
  466   1HD   PRO  42          2HD       PRO  42   0.102   3.706  -8.440
  467   2HD   PRO  42          3HD       PRO  42   1.225   4.803  -7.581
  468    QB   PRO  42           QB       PRO  42   3.282   1.942  -7.116
  469    QG   PRO  42           QG       PRO  42   1.102   2.459  -6.626
  470    QD   PRO  42           QD       PRO  42   0.664   4.255  -8.010
  471    NH1  ARG  43           NH2      ARG  43   1.243  -0.928 -15.347
  472    NH2  ARG  43           NH1      ARG  43   0.222  -3.005 -15.226
  473    H    ARG  43           HN       ARG  43   4.182   0.433  -9.466
  474    HA   ARG  43           HA       ARG  43   2.257  -0.620 -11.439
  475   1HB   ARG  43          2HB       ARG  43   4.843  -0.580 -11.722
  476   2HB   ARG  43          3HB       ARG  43   4.876  -1.852 -10.495
  477   1HG   ARG  43          2HG       ARG  43   4.961  -2.896 -12.652
  478   2HG   ARG  43          3HG       ARG  43   3.381  -3.241 -11.952
  479   1HD   ARG  43          2HD       ARG  43   3.076  -0.802 -13.417
  480   2HD   ARG  43          3HD       ARG  43   4.104  -1.817 -14.422
  481    HE   ARG  43           HE       ARG  43   2.146  -3.566 -13.715
  482   1HH1  ARG  43          2HH2      ARG  43   2.008  -0.321 -15.098
  483   2HH1  ARG  43          1HH2      ARG  43   0.516  -0.571 -15.948
  484   1HH2  ARG  43          2HH1      ARG  43   0.198  -3.954 -14.882
  485   2HH2  ARG  43          1HH1      ARG  43  -0.516  -2.705 -15.845
  486    QB   ARG  43           QB       ARG  43   4.859  -1.216 -11.108
  487    QG   ARG  43           QG       ARG  43   4.171  -3.069 -12.302
  488    QD   ARG  43           QD       ARG  43   3.590  -1.310 -13.920
  489    QH1  ARG  43           QH2      ARG  43   1.263  -0.446 -15.523
  490    QH2  ARG  43           QH1      ARG  43  -0.159  -3.330 -15.363
  491    H    PHE  44           HN       PHE  44   3.292  -1.129  -8.122
  492    HA   PHE  44           HA       PHE  44   1.910  -3.742  -7.945
  493   1HB   PHE  44          2HB       PHE  44   2.807  -3.738  -5.661
  494   2HB   PHE  44          3HB       PHE  44   4.041  -3.654  -6.897
  495    HD1  PHE  44          2HD       PHE  44   2.331  -1.767  -4.188
  496    HD2  PHE  44          1HD       PHE  44   5.489  -1.685  -7.131
  497    HE1  PHE  44          2HE       PHE  44   3.148   0.381  -3.268
  498    HE2  PHE  44          1HE       PHE  44   6.178   0.554  -6.322
  499    HZ   PHE  44           HZ       PHE  44   5.009   1.593  -4.399
  500    QB   PHE  44           QB       PHE  44   3.424  -3.696  -6.279
  501    QR   PHE  44           QR       PHE  44   4.286  -0.629  -5.228
  502    H    LEU  45           HN       LEU  45   0.598  -0.845  -8.241
  503    HA   LEU  45           HA       LEU  45  -0.935  -0.470  -5.917
  504   1HB   LEU  45          2HB       LEU  45  -0.843   0.938  -8.226
  505   2HB   LEU  45          3HB       LEU  45  -2.207  -0.078  -8.616
  506    HG   LEU  45           HG       LEU  45  -3.098   0.627  -6.254
  507   1HD1  LEU  45          2HD1      LEU  45  -1.086   1.912  -5.515
  508   2HD1  LEU  45          3HD1      LEU  45  -1.288   2.983  -6.917
  509   3HD1  LEU  45          1HD1      LEU  45  -2.485   2.990  -5.653
  510   1HD2  LEU  45          3HD2      LEU  45  -3.914   1.277  -8.665
  511   2HD2  LEU  45          1HD2      LEU  45  -4.522   2.100  -7.210
  512   3HD2  LEU  45          2HD2      LEU  45  -3.283   2.873  -8.220
  513    QB   LEU  45           QB       LEU  45  -1.524   0.429  -8.420
  514    QD1  LEU  45           QD1      LEU  45  -1.619   2.629  -6.028
  515    QD2  LEU  45           QD2      LEU  45  -3.906   2.084  -8.031
  516    QQD  LEU  45           QQD      LEU  45  -2.763   2.355  -7.030
  517    HA   PRO  46           HA       PRO  46  -4.252  -3.462  -7.570
  518   1HB   PRO  46          2HB       PRO  46  -3.569  -5.452  -9.353
  519   2HB   PRO  46          3HB       PRO  46  -4.310  -3.886  -9.782
  520   1HG   PRO  46          2HG       PRO  46  -1.487  -4.765 -10.120
  521   2HG   PRO  46          3HG       PRO  46  -2.413  -3.556 -11.049
  522   1HD   PRO  46          2HD       PRO  46  -0.540  -3.121  -8.980
  523   2HD   PRO  46          3HD       PRO  46  -1.578  -1.871  -9.715
  524    QB   PRO  46           QB       PRO  46  -3.939  -4.669  -9.567
  525    QG   PRO  46           QG       PRO  46  -1.950  -4.161 -10.585
  526    QD   PRO  46           QD       PRO  46  -1.060  -2.496  -9.347
  527    H    GLU  47           HN       GLU  47  -0.918  -4.828  -7.550
  528    HA   GLU  47           HA       GLU  47  -1.467  -7.199  -6.163
  529   1HB   GLU  47          2HB       GLU  47   1.008  -5.421  -5.964
  530   2HB   GLU  47          3HB       GLU  47   0.904  -7.137  -5.542
  531   1HG   GLU  47          2HG       GLU  47   0.548  -5.981  -8.357
  532   2HG   GLU  47          3HG       GLU  47   1.967  -6.818  -7.720
  533    QB   GLU  47           QB       GLU  47   0.956  -6.279  -5.752
  534    QG   GLU  47           QG       GLU  47   1.257  -6.399  -8.038
  535    H    LEU  48           HN       LEU  48  -0.594  -3.954  -4.853
  536    HA   LEU  48           HA       LEU  48  -0.780  -4.775  -2.120
  537   1HB   LEU  48          2HB       LEU  48   0.509  -2.845  -3.000
  538   2HB   LEU  48          3HB       LEU  48  -0.979  -1.982  -3.357
  539    HG   LEU  48           HG       LEU  48  -0.672  -2.958  -0.531
  540   1HD1  LEU  48          1HD1      LEU  48   1.065  -0.700  -1.643
  541   2HD1  LEU  48          2HD1      LEU  48   0.808  -1.039   0.079
  542   3HD1  LEU  48          3HD1      LEU  48   1.651  -2.217  -0.932
  543   1HD2  LEU  48          3HD2      LEU  48  -1.422  -0.275  -1.762
  544   2HD2  LEU  48          1HD2      LEU  48  -2.551  -1.548  -1.238
  545   3HD2  LEU  48          2HD2      LEU  48  -1.557  -0.703  -0.044
  546    QB   LEU  48           QB       LEU  48  -0.235  -2.413  -3.178
  547    QD1  LEU  48           QD1      LEU  48   1.175  -1.319  -0.833
  548    QD2  LEU  48           QD2      LEU  48  -1.844  -0.842  -1.015
  549    QQD  LEU  48           QQD      LEU  48  -0.334  -1.080  -0.923
  550    H    ALA  49           HN       ALA  49  -3.110  -3.170  -4.311
  551    HA   ALA  49           HA       ALA  49  -5.249  -2.885  -2.538
  552   1HB   ALA  49          2HB       ALA  49  -5.075  -3.328  -5.521
  553   2HB   ALA  49          3HB       ALA  49  -6.647  -3.276  -4.748
  554   3HB   ALA  49          1HB       ALA  49  -5.594  -1.885  -4.637
  555    QB   ALA  49           QB       ALA  49  -5.772  -2.830  -4.969
  556    H    SER  50           HN       SER  50  -4.435  -5.684  -4.594
  557    HA   SER  50           HA       SER  50  -6.584  -7.349  -3.785
  558   1HB   SER  50          2HB       SER  50  -5.231  -7.628  -5.858
  559   2HB   SER  50          3HB       SER  50  -3.846  -8.144  -4.883
  560    HG   SER  50           HG       SER  50  -6.402  -9.408  -4.965
  561    QB   SER  50           QB       SER  50  -4.539  -7.886  -5.370
  562    H    ALA  51           HN       ALA  51  -3.133  -7.304  -2.683
  563    HA   ALA  51           HA       ALA  51  -3.387  -9.368  -0.784
  564   1HB   ALA  51          2HB       ALA  51  -1.230  -8.482  -1.580
  565   2HB   ALA  51          3HB       ALA  51  -1.525  -6.951  -0.718
  566   3HB   ALA  51          1HB       ALA  51  -1.324  -8.468   0.195
  567    QB   ALA  51           QB       ALA  51  -1.360  -7.967  -0.701
  568    H    LEU  52           HN       LEU  52  -4.078  -5.879  -0.498
  569    HA   LEU  52           HA       LEU  52  -4.860  -6.076   2.301
  570   1HB   LEU  52          2HB       LEU  52  -5.169  -3.974   0.103
  571   2HB   LEU  52          3HB       LEU  52  -5.901  -3.761   1.688
  572    HG   LEU  52           HG       LEU  52  -2.914  -4.124   1.199
  573   1HD1  LEU  52          2HD1      LEU  52  -3.847  -1.934   0.485
  574   2HD1  LEU  52          3HD1      LEU  52  -4.551  -1.698   2.091
  575   3HD1  LEU  52          1HD1      LEU  52  -2.780  -1.774   1.907
  576   1HD2  LEU  52          2HD2      LEU  52  -4.685  -4.244   3.578
  577   2HD2  LEU  52          3HD2      LEU  52  -3.108  -4.955   3.339
  578   3HD2  LEU  52          1HD2      LEU  52  -3.242  -3.233   3.787
  579    QB   LEU  52           QB       LEU  52  -5.535  -3.867   0.895
  580    QD1  LEU  52           QD1      LEU  52  -3.726  -1.802   1.494
  581    QD2  LEU  52           QD2      LEU  52  -3.678  -4.144   3.568
  582    QQD  LEU  52           QQD      LEU  52  -3.702  -2.973   2.532
  583    H    GLY  53           HN       GLY  53  -6.555  -6.472  -0.751
  584   1HA   GLY  53          1HA       GLY  53  -8.697  -7.188  -1.157
  585   2HA   GLY  53          2HA       GLY  53  -9.015  -7.323   0.581
  586    QA   GLY  53           QA       GLY  53  -8.857  -7.255  -0.288
  587    H    VAL  54           HN       VAL  54  -7.924  -4.582  -1.476
  588    HA   VAL  54           HA       VAL  54 -10.495  -3.159  -1.020
  589    HB   VAL  54           HB       VAL  54  -9.361  -1.017  -0.817
  590   1HG1  VAL  54          3HG1      VAL  54  -9.881  -2.263   1.246
  591   2HG1  VAL  54          1HG1      VAL  54  -8.225  -2.932   1.246
  592   3HG1  VAL  54          2HG1      VAL  54  -8.482  -1.174   1.402
  593   1HG2  VAL  54          1HG2      VAL  54  -6.842  -2.659  -1.094
  594   2HG2  VAL  54          2HG2      VAL  54  -7.327  -1.201  -1.991
  595   3HG2  VAL  54          3HG2      VAL  54  -6.809  -1.090  -0.296
  596    QG1  VAL  54           QG1      VAL  54  -8.862  -2.123   1.298
  597    QG2  VAL  54           QG2      VAL  54  -6.992  -1.650  -1.127
  598    QQG  VAL  54           QQG      VAL  54  -7.927  -1.887   0.086
  599    H    SER  55           HN       SER  55 -10.746  -1.377  -2.750
  600    HA   SER  55           HA       SER  55 -10.138  -2.544  -5.340
  601   1HB   SER  55          2HB       SER  55 -11.650  -0.485  -5.937
  602   2HB   SER  55          3HB       SER  55 -12.339  -1.834  -5.022
  603    HG   SER  55           HG       SER  55 -11.883   0.739  -4.164
  604    QB   SER  55           QB       SER  55 -11.994  -1.160  -5.479
  605    H    VAL  56           HN       VAL  56  -8.841  -1.636  -6.907
  606    HA   VAL  56           HA       VAL  56  -6.696   0.128  -6.359
  607    HB   VAL  56           HB       VAL  56  -8.130  -0.862  -8.823
  608   1HG1  VAL  56          3HG1      VAL  56  -6.100   1.362  -8.746
  609   2HG1  VAL  56          1HG1      VAL  56  -6.210   0.247 -10.131
  610   3HG1  VAL  56          2HG1      VAL  56  -7.608   1.249  -9.669
  611   1HG2  VAL  56          1HG2      VAL  56  -6.196  -1.969  -7.252
  612   2HG2  VAL  56          2HG2      VAL  56  -6.344  -2.284  -8.986
  613   3HG2  VAL  56          3HG2      VAL  56  -5.174  -1.087  -8.395
  614    QG1  VAL  56           QG1      VAL  56  -6.640   0.952  -9.515
  615    QG2  VAL  56           QG2      VAL  56  -5.905  -1.780  -8.210
  616    QQG  VAL  56           QQG      VAL  56  -6.272  -0.414  -8.863
  617    H    ASP  57           HN       ASP  57  -9.993   0.888  -7.581
  618    HA   ASP  57           HA       ASP  57  -9.863   3.662  -7.797
  619   1HB   ASP  57          2HB       ASP  57 -11.944   2.537  -8.234
  620   2HB   ASP  57          3HB       ASP  57 -12.011   1.873  -6.584
  621    QB   ASP  57           QB       ASP  57 -11.978   2.206  -7.409
  622    CH2  TRP  58           CH2      TRP  58  -7.366   2.142   2.523
  623    H    TRP  58           HN       TRP  58 -10.108   1.722  -4.767
  624    HA   TRP  58           HA       TRP  58 -10.304   4.075  -3.086
  625   1HB   TRP  58          2HB       TRP  58 -11.165   1.861  -2.393
  626   2HB   TRP  58          3HB       TRP  58  -9.517   1.234  -2.321
  627    HD1  TRP  58           HD1      TRP  58 -11.731   3.882  -0.699
  628    HE1  TRP  58           HE1      TRP  58 -10.956   4.390   1.652
  629    HE3  TRP  58           HE3      TRP  58  -7.405   1.196  -0.757
  630    HZ2  TRP  58           HZ2      TRP  58  -8.851   3.403   3.465
  631    HZ3  TRP  58           HZ3      TRP  58  -5.931   1.169   1.250
  632    HH2  TRP  58           HH2      TRP  58  -6.732   2.086   3.397
  633    QB   TRP  58           QB       TRP  58 -10.341   1.548  -2.357
  634    H    LEU  59           HN       LEU  59  -7.679   1.877  -4.172
  635    HA   LEU  59           HA       LEU  59  -5.684   3.288  -2.653
  636   1HB   LEU  59          2HB       LEU  59  -5.661   1.327  -4.922
  637   2HB   LEU  59          3HB       LEU  59  -4.213   2.236  -4.652
  638    HG   LEU  59           HG       LEU  59  -5.550   0.310  -2.742
  639   1HD1  LEU  59          1HD1      LEU  59  -4.053  -0.427  -4.650
  640   2HD1  LEU  59          2HD1      LEU  59  -2.711   0.417  -3.857
  641   3HD1  LEU  59          3HD1      LEU  59  -3.531  -0.941  -3.055
  642   1HD2  LEU  59          2HD2      LEU  59  -3.304   2.291  -2.162
  643   2HD2  LEU  59          3HD2      LEU  59  -4.778   1.959  -1.197
  644   3HD2  LEU  59          1HD2      LEU  59  -3.496   0.771  -1.264
  645    QB   LEU  59           QB       LEU  59  -4.937   1.782  -4.787
  646    QD1  LEU  59           QD1      LEU  59  -3.432  -0.317  -3.853
  647    QD2  LEU  59           QD2      LEU  59  -3.859   1.674  -1.541
  648    QQD  LEU  59           QQD      LEU  59  -3.645   0.678  -2.697
  649    H    LEU  60           HN       LEU  60  -7.231   4.216  -5.657
  650    HA   LEU  60           HA       LEU  60  -5.200   6.340  -6.090
  651   1HB   LEU  60          2HB       LEU  60  -7.719   5.589  -7.591
  652   2HB   LEU  60          3HB       LEU  60  -6.666   6.939  -8.022
  653    HG   LEU  60           HG       LEU  60  -5.755   4.031  -7.893
  654   1HD1  LEU  60          1HD1      LEU  60  -7.402   4.400  -9.681
  655   2HD1  LEU  60          2HD1      LEU  60  -6.442   5.766 -10.296
  656   3HD1  LEU  60          3HD1      LEU  60  -5.784   4.114 -10.346
  657   1HD2  LEU  60          3HD2      LEU  60  -4.374   6.589  -8.826
  658   2HD2  LEU  60          1HD2      LEU  60  -3.822   5.453  -7.572
  659   3HD2  LEU  60          2HD2      LEU  60  -3.816   4.964  -9.267
  660    QB   LEU  60           QB       LEU  60  -7.192   6.264  -7.807
  661    QD1  LEU  60           QD1      LEU  60  -6.542   4.760 -10.108
  662    QD2  LEU  60           QD2      LEU  60  -4.004   5.668  -8.555
  663    QQD  LEU  60           QQD      LEU  60  -5.274   5.214  -9.331
  664    H    ASN  61           HN       ASN  61  -8.720   6.249  -5.342
  665    HA   ASN  61           HA       ASN  61  -8.724   9.109  -4.669
  666   1HB   ASN  61          2HB       ASN  61 -10.826   6.950  -4.871
  667   2HB   ASN  61          3HB       ASN  61 -11.116   8.306  -3.778
  668   1HD2  ASN  61          2HD2      ASN  61 -11.046   9.069  -7.800
  669   2HD2  ASN  61          1HD2      ASN  61 -10.395   7.551  -7.200
  670    QB   ASN  61           QB       ASN  61 -10.971   7.627  -4.325
  671    QD2  ASN  61           QD2      ASN  61 -10.720   8.310  -7.500
  672    H    GLY  62           HN       GLY  62  -9.274   6.063  -2.791
  673   1HA   GLY  62          1HA       GLY  62  -8.437   5.771  -0.606
  674   2HA   GLY  62          2HA       GLY  62  -8.394   7.523  -0.351
  675    QA   GLY  62           QA       GLY  62  -8.415   6.647  -0.479
  676    H    THR  63           HN       THR  63 -11.323   6.845  -1.765
  677    HA   THR  63           HA       THR  63 -12.730   5.950   0.660
  678    HB   THR  63           HB       THR  63 -14.292   7.864   0.373
  679    HG1  THR  63          1HG       THR  63 -13.338   8.459  -1.719
  680   1HG2  THR  63          2HG2      THR  63 -12.693   7.864   2.258
  681   2HG2  THR  63          3HG2      THR  63 -11.521   8.763   1.257
  682   3HG2  THR  63          1HG2      THR  63 -13.074   9.505   1.679
  683    QG2  THR  63           QG2      THR  63 -12.429   8.710   1.731
  684    H    SER  64           HN       SER  64 -14.046   4.420  -0.148
  685    HA   SER  64           HA       SER  64 -15.033   4.559  -2.960
  686   1HB   SER  64          2HB       SER  64 -13.567   2.631  -2.681
  687   2HB   SER  64          3HB       SER  64 -14.364   2.194  -1.148
  688    HG   SER  64           HG       SER  64 -15.571   2.209  -3.720
  689    QB   SER  64           QB       SER  64 -13.966   2.412  -1.915
  690    H    ASP  65           HN       ASP  65 -17.299   4.455  -3.089
  691    HA   ASP  65           HA       ASP  65 -18.850   3.888  -0.639
  692   1HB   ASP  65          2HB       ASP  65 -18.639   6.398  -0.968
  693   2HB   ASP  65          3HB       ASP  65 -19.465   6.202  -2.530
  694    QB   ASP  65           QB       ASP  65 -19.052   6.300  -1.748
  695    H    SER  66           HN       SER  66 -20.709   2.744  -1.138
  696    HA   SER  66           HA       SER  66 -21.853   2.710  -3.691
  697   1HB   SER  66          2HB       SER  66 -19.920   1.103  -4.169
  698   2HB   SER  66          3HB       SER  66 -20.661   0.002  -2.982
  699    HG   SER  66           HG       SER  66 -21.519  -0.505  -4.979
  700    QB   SER  66           QB       SER  66 -20.291   0.552  -3.576
  701    H    ASN  67           HN       ASN  67 -23.902   2.545  -3.207
  702    HA   ASN  67           HA       ASN  67 -24.862   0.925  -0.875
  703   1HB   ASN  67          2HB       ASN  67 -26.941   2.320  -1.126
  704   2HB   ASN  67          3HB       ASN  67 -25.500   3.170  -0.559
  705   1HD2  ASN  67          2HD2      ASN  67 -25.236   5.320  -3.376
  706   2HD2  ASN  67          1HD2      ASN  67 -24.389   4.680  -1.985
  707    QB   ASN  67           QB       ASN  67 -26.220   2.745  -0.842
  708    QD2  ASN  67           QD2      ASN  67 -24.813   5.000  -2.680
  709    H    VAL  68           HN       VAL  68 -24.819   1.137  -4.357
  710    HA   VAL  68           HA       VAL  68 -27.212  -0.487  -4.754
  711    HB   VAL  68           HB       VAL  68 -26.416  -0.483  -7.140
  712   1HG1  VAL  68          1HG1      VAL  68 -28.103   1.083  -6.293
  713   2HG1  VAL  68          2HG1      VAL  68 -26.827   2.226  -5.822
  714   3HG1  VAL  68          3HG1      VAL  68 -27.084   1.829  -7.534
  715   1HG2  VAL  68          3HG2      VAL  68 -23.946   0.011  -6.603
  716   2HG2  VAL  68          1HG2      VAL  68 -24.690   0.991  -7.874
  717   3HG2  VAL  68          2HG2      VAL  68 -24.447   1.678  -6.263
  718    QG1  VAL  68           QG1      VAL  68 -27.338   1.712  -6.549
  719    QG2  VAL  68           QG2      VAL  68 -24.362   0.893  -6.914
  720    QQG  VAL  68           QQG      VAL  68 -25.849   1.303  -6.732
  721    NH1  ARG  69           NH2      ARG  69 -25.429  -5.155  -8.762
  722    NH2  ARG  69           NH1      ARG  69 -24.497  -7.266  -8.951
  723    H    ARG  69           HN       ARG  69 -26.224  -2.019  -3.104
  724    HA   ARG  69           HA       ARG  69 -25.382  -4.024  -2.538
  725   1HB   ARG  69          2HB       ARG  69 -25.749  -5.923  -4.076
  726   2HB   ARG  69          3HB       ARG  69 -27.180  -4.920  -3.819
  727   1HG   ARG  69          2HG       ARG  69 -26.974  -3.898  -5.972
  728   2HG   ARG  69          3HG       ARG  69 -25.345  -4.583  -6.196
  729   1HD   ARG  69          2HD       ARG  69 -27.482  -6.600  -5.764
  730   2HD   ARG  69          3HD       ARG  69 -27.716  -5.637  -7.216
  731    HE   ARG  69           HE       ARG  69 -25.794  -7.718  -6.827
  732   1HH1  ARG  69          2HH2      ARG  69 -25.959  -4.498  -8.205
  733   2HH1  ARG  69          1HH2      ARG  69 -24.926  -4.812  -9.566
  734   1HH2  ARG  69          2HH1      ARG  69 -24.383  -8.211  -8.614
  735   2HH2  ARG  69          1HH1      ARG  69 -23.981  -6.984  -9.772
  736    QB   ARG  69           QB       ARG  69 -26.464  -5.422  -3.948
  737    QG   ARG  69           QG       ARG  69 -26.160  -4.240  -6.084
  738    QD   ARG  69           QD       ARG  69 -27.599  -6.119  -6.491
  739    QH1  ARG  69           QH2      ARG  69 -25.443  -4.655  -8.885
  740    QH2  ARG  69           QH1      ARG  69 -24.182  -7.597  -9.193
   
  Start of MODEL          13
 Raw file had 740 H/Q atoms
  Start of MODEL   13
    1    H    SER   1           HN       SER   1  -5.329  10.516   4.129
    2    HA   SER   1           HA       SER   1  -3.850  11.266   1.716
    3   1HB   SER   1          2HB       SER   1  -2.962  10.911   4.632
    4   2HB   SER   1          3HB       SER   1  -1.909  11.423   3.293
    5    HG   SER   1           HG       SER   1  -2.814  13.267   4.253
    6    QB   SER   1           QB       SER   1  -2.436  11.167   3.963
    7    H    ILE   2           HN       ILE   2  -1.984  10.006   0.985
    8    HA   ILE   2           HA       ILE   2  -2.796   7.389   0.401
    9    HB   ILE   2           HB       ILE   2  -0.070   8.610   0.088
   10   1HG1  ILE   2          2HG1      ILE   2  -1.828   9.945  -1.044
   11   2HG1  ILE   2          3HG1      ILE   2  -0.770   9.117  -2.188
   12   1HG2  ILE   2          2HG2      ILE   2  -0.026   6.159  -0.069
   13   2HG2  ILE   2          3HG2      ILE   2  -1.329   6.167  -1.247
   14   3HG2  ILE   2          1HG2      ILE   2   0.232   6.903  -1.658
   15   1HD1  ILE   2          3HD1      ILE   2  -2.569   7.423  -2.568
   16   2HD1  ILE   2          1HD1      ILE   2  -3.613   8.387  -1.472
   17   3HD1  ILE   2          2HD1      ILE   2  -3.020   9.074  -2.983
   18    QG1  ILE   2           QG1      ILE   2  -1.299   9.531  -1.616
   19    QG2  ILE   2           QG2      ILE   2  -0.374   6.410  -0.991
   20    QD1  ILE   2           QD1      ILE   2  -3.068   8.294  -2.341
   21    H    SER   3           HN       SER   3  -0.034   8.439   2.480
   22    HA   SER   3           HA       SER   3   0.680   6.085   3.742
   23   1HB   SER   3          2HB       SER   3   1.081   7.717   5.725
   24   2HB   SER   3          3HB       SER   3   1.946   8.068   4.245
   25    HG   SER   3           HG       SER   3   0.284   9.670   5.464
   26    QB   SER   3           QB       SER   3   1.513   7.892   4.984
   27    H    SER   4           HN       SER   4  -2.074   8.229   4.446
   28    HA   SER   4           HA       SER   4  -2.884   6.948   6.844
   29   1HB   SER   4          2HB       SER   4  -4.004   8.950   5.110
   30   2HB   SER   4          3HB       SER   4  -5.273   7.774   5.488
   31    HG   SER   4           HG       SER   4  -4.914   8.247   7.654
   32    QB   SER   4           QB       SER   4  -4.639   8.363   5.299
   33    NH1  ARG   5           NH2      ARG   5  -4.003   5.276  -1.205
   34    NH2  ARG   5           NH1      ARG   5  -5.378   6.564  -2.517
   35    H    ARG   5           HN       ARG   5  -3.816   6.163   3.399
   36    HA   ARG   5           HA       ARG   5  -5.539   4.019   4.241
   37   1HB   ARG   5          2HB       ARG   5  -3.964   4.139   1.650
   38   2HB   ARG   5          3HB       ARG   5  -5.130   3.036   1.972
   39   1HG   ARG   5          2HG       ARG   5  -6.477   4.499   0.850
   40   2HG   ARG   5          3HG       ARG   5  -6.677   5.221   2.455
   41   1HD   ARG   5          2HD       ARG   5  -5.702   7.094   1.801
   42   2HD   ARG   5          3HD       ARG   5  -4.272   6.257   1.291
   43    HE   ARG   5           HE       ARG   5  -6.519   7.127  -0.418
   44   1HH1  ARG   5          2HH2      ARG   5  -3.705   4.940  -0.302
   45   2HH1  ARG   5          1HH2      ARG   5  -3.588   4.908  -2.058
   46   1HH2  ARG   5          2HH1      ARG   5  -6.228   7.079  -2.680
   47   2HH2  ARG   5          1HH1      ARG   5  -4.859   6.255  -3.341
   48    QB   ARG   5           QB       ARG   5  -4.547   3.587   1.811
   49    QG   ARG   5           QG       ARG   5  -6.578   4.860   1.653
   50    QD   ARG   5           QD       ARG   5  -4.987   6.675   1.546
   51    QH1  ARG   5           QH2      ARG   5  -3.647   4.924  -1.180
   52    QH2  ARG   5           QH1      ARG   5  -5.543   6.667  -3.011
   53    H    VAL   6           HN       VAL   6  -2.127   4.023   3.100
   54    HA   VAL   6           HA       VAL   6  -1.777   1.228   3.263
   55    HB   VAL   6           HB       VAL   6   0.302   3.428   3.607
   56   1HG1  VAL   6          3HG1      VAL   6   0.593   0.451   2.992
   57   2HG1  VAL   6          1HG1      VAL   6   1.900   1.633   2.817
   58   3HG1  VAL   6          2HG1      VAL   6   1.229   1.302   4.418
   59   1HG2  VAL   6          2HG2      VAL   6  -0.897   3.541   1.423
   60   2HG2  VAL   6          3HG2      VAL   6   0.786   3.042   1.237
   61   3HG2  VAL   6          1HG2      VAL   6  -0.507   1.830   1.136
   62    QG1  VAL   6           QG1      VAL   6   1.241   1.128   3.409
   63    QG2  VAL   6           QG2      VAL   6  -0.206   2.805   1.265
   64    QQG  VAL   6           QQG      VAL   6   0.517   1.967   2.337
   65    H    LYS   7           HN       LYS   7  -0.944   3.746   5.655
   66    HA   LYS   7           HA       LYS   7  -0.033   1.962   7.633
   67   1HB   LYS   7          2HB       LYS   7   0.482   4.402   7.356
   68   2HB   LYS   7          3HB       LYS   7  -1.085   4.776   8.110
   69   1HG   LYS   7          2HG       LYS   7  -0.370   3.573  10.149
   70   2HG   LYS   7          3HG       LYS   7   1.107   3.042   9.335
   71   1HD   LYS   7          2HD       LYS   7   1.109   5.877   9.021
   72   2HD   LYS   7          3HD       LYS   7   0.482   5.607  10.643
   73   1HE   LYS   7          2HE       LYS   7   2.814   5.752  10.956
   74   2HE   LYS   7          3HE       LYS   7   2.499   4.021  10.994
   75   1HZ   LYS   7          1HZ       LYS   7   3.199   4.051   8.534
   76   2HZ   LYS   7          2HZ       LYS   7   3.580   5.561   8.661
   77   3HZ   LYS   7          3HZ       LYS   7   4.388   4.483   9.594
   78    QB   LYS   7           QB       LYS   7  -0.301   4.589   7.733
   79    QG   LYS   7           QG       LYS   7   0.368   3.307   9.742
   80    QD   LYS   7           QD       LYS   7   0.795   5.742   9.832
   81    QE   LYS   7           QE       LYS   7   2.656   4.887  10.975
   82    QZ   LYS   7           QZ       LYS   7   3.722   4.699   8.930
   83    H    SER   8           HN       SER   8  -3.226   3.727   7.385
   84    HA   SER   8           HA       SER   8  -4.447   2.700   9.690
   85   1HB   SER   8          2HB       SER   8  -5.466   4.475   8.285
   86   2HB   SER   8          3HB       SER   8  -5.748   3.285   6.993
   87    HG   SER   8           HG       SER   8  -6.975   3.437   9.525
   88    QB   SER   8           QB       SER   8  -5.608   3.880   7.639
   89    H    LYS   9           HN       LYS   9  -4.550   1.332   6.336
   90    HA   LYS   9           HA       LYS   9  -6.067  -0.927   7.125
   91   1HB   LYS   9          2HB       LYS   9  -5.615  -0.002   4.734
   92   2HB   LYS   9          3HB       LYS   9  -4.101  -0.919   4.844
   93   1HG   LYS   9          2HG       LYS   9  -5.520  -2.498   3.893
   94   2HG   LYS   9          3HG       LYS   9  -5.721  -2.908   5.589
   95   1HD   LYS   9          2HD       LYS   9  -7.778  -1.319   5.493
   96   2HD   LYS   9          3HD       LYS   9  -7.523  -1.285   3.747
   97   1HE   LYS   9          2HE       LYS   9  -7.605  -3.840   3.751
   98   2HE   LYS   9          3HE       LYS   9  -8.005  -3.783   5.467
   99   1HZ   LYS   9          2HZ       LYS   9  -9.863  -2.206   4.302
  100   2HZ   LYS   9          3HZ       LYS   9  -9.646  -3.430   3.185
  101   3HZ   LYS   9          1HZ       LYS   9 -10.060  -3.779   4.733
  102    QB   LYS   9           QB       LYS   9  -4.858  -0.460   4.790
  103    QG   LYS   9           QG       LYS   9  -5.621  -2.702   4.741
  104    QD   LYS   9           QD       LYS   9  -7.650  -1.301   4.619
  105    QE   LYS   9           QE       LYS   9  -7.805  -3.811   4.609
  106    QZ   LYS   9           QZ       LYS   9  -9.857  -3.139   4.073
  107    NH1  ARG  10           NH2      ARG  10   3.090  -0.925  10.303
  108    NH2  ARG  10           NH1      ARG  10   4.048   0.991   9.407
  109    H    ARG  10           HN       ARG  10  -2.529  -0.352   6.819
  110    HA   ARG  10           HA       ARG  10  -1.650  -2.931   7.523
  111   1HB   ARG  10          2HB       ARG  10  -0.210  -1.272   6.553
  112   2HB   ARG  10          3HB       ARG  10  -0.345  -0.226   7.984
  113   1HG   ARG  10          2HG       ARG  10   0.792  -1.719   9.361
  114   2HG   ARG  10          3HG       ARG  10   0.641  -3.038   8.190
  115   1HD   ARG  10          2HD       ARG  10   2.804  -2.458   7.901
  116   2HD   ARG  10          3HD       ARG  10   2.049  -1.656   6.551
  117    HE   ARG  10           HE       ARG  10   3.063   0.240   7.289
  118   1HH1  ARG  10          2HH2      ARG  10   2.602  -1.817  10.178
  119   2HH1  ARG  10          1HH2      ARG  10   3.431  -0.719  11.230
  120   1HH2  ARG  10          2HH1      ARG  10   4.242   1.571   8.596
  121   2HH2  ARG  10          1HH1      ARG  10   4.516   1.183  10.280
  122    QB   ARG  10           QB       ARG  10  -0.278  -0.749   7.269
  123    QG   ARG  10           QG       ARG  10   0.716  -2.379   8.776
  124    QD   ARG  10           QD       ARG  10   2.427  -2.057   7.225
  125    QH1  ARG  10           QH2      ARG  10   3.016  -1.268  10.703
  126    QH2  ARG  10           QH1      ARG  10   4.379   1.378   9.438
  127    H    ILE  11           HN       ILE  11  -2.819  -0.267   9.609
  128    HA   ILE  11           HA       ILE  11  -2.093  -1.534  12.095
  129    HB   ILE  11           HB       ILE  11  -4.266   0.524  11.609
  130   1HG1  ILE  11          2HG1      ILE  11  -2.428   1.798  11.104
  131   2HG1  ILE  11          3HG1      ILE  11  -2.475   1.935  12.829
  132   1HG2  ILE  11          2HG2      ILE  11  -2.990  -0.563  14.136
  133   2HG2  ILE  11          3HG2      ILE  11  -3.966   0.918  14.072
  134   3HG2  ILE  11          1HG2      ILE  11  -4.701  -0.624  13.661
  135   1HD1  ILE  11          3HD1      ILE  11  -0.696   0.189  13.039
  136   2HD1  ILE  11          1HD1      ILE  11  -0.569   0.165  11.259
  137   3HD1  ILE  11          2HD1      ILE  11  -0.190   1.639  12.152
  138    QG1  ILE  11           QG1      ILE  11  -2.451   1.867  11.967
  139    QG2  ILE  11           QG2      ILE  11  -3.885  -0.089  13.957
  140    QD1  ILE  11           QD1      ILE  11  -0.484   0.664  12.150
  141    H    GLN  12           HN       GLN  12  -5.216  -1.329  10.277
  142    HA   GLN  12           HA       GLN  12  -6.544  -3.094  12.039
  143   1HB   GLN  12          2HB       GLN  12  -8.351  -3.128  10.699
  144   2HB   GLN  12          3HB       GLN  12  -7.580  -1.631  10.178
  145   1HG   GLN  12          2HG       GLN  12  -6.732  -2.797   8.167
  146   2HG   GLN  12          3HG       GLN  12  -7.424  -4.323   8.727
  147   1HE2  GLN  12          2HE2      GLN  12 -10.709  -3.574   7.655
  148   2HE2  GLN  12          1HE2      GLN  12  -9.664  -4.702   8.493
  149    QB   GLN  12           QB       GLN  12  -7.965  -2.380  10.439
  150    QG   GLN  12           QG       GLN  12  -7.078  -3.559   8.447
  151    QE2  GLN  12           QE2      GLN  12 -10.186  -4.138   8.074
  152    H    LEU  13           HN       LEU  13  -4.548  -3.885   9.236
  153    HA   LEU  13           HA       LEU  13  -4.844  -6.781   9.408
  154   1HB   LEU  13          2HB       LEU  13  -3.109  -4.791   7.986
  155   2HB   LEU  13          3HB       LEU  13  -2.401  -6.353   8.227
  156    HG   LEU  13           HG       LEU  13  -3.656  -5.794   6.043
  157   1HD1  LEU  13          3HD1      LEU  13  -2.886  -8.176   7.113
  158   2HD1  LEU  13          1HD1      LEU  13  -4.620  -8.465   6.956
  159   3HD1  LEU  13          2HD1      LEU  13  -3.676  -7.995   5.538
  160   1HD2  LEU  13          3HD2      LEU  13  -5.792  -5.063   7.108
  161   2HD2  LEU  13          1HD2      LEU  13  -5.987  -6.347   5.897
  162   3HD2  LEU  13          2HD2      LEU  13  -6.089  -6.744   7.612
  163    QB   LEU  13           QB       LEU  13  -2.754  -5.572   8.107
  164    QD1  LEU  13           QD1      LEU  13  -3.727  -8.212   6.536
  165    QD2  LEU  13           QD2      LEU  13  -5.956  -6.052   6.873
  166    QQD  LEU  13           QQD      LEU  13  -4.841  -7.131   6.704
  167    H    GLY  14           HN       GLY  14  -2.687  -4.389  10.918
  168   1HA   GLY  14          1HA       GLY  14  -1.428  -4.561  12.808
  169   2HA   GLY  14          2HA       GLY  14  -1.966  -6.235  13.033
  170    QA   GLY  14           QA       GLY  14  -1.697  -5.399  12.921
  171    H    LEU  15           HN       LEU  15  -0.248  -4.582  10.325
  172    HA   LEU  15           HA       LEU  15   2.007  -6.572  10.618
  173   1HB   LEU  15          2HB       LEU  15   0.633  -5.676   8.062
  174   2HB   LEU  15          3HB       LEU  15   2.100  -6.652   8.139
  175    HG   LEU  15           HG       LEU  15  -0.648  -7.507   9.154
  176   1HD1  LEU  15          2HD1      LEU  15  -0.361  -7.436   6.717
  177   2HD1  LEU  15          3HD1      LEU  15   1.068  -8.493   6.844
  178   3HD1  LEU  15          1HD1      LEU  15  -0.533  -9.100   7.312
  179   1HD2  LEU  15          3HD2      LEU  15   2.105  -8.770   9.404
  180   2HD2  LEU  15          1HD2      LEU  15   0.785  -8.709  10.592
  181   3HD2  LEU  15          2HD2      LEU  15   0.676  -9.798   9.212
  182    QB   LEU  15           QB       LEU  15   1.366  -6.165   8.100
  183    QD1  LEU  15           QD1      LEU  15   0.058  -8.343   6.957
  184    QD2  LEU  15           QD2      LEU  15   1.189  -9.092   9.736
  185    QQD  LEU  15           QQD      LEU  15   0.623  -8.718   8.347
  186    H    ASN  16           HN       ASN  16   3.824  -5.844   9.009
  187    HA   ASN  16           HA       ASN  16   4.416  -2.957   9.507
  188   1HB   ASN  16          2HB       ASN  16   6.719  -3.406   9.643
  189   2HB   ASN  16          3HB       ASN  16   5.908  -4.461  10.805
  190   1HD2  ASN  16          2HD2      ASN  16   6.557  -7.480   8.978
  191   2HD2  ASN  16          1HD2      ASN  16   5.566  -6.637  10.166
  192    QB   ASN  16           QB       ASN  16   6.313  -3.934  10.224
  193    QD2  ASN  16           QD2      ASN  16   6.062  -7.058   9.572
  194    H    GLN  17           HN       GLN  17   6.037  -2.186   7.939
  195    HA   GLN  17           HA       GLN  17   4.777  -2.171   5.355
  196   1HB   GLN  17          2HB       GLN  17   7.157  -0.866   6.606
  197   2HB   GLN  17          3HB       GLN  17   7.144  -1.052   4.833
  198   1HG   GLN  17          2HG       GLN  17   4.827   0.159   5.012
  199   2HG   GLN  17          3HG       GLN  17   5.358   0.551   6.643
  200   1HE2  GLN  17          2HE2      GLN  17   7.017   3.388   5.335
  201   2HE2  GLN  17          1HE2      GLN  17   5.618   2.782   6.236
  202    QB   GLN  17           QB       GLN  17   7.151  -0.959   5.719
  203    QG   GLN  17           QG       GLN  17   5.092   0.355   5.827
  204    QE2  GLN  17           QE2      GLN  17   6.317   3.085   5.785
  205    H    ALA  18           HN       ALA  18   7.623  -3.939   6.659
  206    HA   ALA  18           HA       ALA  18   8.599  -4.752   4.083
  207   1HB   ALA  18          3HB       ALA  18   9.853  -4.560   6.357
  208   2HB   ALA  18          1HB       ALA  18   9.218  -6.191   6.670
  209   3HB   ALA  18          2HB       ALA  18  10.244  -5.903   5.260
  210    QB   ALA  18           QB       ALA  18   9.772  -5.551   6.096
  211    H    GLU  19           HN       GLU  19   6.603  -6.242   6.611
  212    HA   GLU  19           HA       GLU  19   5.835  -8.659   5.329
  213   1HB   GLU  19          2HB       GLU  19   4.712  -6.849   7.398
  214   2HB   GLU  19          3HB       GLU  19   3.482  -7.696   6.485
  215   1HG   GLU  19          2HG       GLU  19   5.861  -9.155   7.705
  216   2HG   GLU  19          3HG       GLU  19   4.341  -8.890   8.573
  217    QB   GLU  19           QB       GLU  19   4.098  -7.272   6.942
  218    QG   GLU  19           QG       GLU  19   5.102  -9.023   8.139
  219    H    LEU  20           HN       LEU  20   4.256  -5.439   5.109
  220    HA   LEU  20           HA       LEU  20   2.457  -6.167   3.093
  221   1HB   LEU  20          2HB       LEU  20   2.797  -3.979   4.560
  222   2HB   LEU  20          3HB       LEU  20   3.525  -3.360   3.079
  223    HG   LEU  20           HG       LEU  20   0.740  -4.641   3.293
  224   1HD1  LEU  20          1HD1      LEU  20   1.565  -1.726   3.406
  225   2HD1  LEU  20          2HD1      LEU  20  -0.099  -2.291   3.155
  226   3HD1  LEU  20          3HD1      LEU  20   0.738  -2.674   4.666
  227   1HD2  LEU  20          2HD2      LEU  20   2.151  -3.095   1.084
  228   2HD2  LEU  20          3HD2      LEU  20   1.465  -4.741   1.031
  229   3HD2  LEU  20          1HD2      LEU  20   0.395  -3.348   1.136
  230    QB   LEU  20           QB       LEU  20   3.161  -3.670   3.819
  231    QD1  LEU  20           QD1      LEU  20   0.735  -2.230   3.743
  232    QD2  LEU  20           QD2      LEU  20   1.338  -3.728   1.084
  233    QQD  LEU  20           QQD      LEU  20   1.035  -2.979   2.413
  234    H    ALA  21           HN       ALA  21   5.830  -5.016   2.743
  235    HA   ALA  21           HA       ALA  21   5.930  -4.963  -0.081
  236   1HB   ALA  21          3HB       ALA  21   7.693  -4.167   1.708
  237   2HB   ALA  21          1HB       ALA  21   8.336  -5.809   1.527
  238   3HB   ALA  21          2HB       ALA  21   8.211  -4.754   0.116
  239    QB   ALA  21           QB       ALA  21   8.080  -4.910   1.117
  240    H    GLN  22           HN       GLN  22   6.531  -7.676   2.209
  241    HA   GLN  22           HA       GLN  22   7.409  -9.537   0.268
  242   1HB   GLN  22          2HB       GLN  22   7.972 -10.220   2.339
  243   2HB   GLN  22          3HB       GLN  22   6.530  -9.583   3.126
  244   1HG   GLN  22          2HG       GLN  22   5.220 -11.412   2.613
  245   2HG   GLN  22          3HG       GLN  22   6.293 -11.962   1.301
  246   1HE2  GLN  22          2HE2      GLN  22   8.098 -14.109   3.398
  247   2HE2  GLN  22          1HE2      GLN  22   7.628 -13.657   1.767
  248    QB   GLN  22           QB       GLN  22   7.252  -9.902   2.732
  249    QG   GLN  22           QG       GLN  22   5.757 -11.687   1.957
  250    QE2  GLN  22           QE2      GLN  22   7.863 -13.883   2.582
  251    H    LYS  23           HN       LYS  23   4.128  -9.166   1.758
  252    HA   LYS  23           HA       LYS  23   2.985 -11.121  -0.008
  253   1HB   LYS  23          2HB       LYS  23   0.779  -9.857   0.502
  254   2HB   LYS  23          3HB       LYS  23   1.573 -10.827   1.743
  255   1HG   LYS  23          2HG       LYS  23   2.259  -9.048   3.002
  256   2HG   LYS  23          3HG       LYS  23   2.345  -7.961   1.604
  257   1HD   LYS  23          2HD       LYS  23   0.415  -7.071   2.037
  258   2HD   LYS  23          3HD       LYS  23  -0.400  -8.648   1.902
  259   1HE   LYS  23          2HE       LYS  23  -0.137  -9.080   4.232
  260   2HE   LYS  23          3HE       LYS  23   0.942  -7.693   4.464
  261   1HZ   LYS  23          1HZ       LYS  23  -1.747  -7.279   3.374
  262   2HZ   LYS  23          2HZ       LYS  23  -1.548  -7.461   5.004
  263   3HZ   LYS  23          3HZ       LYS  23  -0.788  -6.231   4.212
  264    QB   LYS  23           QB       LYS  23   1.176 -10.342   1.123
  265    QG   LYS  23           QG       LYS  23   2.302  -8.504   2.303
  266    QD   LYS  23           QD       LYS  23   0.007  -7.859   1.969
  267    QE   LYS  23           QE       LYS  23   0.403  -8.386   4.349
  268    QZ   LYS  23           QZ       LYS  23  -1.361  -6.991   4.197
  269    H    VAL  24           HN       VAL  24   3.520  -7.628  -0.529
  270    HA   VAL  24           HA       VAL  24   2.090  -7.588  -3.063
  271    HB   VAL  24           HB       VAL  24   4.159  -5.793  -1.770
  272   1HG1  VAL  24          1HG1      VAL  24   2.551  -5.347  -4.321
  273   2HG1  VAL  24          2HG1      VAL  24   3.391  -4.056  -3.439
  274   3HG1  VAL  24          3HG1      VAL  24   4.320  -5.358  -4.194
  275   1HG2  VAL  24          2HG2      VAL  24   1.736  -6.052  -0.832
  276   2HG2  VAL  24          3HG2      VAL  24   2.383  -4.435  -1.159
  277   3HG2  VAL  24          1HG2      VAL  24   1.250  -5.204  -2.303
  278    QG1  VAL  24           QG1      VAL  24   3.420  -4.920  -3.985
  279    QG2  VAL  24           QG2      VAL  24   1.789  -5.230  -1.432
  280    QQG  VAL  24           QQG      VAL  24   2.605  -5.075  -2.708
  281    H    GLY  25           HN       GLY  25   5.240  -8.810  -2.090
  282   1HA   GLY  25          1HA       GLY  25   6.908  -9.775  -3.309
  283   2HA   GLY  25          2HA       GLY  25   5.878  -9.722  -4.752
  284    QA   GLY  25           QA       GLY  25   6.393  -9.748  -4.032
  285    H    THR  26           HN       THR  26   7.154  -7.175  -2.567
  286    HA   THR  26           HA       THR  26   8.849  -6.074  -4.739
  287    HB   THR  26           HB       THR  26   6.648  -4.960  -4.887
  288    HG1  THR  26          1HG       THR  26   7.440  -2.973  -5.066
  289   1HG2  THR  26          1HG2      THR  26   6.085  -5.021  -2.445
  290   2HG2  THR  26          2HG2      THR  26   7.255  -3.734  -2.156
  291   3HG2  THR  26          3HG2      THR  26   5.851  -3.434  -3.194
  292    QG2  THR  26           QG2      THR  26   6.397  -4.063  -2.598
  293    H    THR  27           HN       THR  27   9.399  -3.734  -3.199
  294    HA   THR  27           HA       THR  27  11.060  -4.937  -0.983
  295    HB   THR  27           HB       THR  27  12.740  -3.187  -1.561
  296    HG1  THR  27          1HG       THR  27  11.201  -2.874  -3.922
  297   1HG2  THR  27          2HG2      THR  27  12.999  -5.495  -2.395
  298   2HG2  THR  27          3HG2      THR  27  12.058  -5.093  -3.848
  299   3HG2  THR  27          1HG2      THR  27  13.626  -4.313  -3.560
  300    QG2  THR  27           QG2      THR  27  12.894  -4.967  -3.268
  301    H    GLN  28           HN       GLN  28  11.449  -3.611   0.838
  302    HA   GLN  28           HA       GLN  28   9.426  -2.166   1.979
  303   1HB   GLN  28          2HB       GLN  28  11.516  -2.879   3.135
  304   2HB   GLN  28          3HB       GLN  28  12.429  -1.681   2.214
  305   1HG   GLN  28          2HG       GLN  28  12.136  -0.745   4.340
  306   2HG   GLN  28          3HG       GLN  28  10.996   0.139   3.325
  307   1HE2  GLN  28          2HE2      GLN  28   9.268  -0.708   6.500
  308   2HE2  GLN  28          1HE2      GLN  28  10.581   0.325   5.975
  309    QB   GLN  28           QB       GLN  28  11.972  -2.279   2.674
  310    QG   GLN  28           QG       GLN  28  11.566  -0.302   3.833
  311    QE2  GLN  28           QE2      GLN  28   9.924  -0.191   6.237
  312    H    GLN  29           HN       GLN  29  12.051  -0.837  -0.067
  313    HA   GLN  29           HA       GLN  29  11.404   1.843   0.219
  314   1HB   GLN  29          2HB       GLN  29  13.371   0.468  -1.085
  315   2HB   GLN  29          3HB       GLN  29  12.407   0.968  -2.475
  316   1HG   GLN  29          2HG       GLN  29  14.110   2.631  -2.045
  317   2HG   GLN  29          3HG       GLN  29  12.558   3.359  -1.596
  318   1HE2  GLN  29          2HE2      GLN  29  13.620   3.864   1.787
  319   2HE2  GLN  29          1HE2      GLN  29  12.526   4.358   0.586
  320    QB   GLN  29           QB       GLN  29  12.890   0.718  -1.780
  321    QG   GLN  29           QG       GLN  29  13.334   2.995  -1.820
  322    QE2  GLN  29           QE2      GLN  29  13.073   4.111   1.187
  323    H    SER  30           HN       SER  30   9.919  -0.544  -1.947
  324    HA   SER  30           HA       SER  30   8.381   1.325  -3.515
  325   1HB   SER  30          2HB       SER  30   8.113  -1.628  -2.971
  326   2HB   SER  30          3HB       SER  30   6.993  -0.733  -3.974
  327    HG   SER  30           HG       SER  30   8.925  -1.769  -5.011
  328    QB   SER  30           QB       SER  30   7.553  -1.181  -3.472
  329    H    ILE  31           HN       ILE  31   7.958  -0.290  -0.353
  330    HA   ILE  31           HA       ILE  31   5.130   0.482  -0.188
  331    HB   ILE  31           HB       ILE  31   6.954  -0.566   1.998
  332   1HG1  ILE  31          2HG1      ILE  31   6.959  -2.262   0.302
  333   2HG1  ILE  31          3HG1      ILE  31   5.824  -2.717   1.562
  334   1HG2  ILE  31          3HG2      ILE  31   4.898   0.541   2.803
  335   2HG2  ILE  31          1HG2      ILE  31   3.904  -0.484   1.778
  336   3HG2  ILE  31          2HG2      ILE  31   4.855  -1.209   3.084
  337   1HD1  ILE  31          1HD1      ILE  31   4.012  -1.611  -0.081
  338   2HD1  ILE  31          2HD1      ILE  31   5.279  -1.902  -1.283
  339   3HD1  ILE  31          3HD1      ILE  31   4.595  -3.243  -0.353
  340    QG1  ILE  31           QG1      ILE  31   6.392  -2.489   0.932
  341    QG2  ILE  31           QG2      ILE  31   4.553  -0.384   2.555
  342    QD1  ILE  31           QD1      ILE  31   4.629  -2.253  -0.572
  343    H    GLU  32           HN       GLU  32   8.253   1.588   1.164
  344    HA   GLU  32           HA       GLU  32   7.292   3.757   2.690
  345   1HB   GLU  32          2HB       GLU  32   9.581   3.161   2.896
  346   2HB   GLU  32          3HB       GLU  32   9.890   3.380   1.163
  347   1HG   GLU  32          2HG       GLU  32   9.586   5.805   1.339
  348   2HG   GLU  32          3HG       GLU  32   9.124   5.658   3.040
  349    QB   GLU  32           QB       GLU  32   9.736   3.271   2.029
  350    QG   GLU  32           QG       GLU  32   9.355   5.732   2.190
  351    H    GLN  33           HN       GLN  33   8.484   3.849  -0.726
  352    HA   GLN  33           HA       GLN  33   7.761   6.516  -1.161
  353   1HB   GLN  33          2HB       GLN  33   7.798   6.095  -3.536
  354   2HB   GLN  33          3HB       GLN  33   9.116   5.198  -2.722
  355   1HG   GLN  33          2HG       GLN  33   7.689   3.216  -2.833
  356   2HG   GLN  33          3HG       GLN  33   6.487   4.083  -3.800
  357   1HE2  GLN  33          2HE2      GLN  33  10.169   3.244  -5.508
  358   2HE2  GLN  33          1HE2      GLN  33  10.047   3.485  -3.768
  359    QB   GLN  33           QB       GLN  33   8.457   5.647  -3.130
  360    QG   GLN  33           QG       GLN  33   7.087   3.650  -3.316
  361    QE2  GLN  33           QE2      GLN  33  10.109   3.364  -4.638
  362    H    LEU  34           HN       LEU  34   5.810   3.575  -1.482
  363    HA   LEU  34           HA       LEU  34   3.505   4.983  -2.286
  364   1HB   LEU  34          2HB       LEU  34   3.784   2.545  -2.560
  365   2HB   LEU  34          3HB       LEU  34   3.482   2.337  -0.825
  366    HG   LEU  34           HG       LEU  34   1.244   3.324  -1.084
  367   1HD1  LEU  34          3HD1      LEU  34   2.160   3.841  -3.923
  368   2HD1  LEU  34          1HD1      LEU  34   0.430   3.668  -3.549
  369   3HD1  LEU  34          2HD1      LEU  34   1.368   4.957  -2.795
  370   1HD2  LEU  34          3HD2      LEU  34   1.894   0.845  -1.757
  371   2HD2  LEU  34          1HD2      LEU  34   0.249   1.479  -1.956
  372   3HD2  LEU  34          2HD2      LEU  34   1.321   1.369  -3.361
  373    QB   LEU  34           QB       LEU  34   3.633   2.440  -1.692
  374    QD1  LEU  34           QD1      LEU  34   1.320   4.156  -3.422
  375    QD2  LEU  34           QD2      LEU  34   1.155   1.231  -2.358
  376    QQD  LEU  34           QQD      LEU  34   1.237   2.693  -2.890
  377    H    GLU  35           HN       GLU  35   4.506   4.148   1.109
  378    HA   GLU  35           HA       GLU  35   2.245   5.265   2.375
  379   1HB   GLU  35          2HB       GLU  35   5.040   4.705   3.338
  380   2HB   GLU  35          3HB       GLU  35   4.156   5.969   4.184
  381   1HG   GLU  35          2HG       GLU  35   2.230   4.280   4.440
  382   2HG   GLU  35          3HG       GLU  35   3.423   3.049   4.026
  383    QB   GLU  35           QB       GLU  35   4.598   5.336   3.761
  384    QG   GLU  35           QG       GLU  35   2.826   3.664   4.232
  385    H    ASN  36           HN       ASN  36   5.352   6.909   1.477
  386    HA   ASN  36           HA       ASN  36   3.964   9.510   2.013
  387   1HB   ASN  36          2HB       ASN  36   6.136  10.565   1.824
  388   2HB   ASN  36          3HB       ASN  36   6.079   9.314   3.062
  389   1HD2  ASN  36          2HD2      ASN  36   8.231   8.436  -0.357
  390   2HD2  ASN  36          1HD2      ASN  36   6.771   9.427  -0.504
  391    QB   ASN  36           QB       ASN  36   6.107   9.940   2.442
  392    QD2  ASN  36           QD2      ASN  36   7.501   8.932  -0.431
  393    H    GLY  37           HN       GLY  37   3.313   7.769  -0.334
  394   1HA   GLY  37          1HA       GLY  37   2.883   7.998  -2.585
  395   2HA   GLY  37          2HA       GLY  37   2.290   9.574  -2.051
  396    QA   GLY  37           QA       GLY  37   2.588   8.786  -2.318
  397    H    LYS  38           HN       LYS  38   5.574   8.244  -2.477
  398    HA   LYS  38           HA       LYS  38   6.541  10.730  -3.642
  399   1HB   LYS  38          2HB       LYS  38   7.689   8.227  -2.693
  400   2HB   LYS  38          3HB       LYS  38   8.461   8.695  -4.190
  401   1HG   LYS  38          2HG       LYS  38   8.149  10.692  -1.908
  402   2HG   LYS  38          3HG       LYS  38   9.388   9.441  -1.915
  403   1HD   LYS  38          2HD       LYS  38  10.473  11.304  -2.694
  404   2HD   LYS  38          3HD       LYS  38  10.268  10.292  -4.108
  405   1HE   LYS  38          2HE       LYS  38   8.157  12.412  -3.582
  406   2HE   LYS  38          3HE       LYS  38   9.773  12.985  -3.976
  407   1HZ   LYS  38          2HZ       LYS  38   9.716  11.752  -6.011
  408   2HZ   LYS  38          3HZ       LYS  38   8.212  11.171  -5.695
  409   3HZ   LYS  38          1HZ       LYS  38   8.434  12.773  -5.921
  410    QB   LYS  38           QB       LYS  38   8.075   8.461  -3.441
  411    QG   LYS  38           QG       LYS  38   8.769  10.067  -1.912
  412    QD   LYS  38           QD       LYS  38  10.370  10.798  -3.402
  413    QE   LYS  38           QE       LYS  38   8.966  12.698  -3.779
  414    QZ   LYS  38           QZ       LYS  38   8.788  11.899  -5.876
  415    H    THR  39           HN       THR  39   5.153   7.857  -4.980
  416    HA   THR  39           HA       THR  39   6.036   8.571  -7.735
  417    HB   THR  39           HB       THR  39   5.141   5.943  -6.453
  418    HG1  THR  39          1HG       THR  39   7.303   6.456  -6.229
  419   1HG2  THR  39          2HG2      THR  39   5.546   6.572  -9.405
  420   2HG2  THR  39          3HG2      THR  39   5.592   4.944  -8.709
  421   3HG2  THR  39          1HG2      THR  39   4.101   5.883  -8.606
  422    QG2  THR  39           QG2      THR  39   5.080   5.800  -8.907
  423    H    LYS  40           HN       LYS  40   4.436   8.781  -9.314
  424    HA   LYS  40           HA       LYS  40   1.880   9.719  -8.423
  425   1HB   LYS  40          2HB       LYS  40   1.413  10.204 -10.688
  426   2HB   LYS  40          3HB       LYS  40   3.085  10.632 -10.342
  427   1HG   LYS  40          2HG       LYS  40   3.680   8.305 -11.399
  428   2HG   LYS  40          3HG       LYS  40   2.006   8.336 -12.004
  429   1HD   LYS  40          2HD       LYS  40   2.576  10.654 -12.981
  430   2HD   LYS  40          3HD       LYS  40   4.263  10.293 -12.558
  431   1HE   LYS  40          2HE       LYS  40   3.834   8.044 -13.903
  432   2HE   LYS  40          3HE       LYS  40   2.430   8.901 -14.557
  433   1HZ   LYS  40          3HZ       LYS  40   3.994  10.616 -15.330
  434   2HZ   LYS  40          1HZ       LYS  40   5.258   9.711 -14.789
  435   3HZ   LYS  40          2HZ       LYS  40   4.297   9.144 -15.990
  436    QB   LYS  40           QB       LYS  40   2.249  10.418 -10.515
  437    QG   LYS  40           QG       LYS  40   2.843   8.321 -11.701
  438    QD   LYS  40           QD       LYS  40   3.419  10.473 -12.769
  439    QE   LYS  40           QE       LYS  40   3.132   8.472 -14.230
  440    QZ   LYS  40           QZ       LYS  40   4.516   9.824 -15.370
  441    NH1  ARG  41           NH2      ARG  41   2.096   4.038 -13.864
  442    NH2  ARG  41           NH1      ARG  41   0.872   4.230 -15.831
  443    H    ARG  41           HN       ARG  41   2.802   6.692 -10.214
  444    HA   ARG  41           HA       ARG  41   0.297   5.439  -9.253
  445   1HB   ARG  41          2HB       ARG  41  -0.298   6.669 -11.273
  446   2HB   ARG  41          3HB       ARG  41   0.909   5.820 -12.224
  447   1HG   ARG  41          2HG       ARG  41  -1.172   4.296 -10.639
  448   2HG   ARG  41          3HG       ARG  41  -1.667   5.089 -12.120
  449   1HD   ARG  41          2HD       ARG  41   0.515   2.930 -12.016
  450   2HD   ARG  41          3HD       ARG  41  -1.166   2.679 -12.372
  451    HE   ARG  41           HE       ARG  41  -1.084   3.734 -14.380
  452   1HH1  ARG  41          2HH2      ARG  41   2.139   3.934 -12.847
  453   2HH1  ARG  41          1HH2      ARG  41   2.963   4.171 -14.357
  454   1HH2  ARG  41          2HH1      ARG  41  -0.011   4.202 -16.322
  455   2HH2  ARG  41          1HH1      ARG  41   1.704   4.414 -16.372
  456    QB   ARG  41           QB       ARG  41   0.305   6.244 -11.748
  457    QG   ARG  41           QG       ARG  41  -1.419   4.693 -11.380
  458    QD   ARG  41           QD       ARG  41  -0.325   2.805 -12.194
  459    QH1  ARG  41           QH2      ARG  41   2.551   4.053 -13.602
  460    QH2  ARG  41           QH1      ARG  41   0.847   4.309 -16.347
  461    HA   PRO  42           HA       PRO  42   3.899   2.647  -9.348
  462   1HB   PRO  42          2HB       PRO  42   3.111   0.876  -7.392
  463   2HB   PRO  42          3HB       PRO  42   3.853   2.465  -7.064
  464   1HG   PRO  42          2HG       PRO  42   0.970   1.651  -6.928
  465   2HG   PRO  42          3HG       PRO  42   1.847   2.772  -5.870
  466   1HD   PRO  42          2HD       PRO  42   0.191   3.545  -7.976
  467   2HD   PRO  42          3HD       PRO  42   1.476   4.574  -7.322
  468    QB   PRO  42           QB       PRO  42   3.481   1.670  -7.228
  469    QG   PRO  42           QG       PRO  42   1.409   2.211  -6.399
  470    QD   PRO  42           QD       PRO  42   0.833   4.059  -7.649
  471    NH1  ARG  43           NH2      ARG  43   7.143  -3.278 -13.058
  472    NH2  ARG  43           NH1      ARG  43   8.660  -4.609 -11.915
  473    H    ARG  43           HN       ARG  43   4.272   0.479  -9.988
  474    HA   ARG  43           HA       ARG  43   2.353  -0.614 -11.840
  475   1HB   ARG  43          2HB       ARG  43   4.055  -2.318 -12.236
  476   2HB   ARG  43          3HB       ARG  43   4.776  -0.706 -12.176
  477   1HG   ARG  43          2HG       ARG  43   5.019  -1.513  -9.537
  478   2HG   ARG  43          3HG       ARG  43   5.129  -3.060 -10.351
  479   1HD   ARG  43          2HD       ARG  43   6.894  -1.010 -11.606
  480   2HD   ARG  43          3HD       ARG  43   7.113  -1.083  -9.877
  481    HE   ARG  43           HE       ARG  43   8.082  -3.119  -9.977
  482   1HH1  ARG  43          2HH2      ARG  43   6.464  -2.532 -13.034
  483   2HH1  ARG  43          1HH2      ARG  43   7.284  -3.785 -13.918
  484   1HH2  ARG  43          2HH1      ARG  43   9.153  -4.854 -11.068
  485   2HH2  ARG  43          1HH1      ARG  43   8.831  -5.168 -12.740
  486    QB   ARG  43           QB       ARG  43   4.416  -1.511 -12.206
  487    QG   ARG  43           QG       ARG  43   5.073  -2.286  -9.944
  488    QD   ARG  43           QD       ARG  43   7.004  -1.046 -10.741
  489    QH1  ARG  43           QH2      ARG  43   6.874  -3.159 -13.476
  490    QH2  ARG  43           QH1      ARG  43   8.992  -5.011 -11.904
  491    H    PHE  44           HN       PHE  44   3.186  -1.264  -8.481
  492    HA   PHE  44           HA       PHE  44   1.683  -3.798  -8.439
  493   1HB   PHE  44          2HB       PHE  44   2.528  -3.759  -6.018
  494   2HB   PHE  44          3HB       PHE  44   3.721  -3.914  -7.283
  495    HD1  PHE  44          2HD       PHE  44   2.156  -1.468  -4.902
  496    HD2  PHE  44          1HD       PHE  44   5.552  -2.378  -7.396
  497    HE1  PHE  44          2HE       PHE  44   3.331   0.554  -4.070
  498    HE2  PHE  44          1HE       PHE  44   6.647  -0.263  -6.674
  499    HZ   PHE  44           HZ       PHE  44   5.524   1.207  -5.017
  500    QB   PHE  44           QB       PHE  44   3.125  -3.837  -6.650
  501    QR   PHE  44           QR       PHE  44   4.422  -0.888  -5.761
  502    H    LEU  45           HN       LEU  45   0.244  -1.174  -8.913
  503    HA   LEU  45           HA       LEU  45  -1.301  -0.583  -6.629
  504   1HB   LEU  45          2HB       LEU  45  -1.668  -0.338  -9.577
  505   2HB   LEU  45          3HB       LEU  45  -3.166  -0.366  -8.639
  506    HG   LEU  45           HG       LEU  45  -0.852   1.518  -8.127
  507   1HD1  LEU  45          1HD1      LEU  45  -1.919   1.893 -10.299
  508   2HD1  LEU  45          2HD1      LEU  45  -3.516   1.959  -9.516
  509   3HD1  LEU  45          3HD1      LEU  45  -2.282   3.191  -9.143
  510   1HD2  LEU  45          2HD2      LEU  45  -3.681   1.352  -6.966
  511   2HD2  LEU  45          3HD2      LEU  45  -2.156   1.319  -6.056
  512   3HD2  LEU  45          1HD2      LEU  45  -2.669   2.802  -6.847
  513    QB   LEU  45           QB       LEU  45  -2.417  -0.353  -9.108
  514    QD1  LEU  45           QD1      LEU  45  -2.572   2.347  -9.653
  515    QD2  LEU  45           QD2      LEU  45  -2.835   1.824  -6.623
  516    QQD  LEU  45           QQD      LEU  45  -2.704   2.086  -8.138
  517    HA   PRO  46           HA       PRO  46  -4.487  -3.920  -7.707
  518   1HB   PRO  46          2HB       PRO  46  -3.795  -6.072  -9.295
  519   2HB   PRO  46          3HB       PRO  46  -4.573  -4.577  -9.883
  520   1HG   PRO  46          2HG       PRO  46  -1.676  -5.361 -10.048
  521   2HG   PRO  46          3HG       PRO  46  -2.669  -4.492 -11.249
  522   1HD   PRO  46          2HD       PRO  46  -0.898  -3.306  -9.527
  523   2HD   PRO  46          3HD       PRO  46  -2.307  -2.448 -10.187
  524    QB   PRO  46           QB       PRO  46  -4.184  -5.324  -9.589
  525    QG   PRO  46           QG       PRO  46  -2.172  -4.927 -10.648
  526    QD   PRO  46           QD       PRO  46  -1.603  -2.877  -9.857
  527    H    GLU  47           HN       GLU  47  -1.132  -5.123  -7.758
  528    HA   GLU  47           HA       GLU  47  -1.336  -7.306  -6.026
  529   1HB   GLU  47          2HB       GLU  47   0.909  -5.283  -6.263
  530   2HB   GLU  47          3HB       GLU  47   1.066  -6.929  -5.648
  531   1HG   GLU  47          2HG       GLU  47   0.076  -6.523  -8.507
  532   2HG   GLU  47          3HG       GLU  47   1.783  -6.339  -8.110
  533    QB   GLU  47           QB       GLU  47   0.987  -6.106  -5.955
  534    QG   GLU  47           QG       GLU  47   0.929  -6.432  -8.309
  535    H    LEU  48           HN       LEU  48  -0.918  -3.793  -5.270
  536    HA   LEU  48           HA       LEU  48  -0.696  -4.210  -2.445
  537   1HB   LEU  48          2HB       LEU  48  -0.020  -2.166  -3.856
  538   2HB   LEU  48          3HB       LEU  48  -1.700  -1.688  -3.782
  539    HG   LEU  48           HG       LEU  48  -0.805  -0.473  -2.046
  540   1HD1  LEU  48          3HD1      LEU  48  -2.462  -1.900  -0.858
  541   2HD1  LEU  48          1HD1      LEU  48  -1.176  -3.067  -0.494
  542   3HD1  LEU  48          2HD1      LEU  48  -1.107  -1.430   0.171
  543   1HD2  LEU  48          3HD2      LEU  48   1.510  -1.385  -2.382
  544   2HD2  LEU  48          1HD2      LEU  48   1.118  -1.138  -0.671
  545   3HD2  LEU  48          2HD2      LEU  48   1.062  -2.761  -1.367
  546    QB   LEU  48           QB       LEU  48  -0.861  -1.927  -3.819
  547    QD1  LEU  48           QD1      LEU  48  -1.581  -2.133  -0.394
  548    QD2  LEU  48           QD2      LEU  48   1.230  -1.761  -1.473
  549    QQD  LEU  48           QQD      LEU  48  -0.176  -1.947  -0.933
  550    H    ALA  49           HN       ALA  49  -3.366  -3.256  -4.603
  551    HA   ALA  49           HA       ALA  49  -5.399  -2.927  -2.714
  552   1HB   ALA  49          1HB       ALA  49  -5.502  -2.340  -5.128
  553   2HB   ALA  49          2HB       ALA  49  -5.696  -4.060  -5.521
  554   3HB   ALA  49          3HB       ALA  49  -6.934  -3.215  -4.567
  555    QB   ALA  49           QB       ALA  49  -6.044  -3.205  -5.072
  556    H    SER  50           HN       SER  50  -4.391  -5.992  -4.348
  557    HA   SER  50           HA       SER  50  -6.292  -7.609  -2.893
  558   1HB   SER  50          2HB       SER  50  -4.873  -9.473  -3.778
  559   2HB   SER  50          3HB       SER  50  -5.433  -8.332  -5.022
  560    HG   SER  50           HG       SER  50  -3.229  -8.670  -5.323
  561    QB   SER  50           QB       SER  50  -5.153  -8.903  -4.400
  562    H    ALA  51           HN       ALA  51  -2.751  -7.072  -2.546
  563    HA   ALA  51           HA       ALA  51  -2.290  -8.649  -0.312
  564   1HB   ALA  51          1HB       ALA  51  -0.534  -7.647  -1.699
  565   2HB   ALA  51          2HB       ALA  51  -0.932  -6.032  -1.049
  566   3HB   ALA  51          3HB       ALA  51  -0.256  -7.285  -0.008
  567    QB   ALA  51           QB       ALA  51  -0.574  -6.988  -0.919
  568    H    LEU  52           HN       LEU  52  -3.724  -5.426  -0.334
  569    HA   LEU  52           HA       LEU  52  -3.893  -5.423   2.646
  570   1HB   LEU  52          2HB       LEU  52  -4.292  -3.370   0.468
  571   2HB   LEU  52          3HB       LEU  52  -5.191  -3.202   1.946
  572    HG   LEU  52           HG       LEU  52  -2.169  -3.205   1.608
  573   1HD1  LEU  52          1HD1      LEU  52  -4.183  -1.141   2.614
  574   2HD1  LEU  52          2HD1      LEU  52  -2.418  -0.932   2.618
  575   3HD1  LEU  52          3HD1      LEU  52  -3.309  -1.099   1.099
  576   1HD2  LEU  52          3HD2      LEU  52  -3.696  -3.626   4.173
  577   2HD2  LEU  52          1HD2      LEU  52  -2.164  -4.309   3.614
  578   3HD2  LEU  52          2HD2      LEU  52  -2.234  -2.641   4.180
  579    QB   LEU  52           QB       LEU  52  -4.741  -3.285   1.207
  580    QD1  LEU  52           QD1      LEU  52  -3.303  -1.057   2.110
  581    QD2  LEU  52           QD2      LEU  52  -2.697  -3.525   3.989
  582    QQD  LEU  52           QQD      LEU  52  -3.000  -2.292   3.050
  583    H    GLY  53           HN       GLY  53  -5.991  -5.805  -0.224
  584   1HA   GLY  53          1HA       GLY  53  -8.029  -6.885  -0.274
  585   2HA   GLY  53          2HA       GLY  53  -8.123  -6.904   1.492
  586    QA   GLY  53           QA       GLY  53  -8.076  -6.894   0.609
  587    H    VAL  54           HN       VAL  54  -7.963  -4.611  -1.248
  588    HA   VAL  54           HA       VAL  54 -10.369  -3.161  -0.410
  589    HB   VAL  54           HB       VAL  54  -9.148  -0.945  -0.625
  590   1HG1  VAL  54          1HG1      VAL  54  -9.835  -1.948   1.566
  591   2HG1  VAL  54          2HG1      VAL  54  -8.148  -2.522   1.739
  592   3HG1  VAL  54          3HG1      VAL  54  -8.503  -0.789   1.635
  593   1HG2  VAL  54          1HG2      VAL  54  -6.634  -2.645  -0.267
  594   2HG2  VAL  54          2HG2      VAL  54  -7.066  -1.668  -1.690
  595   3HG2  VAL  54          3HG2      VAL  54  -6.721  -0.890  -0.139
  596    QG1  VAL  54           QG1      VAL  54  -8.829  -1.753   1.647
  597    QG2  VAL  54           QG2      VAL  54  -6.807  -1.734  -0.698
  598    QQG  VAL  54           QQG      VAL  54  -7.818  -1.744   0.474
  599    H    SER  55           HN       SER  55 -10.674  -1.290  -2.176
  600    HA   SER  55           HA       SER  55 -10.392  -2.499  -4.820
  601   1HB   SER  55          2HB       SER  55 -11.770  -0.330  -5.288
  602   2HB   SER  55          3HB       SER  55 -12.512  -1.621  -4.327
  603    HG   SER  55           HG       SER  55 -11.271   0.719  -3.307
  604    QB   SER  55           QB       SER  55 -12.141  -0.975  -4.808
  605    H    VAL  56           HN       VAL  56  -8.985  -1.820  -6.352
  606    HA   VAL  56           HA       VAL  56  -6.756  -0.155  -5.964
  607    HB   VAL  56           HB       VAL  56  -8.314  -0.974  -8.457
  608   1HG1  VAL  56          3HG1      VAL  56  -5.768   0.690  -8.309
  609   2HG1  VAL  56          1HG1      VAL  56  -6.288  -0.203  -9.754
  610   3HG1  VAL  56          2HG1      VAL  56  -7.299   1.096  -9.126
  611   1HG2  VAL  56          2HG2      VAL  56  -7.025  -2.735  -7.239
  612   2HG2  VAL  56          3HG2      VAL  56  -6.355  -2.409  -8.840
  613   3HG2  VAL  56          1HG2      VAL  56  -5.557  -1.737  -7.406
  614    QG1  VAL  56           QG1      VAL  56  -6.452   0.528  -9.063
  615    QG2  VAL  56           QG2      VAL  56  -6.312  -2.294  -7.829
  616    QQG  VAL  56           QQG      VAL  56  -6.382  -0.883  -8.445
  617    H    ASP  57           HN       ASP  57  -9.985   0.770  -7.237
  618    HA   ASP  57           HA       ASP  57  -9.653   3.476  -7.760
  619   1HB   ASP  57          2HB       ASP  57 -11.770   2.358  -8.091
  620   2HB   ASP  57          3HB       ASP  57 -11.912   1.975  -6.362
  621    QB   ASP  57           QB       ASP  57 -11.842   2.166  -7.227
  622    CH2  TRP  58           CH2      TRP  58  -7.393   2.309   2.535
  623    H    TRP  58           HN       TRP  58 -10.004   1.958  -4.533
  624    HA   TRP  58           HA       TRP  58 -10.156   4.549  -3.209
  625   1HB   TRP  58          2HB       TRP  58 -11.350   2.671  -2.259
  626   2HB   TRP  58          3HB       TRP  58  -9.855   1.744  -2.127
  627    HD1  TRP  58           HD1      TRP  58 -11.587   4.780  -0.424
  628    HE1  TRP  58           HE1      TRP  58 -10.562   5.116   1.855
  629    HE3  TRP  58           HE3      TRP  58  -7.846   1.288  -0.690
  630    HZ2  TRP  58           HZ2      TRP  58  -8.535   3.846   3.523
  631    HZ3  TRP  58           HZ3      TRP  58  -6.312   0.983   1.240
  632    HH2  TRP  58           HH2      TRP  58  -6.609   2.283   3.279
  633    QB   TRP  58           QB       TRP  58 -10.603   2.208  -2.193
  634    H    LEU  59           HN       LEU  59  -7.746   1.979  -3.660
  635    HA   LEU  59           HA       LEU  59  -5.625   3.314  -2.291
  636   1HB   LEU  59          2HB       LEU  59  -5.841   1.027  -4.210
  637   2HB   LEU  59          3HB       LEU  59  -4.267   1.774  -4.096
  638    HG   LEU  59           HG       LEU  59  -5.854   0.512  -1.839
  639   1HD1  LEU  59          2HD1      LEU  59  -4.548  -0.855  -3.586
  640   2HD1  LEU  59          3HD1      LEU  59  -3.087  -0.129  -2.893
  641   3HD1  LEU  59          1HD1      LEU  59  -4.158  -1.133  -1.880
  642   1HD2  LEU  59          2HD2      LEU  59  -3.267   2.124  -1.708
  643   2HD2  LEU  59          3HD2      LEU  59  -4.704   2.279  -0.664
  644   3HD2  LEU  59          1HD2      LEU  59  -3.660   0.876  -0.512
  645    QB   LEU  59           QB       LEU  59  -5.054   1.400  -4.153
  646    QD1  LEU  59           QD1      LEU  59  -3.931  -0.706  -2.786
  647    QD2  LEU  59           QD2      LEU  59  -3.877   1.760  -0.961
  648    QQD  LEU  59           QQD      LEU  59  -3.904   0.528  -1.874
  649    H    LEU  60           HN       LEU  60  -6.864   3.737  -5.537
  650    HA   LEU  60           HA       LEU  60  -4.722   5.514  -6.380
  651   1HB   LEU  60          2HB       LEU  60  -7.518   4.924  -7.404
  652   2HB   LEU  60          3HB       LEU  60  -6.501   6.185  -8.098
  653    HG   LEU  60           HG       LEU  60  -5.560   3.313  -7.931
  654   1HD1  LEU  60          3HD1      LEU  60  -7.661   3.451  -9.239
  655   2HD1  LEU  60          1HD1      LEU  60  -6.965   4.753 -10.225
  656   3HD1  LEU  60          2HD1      LEU  60  -6.268   3.119 -10.281
  657   1HD2  LEU  60          3HD2      LEU  60  -4.667   5.829  -9.429
  658   2HD2  LEU  60          1HD2      LEU  60  -3.722   4.850  -8.293
  659   3HD2  LEU  60          2HD2      LEU  60  -4.151   4.207  -9.890
  660    QB   LEU  60           QB       LEU  60  -7.009   5.555  -7.752
  661    QD1  LEU  60           QD1      LEU  60  -6.965   3.774  -9.915
  662    QD2  LEU  60           QD2      LEU  60  -4.180   4.962  -9.204
  663    QQD  LEU  60           QQD      LEU  60  -5.573   4.368  -9.560
  664    H    ASN  61           HN       ASN  61  -8.218   6.246  -5.622
  665    HA   ASN  61           HA       ASN  61  -7.328   8.670  -4.165
  666   1HB   ASN  61          2HB       ASN  61  -9.307   9.167  -6.387
  667   2HB   ASN  61          3HB       ASN  61  -8.222  10.262  -5.548
  668   1HD2  ASN  61          2HD2      ASN  61  -7.142   8.298  -8.976
  669   2HD2  ASN  61          1HD2      ASN  61  -8.561   7.793  -8.068
  670    QB   ASN  61           QB       ASN  61  -8.764   9.714  -5.968
  671    QD2  ASN  61           QD2      ASN  61  -7.851   8.045  -8.522
  672    H    GLY  62           HN       GLY  62  -8.448   6.878  -2.593
  673   1HA   GLY  62          1HA       GLY  62 -11.121   7.979  -2.148
  674   2HA   GLY  62          2HA       GLY  62 -10.885   6.235  -2.092
  675    QA   GLY  62           QA       GLY  62 -11.003   7.106  -2.120
  676    H    THR  63           HN       THR  63 -10.727   9.142  -0.537
  677    HA   THR  63           HA       THR  63  -9.860   7.828   1.993
  678    HB   THR  63           HB       THR  63  -8.471   9.558   2.675
  679    HG1  THR  63          1HG       THR  63  -9.680  11.256   1.335
  680   1HG2  THR  63          3HG2      THR  63  -7.525   7.894   1.160
  681   2HG2  THR  63          1HG2      THR  63  -7.737   8.974  -0.237
  682   3HG2  THR  63          2HG2      THR  63  -6.613   9.418   1.034
  683    QG2  THR  63           QG2      THR  63  -7.292   8.762   0.653
  684    H    SER  64           HN       SER  64 -11.713   7.853   3.135
  685    HA   SER  64           HA       SER  64 -13.108  10.417   3.629
  686   1HB   SER  64          2HB       SER  64 -14.302   7.790   2.658
  687   2HB   SER  64          3HB       SER  64 -15.249   9.055   3.473
  688    HG   SER  64           HG       SER  64 -15.372   9.460   1.287
  689    QB   SER  64           QB       SER  64 -14.776   8.423   3.065
  690    H    ASP  65           HN       ASP  65 -11.981  10.420   5.656
  691    HA   ASP  65           HA       ASP  65 -13.334   9.021   7.755
  692   1HB   ASP  65          2HB       ASP  65 -11.616   7.307   7.117
  693   2HB   ASP  65          3HB       ASP  65 -10.344   8.522   7.332
  694    QB   ASP  65           QB       ASP  65 -10.980   7.915   7.224
  695    H    SER  66           HN       SER  66 -12.406   9.939   9.829
  696    HA   SER  66           HA       SER  66 -10.741  12.140  10.117
  697   1HB   SER  66          2HB       SER  66 -12.100  13.497   8.611
  698   2HB   SER  66          3HB       SER  66 -13.586  13.022   9.462
  699    HG   SER  66           HG       SER  66 -12.731  14.092  11.296
  700    QB   SER  66           QB       SER  66 -12.844  13.260   9.037
  701    H    ASN  67           HN       ASN  67 -10.891  10.202  11.756
  702    HA   ASN  67           HA       ASN  67 -12.473  11.195  14.117
  703   1HB   ASN  67          2HB       ASN  67 -12.028   8.346  13.160
  704   2HB   ASN  67          3HB       ASN  67 -12.391   8.728  14.850
  705   1HD2  ASN  67          2HD2      ASN  67 -15.761   9.834  14.177
  706   2HD2  ASN  67          1HD2      ASN  67 -14.381  10.259  15.175
  707    QB   ASN  67           QB       ASN  67 -12.210   8.537  14.004
  708    QD2  ASN  67           QD2      ASN  67 -15.071  10.047  14.676
  709    H    VAL  68           HN       VAL  68  -9.960   8.681  13.821
  710    HA   VAL  68           HA       VAL  68  -8.683   9.818  16.178
  711    HB   VAL  68           HB       VAL  68  -9.089   7.453  15.943
  712   1HG1  VAL  68          3HG1      VAL  68  -8.525   7.281  13.428
  713   2HG1  VAL  68          1HG1      VAL  68  -6.832   7.166  13.943
  714   3HG1  VAL  68          2HG1      VAL  68  -8.007   5.973  14.500
  715   1HG2  VAL  68          2HG2      VAL  68  -7.367   8.210  17.476
  716   2HG2  VAL  68          3HG2      VAL  68  -6.904   6.660  16.750
  717   3HG2  VAL  68          1HG2      VAL  68  -6.139   8.157  16.194
  718    QG1  VAL  68           QG1      VAL  68  -7.788   6.807  13.957
  719    QG2  VAL  68           QG2      VAL  68  -6.803   7.676  16.807
  720    QQG  VAL  68           QQG      VAL  68  -7.296   7.241  15.382
  721    NH1  ARG  69           NH2      ARG  69  -1.111  12.373  17.855
  722    NH2  ARG  69           NH1      ARG  69  -1.577  14.348  18.979
  723    H    ARG  69           HN       ARG  69  -8.355  11.839  14.952
  724    HA   ARG  69           HA       ARG  69  -6.869  13.441  14.409
  725   1HB   ARG  69          2HB       ARG  69  -4.934  11.251  14.833
  726   2HB   ARG  69          3HB       ARG  69  -4.453  12.339  13.538
  727   1HG   ARG  69          2HG       ARG  69  -4.520  14.238  14.997
  728   2HG   ARG  69          3HG       ARG  69  -5.374  13.322  16.263
  729   1HD   ARG  69          2HD       ARG  69  -3.432  11.814  16.493
  730   2HD   ARG  69          3HD       ARG  69  -2.539  12.769  15.280
  731    HE   ARG  69           HE       ARG  69  -3.379  14.587  17.227
  732   1HH1  ARG  69          2HH2      ARG  69  -1.317  11.742  17.095
  733   2HH1  ARG  69          1HH2      ARG  69  -0.356  12.148  18.484
  734   1HH2  ARG  69          2HH1      ARG  69  -2.132  15.184  19.092
  735   2HH2  ARG  69          1HH1      ARG  69  -0.831  14.179  19.637
  736    QB   ARG  69           QB       ARG  69  -4.693  11.794  14.186
  737    QG   ARG  69           QG       ARG  69  -4.947  13.780  15.630
  738    QD   ARG  69           QD       ARG  69  -2.985  12.291  15.886
  739    QH1  ARG  69           QH2      ARG  69  -0.836  11.945  17.789
  740    QH2  ARG  69           QH1      ARG  69  -1.482  14.682  19.365
   
  Start of MODEL          14
 Raw file had 740 H/Q atoms
  Start of MODEL   14
    1    H    SER   1           HN       SER   1  -3.321  11.516   0.334
    2    HA   SER   1           HA       SER   1  -2.350  11.172   3.103
    3   1HB   SER   1          2HB       SER   1  -5.185  10.758   2.198
    4   2HB   SER   1          3HB       SER   1  -4.503  10.924   3.855
    5    HG   SER   1           HG       SER   1  -5.357  12.929   3.178
    6    QB   SER   1           QB       SER   1  -4.844  10.841   3.027
    7    H    ILE   2           HN       ILE   2  -2.253   9.674   0.224
    8    HA   ILE   2           HA       ILE   2  -3.247   7.105   0.652
    9    HB   ILE   2           HB       ILE   2  -2.571   7.853  -1.461
   10   1HG1  ILE   2          2HG1      ILE   2  -0.636   5.586  -1.095
   11   2HG1  ILE   2          3HG1      ILE   2  -2.309   5.305  -0.587
   12   1HG2  ILE   2          2HG2      ILE   2  -0.593   9.206  -1.013
   13   2HG2  ILE   2          3HG2      ILE   2   0.310   7.754  -0.534
   14   3HG2  ILE   2          1HG2      ILE   2  -0.211   7.958  -2.207
   15   1HD1  ILE   2          3HD1      ILE   2  -1.676   6.421  -3.335
   16   2HD1  ILE   2          1HD1      ILE   2  -1.813   4.685  -2.988
   17   3HD1  ILE   2          2HD1      ILE   2  -3.197   5.761  -2.704
   18    QG1  ILE   2           QG1      ILE   2  -1.473   5.445  -0.842
   19    QG2  ILE   2           QG2      ILE   2  -0.165   8.306  -1.251
   20    QD1  ILE   2           QD1      ILE   2  -2.229   5.622  -3.009
   21    H    SER   3           HN       SER   3  -0.413   8.636   2.008
   22    HA   SER   3           HA       SER   3   1.026   6.492   3.134
   23   1HB   SER   3          2HB       SER   3   1.454   8.245   4.953
   24   2HB   SER   3          3HB       SER   3   1.822   8.779   3.312
   25    HG   SER   3           HG       SER   3   0.280  10.049   4.895
   26    QB   SER   3           QB       SER   3   1.637   8.512   4.133
   27    H    SER   4           HN       SER   4  -1.389   8.456   4.764
   28    HA   SER   4           HA       SER   4  -1.820   6.794   6.969
   29   1HB   SER   4          2HB       SER   4  -3.871   8.637   5.687
   30   2HB   SER   4          3HB       SER   4  -3.758   8.171   7.397
   31    HG   SER   4           HG       SER   4  -1.739   9.250   7.473
   32    QB   SER   4           QB       SER   4  -3.815   8.403   6.543
   33    NH1  ARG   5           NH2      ARG   5  -6.074   8.818  -1.134
   34    NH2  ARG   5           NH1      ARG   5  -5.828   6.863  -2.321
   35    H    ARG   5           HN       ARG   5  -3.565   6.824   3.798
   36    HA   ARG   5           HA       ARG   5  -5.484   4.838   4.516
   37   1HB   ARG   5          2HB       ARG   5  -4.198   5.592   1.929
   38   2HB   ARG   5          3HB       ARG   5  -5.361   4.413   1.884
   39   1HG   ARG   5          2HG       ARG   5  -7.137   5.828   2.345
   40   2HG   ARG   5          3HG       ARG   5  -6.182   6.871   3.390
   41   1HD   ARG   5          2HD       ARG   5  -6.987   7.955   1.334
   42   2HD   ARG   5          3HD       ARG   5  -5.236   8.045   1.562
   43    HE   ARG   5           HE       ARG   5  -5.720   5.789  -0.051
   44   1HH1  ARG   5          2HH2      ARG   5  -6.288   9.265  -0.259
   45   2HH1  ARG   5          1HH2      ARG   5  -6.344   9.295  -1.985
   46   1HH2  ARG   5          2HH1      ARG   5  -5.910   5.857  -2.359
   47   2HH2  ARG   5          1HH1      ARG   5  -5.781   7.353  -3.208
   48    QB   ARG   5           QB       ARG   5  -4.779   5.003   1.907
   49    QG   ARG   5           QG       ARG   5  -6.659   6.349   2.868
   50    QD   ARG   5           QD       ARG   5  -6.112   8.000   1.448
   51    QH1  ARG   5           QH2      ARG   5  -6.316   9.280  -1.122
   52    QH2  ARG   5           QH1      ARG   5  -5.845   6.605  -2.783
   53    H    VAL   6           HN       VAL   6  -2.325   4.340   2.833
   54    HA   VAL   6           HA       VAL   6  -2.385   1.524   2.761
   55    HB   VAL   6           HB       VAL   6  -0.085   3.517   2.891
   56   1HG1  VAL   6          1HG1      VAL   6   0.003   0.547   2.277
   57   2HG1  VAL   6          2HG1      VAL   6   1.362   1.668   2.068
   58   3HG1  VAL   6          3HG1      VAL   6   0.721   1.374   3.687
   59   1HG2  VAL   6          1HG2      VAL   6  -1.553   2.101   0.639
   60   2HG2  VAL   6          2HG2      VAL   6  -1.145   3.806   0.781
   61   3HG2  VAL   6          3HG2      VAL   6   0.124   2.653   0.428
   62    QG1  VAL   6           QG1      VAL   6   0.695   1.196   2.677
   63    QG2  VAL   6           QG2      VAL   6  -0.858   2.854   0.616
   64    QQG  VAL   6           QQG      VAL   6  -0.081   2.025   1.646
   65    H    LYS   7           HN       LYS   7  -0.864   3.654   5.262
   66    HA   LYS   7           HA       LYS   7  -0.055   1.426   6.835
   67   1HB   LYS   7          2HB       LYS   7   0.752   3.894   6.741
   68   2HB   LYS   7          3HB       LYS   7  -0.449   4.197   7.995
   69   1HG   LYS   7          2HG       LYS   7   1.752   2.056   8.110
   70   2HG   LYS   7          3HG       LYS   7   1.965   3.697   8.661
   71   1HD   LYS   7          2HD       LYS   7  -0.407   2.918   9.978
   72   2HD   LYS   7          3HD       LYS   7   0.508   1.419   9.917
   73   1HE   LYS   7          2HE       LYS   7   0.910   2.652  12.007
   74   2HE   LYS   7          3HE       LYS   7   2.414   2.492  11.087
   75   1HZ   LYS   7          1HZ       LYS   7   0.701   4.888  10.960
   76   2HZ   LYS   7          2HZ       LYS   7   1.904   4.719  12.070
   77   3HZ   LYS   7          3HZ       LYS   7   2.267   4.742  10.471
   78    QB   LYS   7           QB       LYS   7   0.152   4.045   7.369
   79    QG   LYS   7           QG       LYS   7   1.859   2.877   8.386
   80    QD   LYS   7           QD       LYS   7   0.050   2.168   9.948
   81    QE   LYS   7           QE       LYS   7   1.661   2.572  11.547
   82    QZ   LYS   7           QZ       LYS   7   1.623   4.783  11.167
   83    H    SER   8           HN       SER   8  -3.021   3.471   6.998
   84    HA   SER   8           HA       SER   8  -4.190   2.476   9.357
   85   1HB   SER   8          2HB       SER   8  -5.423   3.398   6.729
   86   2HB   SER   8          3HB       SER   8  -6.394   2.874   8.105
   87    HG   SER   8           HG       SER   8  -5.954   5.171   8.032
   88    QB   SER   8           QB       SER   8  -5.908   3.136   7.417
   89    H    LYS   9           HN       LYS   9  -4.313   1.104   5.953
   90    HA   LYS   9           HA       LYS   9  -6.063  -1.013   6.858
   91   1HB   LYS   9          2HB       LYS   9  -4.845  -0.120   4.347
   92   2HB   LYS   9          3HB       LYS   9  -4.687  -1.860   4.584
   93   1HG   LYS   9          2HG       LYS   9  -7.325  -0.455   4.917
   94   2HG   LYS   9          3HG       LYS   9  -6.701  -1.105   3.390
   95   1HD   LYS   9          2HD       LYS   9  -7.024  -3.299   3.980
   96   2HD   LYS   9          3HD       LYS   9  -6.453  -3.052   5.612
   97   1HE   LYS   9          2HE       LYS   9  -8.677  -3.772   5.807
   98   2HE   LYS   9          3HE       LYS   9  -8.688  -2.051   6.204
   99   1HZ   LYS   9          3HZ       LYS   9  -9.454  -3.239   3.573
  100   2HZ   LYS   9          1HZ       LYS   9 -10.494  -2.690   4.740
  101   3HZ   LYS   9          2HZ       LYS   9  -9.504  -1.645   3.967
  102    QB   LYS   9           QB       LYS   9  -4.767  -0.990   4.466
  103    QG   LYS   9           QG       LYS   9  -7.013  -0.780   4.154
  104    QD   LYS   9           QD       LYS   9  -6.739  -3.176   4.797
  105    QE   LYS   9           QE       LYS   9  -8.682  -2.911   6.005
  106    QZ   LYS   9           QZ       LYS   9  -9.818  -2.524   4.093
  107    NH1  ARG  10           NH2      ARG  10   1.693  -1.091   3.741
  108    NH2  ARG  10           NH1      ARG  10   2.905   0.544   4.797
  109    H    ARG  10           HN       ARG  10  -2.537  -0.512   6.606
  110    HA   ARG  10           HA       ARG  10  -1.687  -3.134   7.073
  111   1HB   ARG  10          2HB       ARG  10  -0.367  -0.868   6.668
  112   2HB   ARG  10          3HB       ARG  10  -0.310  -0.792   8.431
  113   1HG   ARG  10          2HG       ARG  10   1.467  -2.120   8.387
  114   2HG   ARG  10          3HG       ARG  10   0.400  -3.442   7.907
  115   1HD   ARG  10          2HD       ARG  10   2.117  -3.345   6.239
  116   2HD   ARG  10          3HD       ARG  10   0.646  -2.703   5.528
  117    HE   ARG  10           HE       ARG  10   2.683  -0.864   6.790
  118   1HH1  ARG  10          2HH2      ARG  10   1.072  -1.877   3.813
  119   2HH1  ARG  10          1HH2      ARG  10   1.797  -0.622   2.853
  120   1HH2  ARG  10          2HH1      ARG  10   3.150   1.139   5.590
  121   2HH2  ARG  10          1HH1      ARG  10   3.246   0.975   3.929
  122    QB   ARG  10           QB       ARG  10  -0.338  -0.829   7.550
  123    QG   ARG  10           QG       ARG  10   0.933  -2.781   8.146
  124    QD   ARG  10           QD       ARG  10   1.382  -3.024   5.884
  125    QH1  ARG  10           QH2      ARG  10   1.435  -1.249   3.332
  126    QH2  ARG  10           QH1      ARG  10   3.198   1.056   4.759
  127    H    ILE  11           HN       ILE  11  -2.609  -0.587   9.422
  128    HA   ILE  11           HA       ILE  11  -2.149  -2.212  11.748
  129    HB   ILE  11           HB       ILE  11  -3.962   0.196  11.446
  130   1HG1  ILE  11          2HG1      ILE  11  -1.855   1.036  10.930
  131   2HG1  ILE  11          3HG1      ILE  11  -1.972   1.236  12.665
  132   1HG2  ILE  11          2HG2      ILE  11  -2.892  -1.300  13.866
  133   2HG2  ILE  11          3HG2      ILE  11  -3.566   0.343  13.950
  134   3HG2  ILE  11          1HG2      ILE  11  -4.588  -0.995  13.432
  135   1HD1  ILE  11          1HD1      ILE  11  -0.623  -0.910  12.923
  136   2HD1  ILE  11          2HD1      ILE  11  -0.346  -0.860  11.167
  137   3HD1  ILE  11          3HD1      ILE  11   0.245   0.444  12.187
  138    QG1  ILE  11           QG1      ILE  11  -1.913   1.135  11.797
  139    QG2  ILE  11           QG2      ILE  11  -3.682  -0.650  13.750
  140    QD1  ILE  11           QD1      ILE  11  -0.241  -0.443  12.092
  141    H    GLN  12           HN       GLN  12  -5.171  -1.449   9.967
  142    HA   GLN  12           HA       GLN  12  -6.837  -3.141  11.529
  143   1HB   GLN  12          2HB       GLN  12  -6.972  -2.134   8.689
  144   2HB   GLN  12          3HB       GLN  12  -8.118  -3.377   9.197
  145   1HG   GLN  12          2HG       GLN  12  -7.744  -0.742  10.688
  146   2HG   GLN  12          3HG       GLN  12  -8.976  -1.039   9.456
  147   1HE2  GLN  12          2HE2      GLN  12  -9.609  -2.461  13.208
  148   2HE2  GLN  12          1HE2      GLN  12  -8.175  -1.524  12.830
  149    QB   GLN  12           QB       GLN  12  -7.545  -2.755   8.943
  150    QG   GLN  12           QG       GLN  12  -8.359  -0.890  10.073
  151    QE2  GLN  12           QE2      GLN  12  -8.892  -1.992  13.019
  152    H    LEU  13           HN       LEU  13  -4.713  -4.050   8.846
  153    HA   LEU  13           HA       LEU  13  -5.444  -6.887   8.935
  154   1HB   LEU  13          2HB       LEU  13  -3.376  -5.140   7.583
  155   2HB   LEU  13          3HB       LEU  13  -3.120  -6.859   7.620
  156    HG   LEU  13           HG       LEU  13  -4.437  -5.557   5.679
  157   1HD1  LEU  13          1HD1      LEU  13  -4.220  -8.373   6.541
  158   2HD1  LEU  13          2HD1      LEU  13  -5.609  -8.063   5.498
  159   3HD1  LEU  13          3HD1      LEU  13  -3.982  -7.617   4.955
  160   1HD2  LEU  13          3HD2      LEU  13  -6.411  -4.963   7.078
  161   2HD2  LEU  13          1HD2      LEU  13  -6.830  -5.990   5.705
  162   3HD2  LEU  13          2HD2      LEU  13  -6.755  -6.701   7.299
  163    QB   LEU  13           QB       LEU  13  -3.248  -5.999   7.602
  164    QD1  LEU  13           QD1      LEU  13  -4.604  -8.018   5.665
  165    QD2  LEU  13           QD2      LEU  13  -6.665  -5.885   6.694
  166    QQD  LEU  13           QQD      LEU  13  -5.634  -6.951   6.179
  167    H    GLY  14           HN       GLY  14  -3.052  -4.860  10.485
  168   1HA   GLY  14          1HA       GLY  14  -1.907  -5.268  12.450
  169   2HA   GLY  14          2HA       GLY  14  -2.465  -6.949  12.464
  170    QA   GLY  14           QA       GLY  14  -2.186  -6.108  12.457
  171    H    LEU  15           HN       LEU  15  -0.924  -5.342   9.691
  172    HA   LEU  15           HA       LEU  15   1.455  -7.164   9.993
  173   1HB   LEU  15          2HB       LEU  15   0.326  -6.020   7.412
  174   2HB   LEU  15          3HB       LEU  15   1.701  -7.114   7.587
  175    HG   LEU  15           HG       LEU  15  -1.215  -7.766   8.036
  176   1HD1  LEU  15          3HD1      LEU  15  -0.295  -7.756   5.705
  177   2HD1  LEU  15          1HD1      LEU  15   0.933  -8.930   6.225
  178   3HD1  LEU  15          2HD1      LEU  15  -0.794  -9.372   6.244
  179   1HD2  LEU  15          1HD2      LEU  15   1.228  -9.409   8.793
  180   2HD2  LEU  15          2HD2      LEU  15  -0.152  -8.958   9.815
  181   3HD2  LEU  15          3HD2      LEU  15  -0.376 -10.115   8.505
  182    QB   LEU  15           QB       LEU  15   1.014  -6.566   7.500
  183    QD1  LEU  15           QD1      LEU  15  -0.052  -8.686   6.058
  184    QD2  LEU  15           QD2      LEU  15   0.233  -9.494   9.037
  185    QQD  LEU  15           QQD      LEU  15   0.090  -9.090   7.548
  186    H    ASN  16           HN       ASN  16   3.203  -6.028   8.344
  187    HA   ASN  16           HA       ASN  16   3.434  -3.141   8.996
  188   1HB   ASN  16          2HB       ASN  16   5.637  -3.343   9.806
  189   2HB   ASN  16          3HB       ASN  16   4.699  -4.528  10.714
  190   1HD2  ASN  16          2HD2      ASN  16   6.310  -7.357   9.070
  191   2HD2  ASN  16          1HD2      ASN  16   4.737  -6.908   9.618
  192    QB   ASN  16           QB       ASN  16   5.168  -3.936  10.260
  193    QD2  ASN  16           QD2      ASN  16   5.523  -7.133   9.344
  194    H    GLN  17           HN       GLN  17   5.454  -2.315   7.827
  195    HA   GLN  17           HA       GLN  17   4.900  -2.419   5.058
  196   1HB   GLN  17          2HB       GLN  17   6.956  -1.136   6.805
  197   2HB   GLN  17          3HB       GLN  17   7.382  -1.399   5.093
  198   1HG   GLN  17          2HG       GLN  17   5.299  -0.191   4.488
  199   2HG   GLN  17          3HG       GLN  17   5.077   0.200   6.214
  200   1HE2  GLN  17          2HE2      GLN  17   6.954   3.143   5.562
  201   2HE2  GLN  17          1HE2      GLN  17   5.332   2.544   5.894
  202    QB   GLN  17           QB       GLN  17   7.169  -1.268   5.949
  203    QG   GLN  17           QG       GLN  17   5.188   0.004   5.352
  204    QE2  GLN  17           QE2      GLN  17   6.143   2.844   5.728
  205    H    ALA  18           HN       ALA  18   7.317  -4.286   6.974
  206    HA   ALA  18           HA       ALA  18   8.694  -5.252   4.645
  207   1HB   ALA  18          1HB       ALA  18   9.552  -5.123   7.057
  208   2HB   ALA  18          2HB       ALA  18   8.655  -6.629   7.342
  209   3HB   ALA  18          3HB       ALA  18   9.938  -6.577   6.117
  210    QB   ALA  18           QB       ALA  18   9.382  -6.109   6.839
  211    H    GLU  19           HN       GLU  19   6.265  -6.768   6.844
  212    HA   GLU  19           HA       GLU  19   5.887  -9.205   5.426
  213   1HB   GLU  19          2HB       GLU  19   4.143  -7.501   7.206
  214   2HB   GLU  19          3HB       GLU  19   3.475  -8.929   6.417
  215   1HG   GLU  19          2HG       GLU  19   5.034 -10.408   7.442
  216   2HG   GLU  19          3HG       GLU  19   5.963  -9.092   8.155
  217    QB   GLU  19           QB       GLU  19   3.809  -8.215   6.811
  218    QG   GLU  19           QG       GLU  19   5.498  -9.751   7.798
  219    H    LEU  20           HN       LEU  20   4.410  -5.978   5.044
  220    HA   LEU  20           HA       LEU  20   2.583  -6.835   3.011
  221   1HB   LEU  20          2HB       LEU  20   2.076  -4.950   4.310
  222   2HB   LEU  20          3HB       LEU  20   3.556  -4.107   3.857
  223    HG   LEU  20           HG       LEU  20   1.469  -3.335   2.726
  224   1HD1  LEU  20          2HD1      LEU  20   4.001  -3.481   1.768
  225   2HD1  LEU  20          3HD1      LEU  20   3.109  -4.205   0.424
  226   3HD1  LEU  20          1HD1      LEU  20   2.677  -2.601   1.039
  227   1HD2  LEU  20          2HD2      LEU  20   0.240  -5.357   2.380
  228   2HD2  LEU  20          3HD2      LEU  20   0.534  -4.516   0.841
  229   3HD2  LEU  20          1HD2      LEU  20   1.473  -5.957   1.255
  230    QB   LEU  20           QB       LEU  20   2.816  -4.528   4.083
  231    QD1  LEU  20           QD1      LEU  20   3.262  -3.429   1.077
  232    QD2  LEU  20           QD2      LEU  20   0.749  -5.276   1.492
  233    QQD  LEU  20           QQD      LEU  20   2.006  -4.353   1.285
  234    H    ALA  21           HN       ALA  21   5.872  -5.325   2.898
  235    HA   ALA  21           HA       ALA  21   6.198  -5.163   0.123
  236   1HB   ALA  21          2HB       ALA  21   8.150  -5.640   2.384
  237   2HB   ALA  21          3HB       ALA  21   8.674  -5.651   0.700
  238   3HB   ALA  21          1HB       ALA  21   7.897  -4.211   1.381
  239    QB   ALA  21           QB       ALA  21   8.241  -5.168   1.488
  240    H    GLN  22           HN       GLN  22   7.014  -8.001   2.194
  241    HA   GLN  22           HA       GLN  22   7.617  -9.590  -0.152
  242   1HB   GLN  22          2HB       GLN  22   7.292 -11.589   1.406
  243   2HB   GLN  22          3HB       GLN  22   8.653 -10.499   1.647
  244   1HG   GLN  22          2HG       GLN  22   7.951  -9.760   3.668
  245   2HG   GLN  22          3HG       GLN  22   6.264  -9.742   3.173
  246   1HE2  GLN  22          2HE2      GLN  22   5.545 -13.107   4.122
  247   2HE2  GLN  22          1HE2      GLN  22   5.190 -11.945   2.849
  248    QB   GLN  22           QB       GLN  22   7.972 -11.044   1.527
  249    QG   GLN  22           QG       GLN  22   7.107  -9.751   3.420
  250    QE2  GLN  22           QE2      GLN  22   5.367 -12.525   3.486
  251    H    LYS  23           HN       LYS  23   4.514  -9.103   1.615
  252    HA   LYS  23           HA       LYS  23   3.052 -11.054   0.103
  253   1HB   LYS  23          2HB       LYS  23   2.416  -8.695   1.815
  254   2HB   LYS  23          3HB       LYS  23   1.181  -9.102   0.637
  255   1HG   LYS  23          2HG       LYS  23   0.676 -11.103   1.550
  256   2HG   LYS  23          3HG       LYS  23   2.317 -11.413   2.153
  257   1HD   LYS  23          2HD       LYS  23   2.063  -9.798   3.947
  258   2HD   LYS  23          3HD       LYS  23   0.418  -9.402   3.441
  259   1HE   LYS  23          2HE       LYS  23   1.416 -12.186   4.295
  260   2HE   LYS  23          3HE       LYS  23   0.595 -11.060   5.368
  261   1HZ   LYS  23          1HZ       LYS  23  -1.293 -11.125   3.796
  262   2HZ   LYS  23          2HZ       LYS  23  -0.543 -12.353   2.990
  263   3HZ   LYS  23          3HZ       LYS  23  -0.993 -12.552   4.559
  264    QB   LYS  23           QB       LYS  23   1.799  -8.898   1.226
  265    QG   LYS  23           QG       LYS  23   1.496 -11.259   1.851
  266    QD   LYS  23           QD       LYS  23   1.241  -9.600   3.694
  267    QE   LYS  23           QE       LYS  23   1.006 -11.622   4.831
  268    QZ   LYS  23           QZ       LYS  23  -0.943 -12.009   3.782
  269    H    VAL  24           HN       VAL  24   3.745  -7.639  -0.639
  270    HA   VAL  24           HA       VAL  24   2.317  -7.709  -3.176
  271    HB   VAL  24           HB       VAL  24   4.317  -5.805  -1.900
  272   1HG1  VAL  24          1HG1      VAL  24   2.764  -5.436  -4.487
  273   2HG1  VAL  24          2HG1      VAL  24   3.721  -4.187  -3.665
  274   3HG1  VAL  24          3HG1      VAL  24   4.529  -5.587  -4.390
  275   1HG2  VAL  24          2HG2      VAL  24   1.337  -5.671  -2.492
  276   2HG2  VAL  24          3HG2      VAL  24   2.064  -5.898  -0.897
  277   3HG2  VAL  24          1HG2      VAL  24   2.291  -4.362  -1.758
  278    QG1  VAL  24           QG1      VAL  24   3.671  -5.069  -4.181
  279    QG2  VAL  24           QG2      VAL  24   1.898  -5.311  -1.716
  280    QQG  VAL  24           QQG      VAL  24   2.784  -5.190  -2.949
  281    H    GLY  25           HN       GLY  25   5.557  -8.554  -2.071
  282   1HA   GLY  25          1HA       GLY  25   7.086  -9.916  -3.184
  283   2HA   GLY  25          2HA       GLY  25   6.186  -9.759  -4.703
  284    QA   GLY  25           QA       GLY  25   6.636  -9.837  -3.944
  285    H    THR  26           HN       THR  26   7.229  -7.205  -2.461
  286    HA   THR  26           HA       THR  26   9.380  -6.321  -4.276
  287    HB   THR  26           HB       THR  26   7.342  -5.033  -4.888
  288    HG1  THR  26          1HG       THR  26   9.374  -4.141  -5.112
  289   1HG2  THR  26          2HG2      THR  26   6.236  -4.983  -2.666
  290   2HG2  THR  26          3HG2      THR  26   7.461  -3.860  -2.072
  291   3HG2  THR  26          1HG2      THR  26   6.386  -3.380  -3.400
  292    QG2  THR  26           QG2      THR  26   6.694  -4.074  -2.712
  293    H    THR  27           HN       THR  27   9.743  -3.972  -2.660
  294    HA   THR  27           HA       THR  27  10.926  -5.188  -0.177
  295    HB   THR  27           HB       THR  27  12.724  -3.380  -0.701
  296    HG1  THR  27          1HG       THR  27  11.319  -2.447  -2.446
  297   1HG2  THR  27          1HG2      THR  27  12.359  -5.790  -2.543
  298   2HG2  THR  27          2HG2      THR  27  13.876  -4.901  -2.297
  299   3HG2  THR  27          3HG2      THR  27  13.143  -5.791  -0.948
  300    QG2  THR  27           QG2      THR  27  13.126  -5.494  -1.929
  301    H    GLN  28           HN       GLN  28  10.919  -3.897   1.670
  302    HA   GLN  28           HA       GLN  28   8.842  -2.283   2.333
  303   1HB   GLN  28          2HB       GLN  28  10.306  -3.151   3.961
  304   2HB   GLN  28          3HB       GLN  28  11.713  -2.262   3.345
  305   1HG   GLN  28          2HG       GLN  28  10.929  -0.192   4.204
  306   2HG   GLN  28          3HG       GLN  28   9.273  -0.781   4.275
  307   1HE2  GLN  28          2HE2      GLN  28  11.827  -1.678   7.375
  308   2HE2  GLN  28          1HE2      GLN  28  12.492  -1.171   5.833
  309    QB   GLN  28           QB       GLN  28  11.009  -2.707   3.653
  310    QG   GLN  28           QG       GLN  28  10.101  -0.486   4.239
  311    QE2  GLN  28           QE2      GLN  28  12.160  -1.425   6.604
  312    H    GLN  29           HN       GLN  29  11.884  -1.106   0.893
  313    HA   GLN  29           HA       GLN  29  11.459   1.621   0.961
  314   1HB   GLN  29          2HB       GLN  29  13.287  -0.138  -0.289
  315   2HB   GLN  29          3HB       GLN  29  12.515   0.672  -1.643
  316   1HG   GLN  29          2HG       GLN  29  13.007   2.854  -0.082
  317   2HG   GLN  29          3HG       GLN  29  14.256   1.769   0.547
  318   1HE2  GLN  29          2HE2      GLN  29  14.380   3.138  -3.362
  319   2HE2  GLN  29          1HE2      GLN  29  12.875   3.157  -2.452
  320    QB   GLN  29           QB       GLN  29  12.901   0.267  -0.966
  321    QG   GLN  29           QG       GLN  29  13.631   2.312   0.233
  322    QE2  GLN  29           QE2      GLN  29  13.627   3.148  -2.907
  323    H    SER  30           HN       SER  30  10.143  -0.713  -1.410
  324    HA   SER  30           HA       SER  30   8.989   1.138  -3.235
  325   1HB   SER  30          2HB       SER  30   8.166  -1.703  -2.622
  326   2HB   SER  30          3HB       SER  30   7.844  -0.783  -4.088
  327    HG   SER  30           HG       SER  30   9.674  -2.163  -4.264
  328    QB   SER  30           QB       SER  30   8.006  -1.243  -3.355
  329    H    ILE  31           HN       ILE  31   8.042  -0.244  -0.122
  330    HA   ILE  31           HA       ILE  31   5.221   0.387  -0.457
  331    HB   ILE  31           HB       ILE  31   6.660  -0.494   2.074
  332   1HG1  ILE  31          2HG1      ILE  31   7.249  -2.152   0.422
  333   2HG1  ILE  31          3HG1      ILE  31   5.985  -2.794   1.433
  334   1HG2  ILE  31          1HG2      ILE  31   3.771  -0.642   1.135
  335   2HG2  ILE  31          2HG2      ILE  31   4.415  -1.397   2.622
  336   3HG2  ILE  31          3HG2      ILE  31   4.441   0.349   2.397
  337   1HD1  ILE  31          2HD1      ILE  31   4.358  -1.961  -0.495
  338   2HD1  ILE  31          3HD1      ILE  31   5.830  -1.835  -1.455
  339   3HD1  ILE  31          1HD1      ILE  31   5.332  -3.393  -0.793
  340    QG1  ILE  31           QG1      ILE  31   6.617  -2.473   0.927
  341    QG2  ILE  31           QG2      ILE  31   4.209  -0.564   2.051
  342    QD1  ILE  31           QD1      ILE  31   5.173  -2.396  -0.914
  343    H    GLU  32           HN       GLU  32   8.004   1.578   1.510
  344    HA   GLU  32           HA       GLU  32   6.892   3.868   2.642
  345   1HB   GLU  32          2HB       GLU  32   9.118   3.399   3.198
  346   2HB   GLU  32          3HB       GLU  32   9.654   3.306   1.518
  347   1HG   GLU  32          2HG       GLU  32   9.417   5.731   1.222
  348   2HG   GLU  32          3HG       GLU  32   8.715   5.893   2.831
  349    QB   GLU  32           QB       GLU  32   9.386   3.352   2.357
  350    QG   GLU  32           QG       GLU  32   9.066   5.812   2.026
  351    H    GLN  33           HN       GLN  33   8.474   3.732  -0.615
  352    HA   GLN  33           HA       GLN  33   7.845   6.361  -1.267
  353   1HB   GLN  33          2HB       GLN  33   8.089   5.822  -3.635
  354   2HB   GLN  33          3HB       GLN  33   9.372   5.101  -2.619
  355   1HG   GLN  33          2HG       GLN  33   8.219   3.014  -2.707
  356   2HG   GLN  33          3HG       GLN  33   6.952   3.645  -3.779
  357   1HE2  GLN  33          2HE2      GLN  33  10.749   3.022  -5.301
  358   2HE2  GLN  33          1HE2      GLN  33  10.541   3.360  -3.587
  359    QB   GLN  33           QB       GLN  33   8.731   5.462  -3.128
  360    QG   GLN  33           QG       GLN  33   7.586   3.329  -3.243
  361    QE2  GLN  33           QE2      GLN  33  10.645   3.191  -4.445
  362    H    LEU  34           HN       LEU  34   5.872   3.470  -1.761
  363    HA   LEU  34           HA       LEU  34   3.758   4.848  -3.026
  364   1HB   LEU  34          2HB       LEU  34   4.075   2.415  -3.090
  365   2HB   LEU  34          3HB       LEU  34   3.540   2.279  -1.410
  366    HG   LEU  34           HG       LEU  34   1.321   3.074  -1.956
  367   1HD1  LEU  34          2HD1      LEU  34   2.442   3.611  -4.718
  368   2HD1  LEU  34          3HD1      LEU  34   0.688   3.551  -4.348
  369   3HD1  LEU  34          1HD1      LEU  34   1.688   4.796  -3.627
  370   1HD2  LEU  34          1HD2      LEU  34   2.439   0.694  -3.068
  371   2HD2  LEU  34          2HD2      LEU  34   0.747   1.054  -2.678
  372   3HD2  LEU  34          3HD2      LEU  34   1.350   1.340  -4.302
  373    QB   LEU  34           QB       LEU  34   3.807   2.347  -2.251
  374    QD1  LEU  34           QD1      LEU  34   1.606   3.986  -4.231
  375    QD2  LEU  34           QD2      LEU  34   1.511   1.029  -3.349
  376    QQD  LEU  34           QQD      LEU  34   1.559   2.508  -3.790
  377    H    GLU  35           HN       GLU  35   4.237   4.100   0.438
  378    HA   GLU  35           HA       GLU  35   1.912   5.246   1.503
  379   1HB   GLU  35          2HB       GLU  35   4.625   4.558   2.460
  380   2HB   GLU  35          3HB       GLU  35   3.992   5.959   3.307
  381   1HG   GLU  35          2HG       GLU  35   2.304   4.783   4.372
  382   2HG   GLU  35          3HG       GLU  35   2.154   3.637   3.027
  383    QB   GLU  35           QB       GLU  35   4.309   5.258   2.884
  384    QG   GLU  35           QG       GLU  35   2.229   4.210   3.700
  385    H    ASN  36           HN       ASN  36   5.109   6.924   1.105
  386    HA   ASN  36           HA       ASN  36   3.650   9.471   1.549
  387   1HB   ASN  36          2HB       ASN  36   5.843  10.561   1.342
  388   2HB   ASN  36          3HB       ASN  36   5.732   9.335   2.603
  389   1HD2  ASN  36          2HD2      ASN  36   7.879   8.225  -0.725
  390   2HD2  ASN  36          1HD2      ASN  36   6.458   9.219  -0.984
  391    QB   ASN  36           QB       ASN  36   5.787   9.948   1.972
  392    QD2  ASN  36           QD2      ASN  36   7.168   8.721  -0.855
  393    H    GLY  37           HN       GLY  37   3.434   7.617  -1.070
  394   1HA   GLY  37          1HA       GLY  37   3.114   7.948  -3.278
  395   2HA   GLY  37          2HA       GLY  37   2.442   9.510  -2.790
  396    QA   GLY  37           QA       GLY  37   2.778   8.729  -3.034
  397    H    LYS  38           HN       LYS  38   5.717   8.086  -2.981
  398    HA   LYS  38           HA       LYS  38   6.889  10.526  -4.172
  399   1HB   LYS  38          2HB       LYS  38   7.862   8.007  -2.938
  400   2HB   LYS  38          3HB       LYS  38   8.866   8.562  -4.250
  401   1HG   LYS  38          2HG       LYS  38   8.038  10.582  -2.175
  402   2HG   LYS  38          3HG       LYS  38   9.234   9.374  -1.716
  403   1HD   LYS  38          2HD       LYS  38   9.566  11.153  -4.150
  404   2HD   LYS  38          3HD       LYS  38  10.176  11.514  -2.522
  405   1HE   LYS  38          2HE       LYS  38  11.270   9.069  -2.711
  406   2HE   LYS  38          3HE       LYS  38  11.044   9.332  -4.446
  407   1HZ   LYS  38          3HZ       LYS  38  12.247  11.553  -3.866
  408   2HZ   LYS  38          1HZ       LYS  38  12.790  10.698  -2.566
  409   3HZ   LYS  38          2HZ       LYS  38  13.104  10.167  -4.087
  410    QB   LYS  38           QB       LYS  38   8.364   8.284  -3.594
  411    QG   LYS  38           QG       LYS  38   8.636   9.978  -1.945
  412    QD   LYS  38           QD       LYS  38   9.871  11.333  -3.336
  413    QE   LYS  38           QE       LYS  38  11.157   9.201  -3.578
  414    QZ   LYS  38           QZ       LYS  38  12.713  10.806  -3.506
  415    H    THR  39           HN       THR  39   4.821   8.551  -5.606
  416    HA   THR  39           HA       THR  39   6.162   8.896  -8.164
  417    HB   THR  39           HB       THR  39   6.521   6.448  -7.331
  418    HG1  THR  39          1HG       THR  39   6.968   6.738  -9.368
  419   1HG2  THR  39          3HG2      THR  39   4.058   6.143  -6.631
  420   2HG2  THR  39          1HG2      THR  39   3.678   6.118  -8.369
  421   3HG2  THR  39          2HG2      THR  39   4.757   4.892  -7.681
  422    QG2  THR  39           QG2      THR  39   4.164   5.718  -7.560
  423    H    LYS  40           HN       LYS  40   4.550   8.542  -9.908
  424    HA   LYS  40           HA       LYS  40   2.073  10.016  -9.156
  425   1HB   LYS  40          2HB       LYS  40   3.374   9.545 -11.878
  426   2HB   LYS  40          3HB       LYS  40   1.891  10.443 -11.559
  427   1HG   LYS  40          2HG       LYS  40   3.264  12.233 -11.506
  428   2HG   LYS  40          3HG       LYS  40   3.408  11.772  -9.824
  429   1HD   LYS  40          2HD       LYS  40   5.556  12.314 -10.606
  430   2HD   LYS  40          3HD       LYS  40   5.584  10.577 -10.380
  431   1HE   LYS  40          2HE       LYS  40   4.822  11.624 -13.126
  432   2HE   LYS  40          3HE       LYS  40   6.481  11.926 -12.614
  433   1HZ   LYS  40          3HZ       LYS  40   5.278   9.247 -12.673
  434   2HZ   LYS  40          1HZ       LYS  40   6.216   9.888 -13.859
  435   3HZ   LYS  40          2HZ       LYS  40   6.855   9.629 -12.369
  436    QB   LYS  40           QB       LYS  40   2.632   9.994 -11.718
  437    QG   LYS  40           QG       LYS  40   3.336  12.002 -10.665
  438    QD   LYS  40           QD       LYS  40   5.570  11.445 -10.493
  439    QE   LYS  40           QE       LYS  40   5.652  11.776 -12.869
  440    QZ   LYS  40           QZ       LYS  40   6.116   9.588 -12.967
  441    NH1  ARG  41           NH2      ARG  41  -4.154   7.305 -11.643
  442    NH2  ARG  41           NH1      ARG  41  -5.234   5.591 -12.770
  443    H    ARG  41           HN       ARG  41   3.139   7.037 -10.854
  444    HA   ARG  41           HA       ARG  41   0.535   5.862 -10.226
  445   1HB   ARG  41          2HB       ARG  41   0.699   6.881 -12.700
  446   2HB   ARG  41          3HB       ARG  41   1.564   5.383 -13.008
  447   1HG   ARG  41          2HG       ARG  41  -0.690   4.947 -13.520
  448   2HG   ARG  41          3HG       ARG  41  -0.438   4.148 -11.959
  449   1HD   ARG  41          2HD       ARG  41  -1.608   5.960 -10.791
  450   2HD   ARG  41          3HD       ARG  41  -1.544   6.975 -12.248
  451    HE   ARG  41           HE       ARG  41  -2.961   4.501 -12.712
  452   1HH1  ARG  41          2HH2      ARG  41  -3.315   7.672 -11.218
  453   2HH1  ARG  41          1HH2      ARG  41  -4.999   7.854 -11.595
  454   1HH2  ARG  41          2HH1      ARG  41  -5.216   4.695 -13.234
  455   2HH2  ARG  41          1HH1      ARG  41  -6.111   6.091 -12.739
  456    QB   ARG  41           QB       ARG  41   1.132   6.131 -12.854
  457    QG   ARG  41           QG       ARG  41  -0.564   4.547 -12.740
  458    QD   ARG  41           QD       ARG  41  -1.577   6.468 -11.520
  459    QH1  ARG  41           QH2      ARG  41  -4.156   7.763 -11.407
  460    QH2  ARG  41           QH1      ARG  41  -5.663   5.393 -12.987
  461    HA   PRO  42           HA       PRO  42   3.934   2.918  -9.438
  462   1HB   PRO  42          2HB       PRO  42   2.629   1.347  -7.586
  463   2HB   PRO  42          3HB       PRO  42   3.417   2.876  -7.170
  464   1HG   PRO  42          2HG       PRO  42   0.551   2.243  -7.609
  465   2HG   PRO  42          3HG       PRO  42   1.212   3.461  -6.504
  466   1HD   PRO  42          2HD       PRO  42   0.062   3.961  -9.003
  467   2HD   PRO  42          3HD       PRO  42   1.085   5.107  -8.101
  468    QB   PRO  42           QB       PRO  42   3.023   2.112  -7.378
  469    QG   PRO  42           QG       PRO  42   0.881   2.852  -7.057
  470    QD   PRO  42           QD       PRO  42   0.574   4.533  -8.552
  471    NH1  ARG  43           NH2      ARG  43   6.373  -5.001 -10.428
  472    NH2  ARG  43           NH1      ARG  43   6.279  -5.456 -12.699
  473    H    ARG  43           HN       ARG  43   4.079   0.595  -9.702
  474    HA   ARG  43           HA       ARG  43   2.174  -0.474 -11.690
  475   1HB   ARG  43          2HB       ARG  43   3.820  -2.195 -12.056
  476   2HB   ARG  43          3HB       ARG  43   4.614  -0.615 -12.071
  477   1HG   ARG  43          2HG       ARG  43   5.261  -1.061  -9.605
  478   2HG   ARG  43          3HG       ARG  43   4.687  -2.717  -9.856
  479   1HD   ARG  43          2HD       ARG  43   6.851  -1.285 -11.460
  480   2HD   ARG  43          3HD       ARG  43   7.173  -2.435 -10.178
  481    HE   ARG  43           HE       ARG  43   6.307  -2.955 -12.927
  482   1HH1  ARG  43          2HH2      ARG  43   6.363  -4.328  -9.678
  483   2HH1  ARG  43          1HH2      ARG  43   6.330  -5.982 -10.190
  484   1HH2  ARG  43          2HH1      ARG  43   6.236  -5.143 -13.658
  485   2HH2  ARG  43          1HH1      ARG  43   6.259  -6.448 -12.518
  486    QB   ARG  43           QB       ARG  43   4.216  -1.405 -12.063
  487    QG   ARG  43           QG       ARG  43   4.974  -1.890  -9.731
  488    QD   ARG  43           QD       ARG  43   7.013  -1.860 -10.819
  489    QH1  ARG  43           QH2      ARG  43   6.346  -5.155  -9.935
  490    QH2  ARG  43           QH1      ARG  43   6.248  -5.796 -13.088
  491    H    PHE  44           HN       PHE  44   3.258  -1.031  -8.353
  492    HA   PHE  44           HA       PHE  44   1.660  -3.504  -8.204
  493   1HB   PHE  44          2HB       PHE  44   2.689  -3.544  -5.862
  494   2HB   PHE  44          3HB       PHE  44   3.731  -3.782  -7.241
  495    HD1  PHE  44          1HD       PHE  44   2.404  -0.807  -5.270
  496    HD2  PHE  44          2HD       PHE  44   5.838  -2.753  -7.011
  497    HE1  PHE  44          1HE       PHE  44   3.754   1.224  -4.906
  498    HE2  PHE  44          2HE       PHE  44   7.228  -0.777  -6.448
  499    HZ   PHE  44           HZ       PHE  44   6.202   1.167  -5.257
  500    QB   PHE  44           QB       PHE  44   3.210  -3.663  -6.551
  501    QR   PHE  44           QR       PHE  44   4.807  -0.779  -5.908
  502    H    LEU  45           HN       LEU  45   0.326  -0.837  -8.539
  503    HA   LEU  45           HA       LEU  45  -0.841  -0.163  -6.037
  504   1HB   LEU  45          2HB       LEU  45  -1.009   1.060  -8.437
  505   2HB   LEU  45          3HB       LEU  45  -2.450   0.080  -8.571
  506    HG   LEU  45           HG       LEU  45  -3.235   0.995  -6.390
  507   1HD1  LEU  45          1HD1      LEU  45  -0.901   1.938  -5.636
  508   2HD1  LEU  45          2HD1      LEU  45  -1.215   3.257  -6.774
  509   3HD1  LEU  45          3HD1      LEU  45  -2.269   3.012  -5.412
  510   1HD2  LEU  45          2HD2      LEU  45  -3.685   1.952  -8.851
  511   2HD2  LEU  45          3HD2      LEU  45  -4.385   2.681  -7.395
  512   3HD2  LEU  45          1HD2      LEU  45  -2.950   3.395  -8.150
  513    QB   LEU  45           QB       LEU  45  -1.729   0.570  -8.504
  514    QD1  LEU  45           QD1      LEU  45  -1.462   2.736  -5.940
  515    QD2  LEU  45           QD2      LEU  45  -3.674   2.676  -8.132
  516    QQD  LEU  45           QQD      LEU  45  -2.568   2.707  -7.036
  517    HA   PRO  46           HA       PRO  46  -4.328  -3.257  -6.921
  518   1HB   PRO  46          2HB       PRO  46  -3.917  -5.387  -8.622
  519   2HB   PRO  46          3HB       PRO  46  -4.679  -3.840  -9.074
  520   1HG   PRO  46          2HG       PRO  46  -1.909  -4.793  -9.670
  521   2HG   PRO  46          3HG       PRO  46  -2.957  -3.708 -10.620
  522   1HD   PRO  46          2HD       PRO  46  -0.851  -2.998  -8.929
  523   2HD   PRO  46          3HD       PRO  46  -2.068  -1.860  -9.561
  524    QB   PRO  46           QB       PRO  46  -4.297  -4.613  -8.848
  525    QG   PRO  46           QG       PRO  46  -2.433  -4.251 -10.145
  526    QD   PRO  46           QD       PRO  46  -1.460  -2.429  -9.245
  527    H    GLU  47           HN       GLU  47  -1.028  -4.731  -7.261
  528    HA   GLU  47           HA       GLU  47  -1.445  -6.889  -5.514
  529   1HB   GLU  47          2HB       GLU  47   1.052  -5.238  -5.993
  530   2HB   GLU  47          3HB       GLU  47   1.000  -6.806  -5.167
  531   1HG   GLU  47          2HG       GLU  47   1.133  -7.874  -7.128
  532   2HG   GLU  47          3HG       GLU  47  -0.386  -7.153  -7.659
  533    QB   GLU  47           QB       GLU  47   1.026  -6.022  -5.580
  534    QG   GLU  47           QG       GLU  47   0.374  -7.513  -7.394
  535    H    LEU  48           HN       LEU  48  -0.367  -3.511  -4.691
  536    HA   LEU  48           HA       LEU  48  -0.214  -4.112  -1.887
  537   1HB   LEU  48          2HB       LEU  48   1.001  -2.279  -2.931
  538   2HB   LEU  48          3HB       LEU  48  -0.505  -1.420  -3.256
  539    HG   LEU  48           HG       LEU  48  -0.229  -2.339  -0.434
  540   1HD1  LEU  48          2HD1      LEU  48   2.125  -1.969  -0.949
  541   2HD1  LEU  48          3HD1      LEU  48   1.797  -0.267  -1.261
  542   3HD1  LEU  48          1HD1      LEU  48   1.464  -0.915   0.332
  543   1HD2  LEU  48          2HD2      LEU  48  -1.009   0.237  -1.827
  544   2HD2  LEU  48          3HD2      LEU  48  -1.946  -0.769  -0.734
  545   3HD2  LEU  48          1HD2      LEU  48  -0.616   0.222  -0.103
  546    QB   LEU  48           QB       LEU  48   0.248  -1.850  -3.094
  547    QD1  LEU  48           QD1      LEU  48   1.795  -1.050  -0.626
  548    QD2  LEU  48           QD2      LEU  48  -1.191  -0.104  -0.888
  549    QQD  LEU  48           QQD      LEU  48   0.302  -0.577  -0.757
  550    H    ALA  49           HN       ALA  49  -2.807  -2.681  -3.913
  551    HA   ALA  49           HA       ALA  49  -4.664  -2.164  -1.856
  552   1HB   ALA  49          1HB       ALA  49  -4.802  -2.567  -4.797
  553   2HB   ALA  49          2HB       ALA  49  -6.275  -2.989  -3.954
  554   3HB   ALA  49          3HB       ALA  49  -5.619  -1.374  -3.758
  555    QB   ALA  49           QB       ALA  49  -5.565  -2.310  -4.170
  556    H    SER  50           HN       SER  50  -4.254  -5.177  -3.768
  557    HA   SER  50           HA       SER  50  -6.282  -6.608  -2.333
  558   1HB   SER  50          2HB       SER  50  -5.284  -8.613  -3.414
  559   2HB   SER  50          3HB       SER  50  -5.673  -7.307  -4.548
  560    HG   SER  50           HG       SER  50  -3.512  -6.754  -4.649
  561    QB   SER  50           QB       SER  50  -5.479  -7.960  -3.980
  562    H    ALA  51           HN       ALA  51  -2.710  -6.563  -2.022
  563    HA   ALA  51           HA       ALA  51  -2.434  -8.388   0.067
  564   1HB   ALA  51          2HB       ALA  51  -0.806  -5.880  -0.485
  565   2HB   ALA  51          3HB       ALA  51  -0.309  -7.231   0.562
  566   3HB   ALA  51          1HB       ALA  51  -0.528  -7.496  -1.181
  567    QB   ALA  51           QB       ALA  51  -0.547  -6.869  -0.368
  568    H    LEU  52           HN       LEU  52  -3.137  -4.850   0.316
  569    HA   LEU  52           HA       LEU  52  -3.340  -5.009   3.222
  570   1HB   LEU  52          2HB       LEU  52  -3.813  -2.882   1.153
  571   2HB   LEU  52          3HB       LEU  52  -4.783  -2.805   2.592
  572    HG   LEU  52           HG       LEU  52  -3.097  -1.437   3.196
  573   1HD1  LEU  52          3HD1      LEU  52  -3.147  -3.383   4.927
  574   2HD1  LEU  52          1HD1      LEU  52  -1.667  -3.959   4.147
  575   3HD1  LEU  52          2HD1      LEU  52  -1.694  -2.356   4.867
  576   1HD2  LEU  52          3HD2      LEU  52  -1.765  -1.826   1.216
  577   2HD2  LEU  52          1HD2      LEU  52  -0.872  -1.489   2.716
  578   3HD2  LEU  52          2HD2      LEU  52  -0.944  -3.164   2.081
  579    QB   LEU  52           QB       LEU  52  -4.298  -2.843   1.872
  580    QD1  LEU  52           QD1      LEU  52  -2.169  -3.233   4.647
  581    QD2  LEU  52           QD2      LEU  52  -1.193  -2.159   2.004
  582    QQD  LEU  52           QQD      LEU  52  -1.681  -2.696   3.326
  583    H    GLY  53           HN       GLY  53  -5.650  -5.145   0.504
  584   1HA   GLY  53          1HA       GLY  53  -7.710  -6.322   0.615
  585   2HA   GLY  53          2HA       GLY  53  -7.789  -6.100   2.373
  586    QA   GLY  53           QA       GLY  53  -7.749  -6.211   1.494
  587    H    VAL  54           HN       VAL  54  -7.375  -4.017  -0.513
  588    HA   VAL  54           HA       VAL  54  -9.920  -2.625  -0.094
  589    HB   VAL  54           HB       VAL  54  -8.777  -0.382  -0.485
  590   1HG1  VAL  54          2HG1      VAL  54  -9.742  -0.942   1.651
  591   2HG1  VAL  54          3HG1      VAL  54  -8.235  -1.746   2.123
  592   3HG1  VAL  54          1HG1      VAL  54  -8.261   0.002   1.880
  593   1HG2  VAL  54          3HG2      VAL  54  -6.257  -1.969   0.163
  594   2HG2  VAL  54          1HG2      VAL  54  -6.598  -0.923  -1.233
  595   3HG2  VAL  54          2HG2      VAL  54  -6.372  -0.234   0.377
  596    QG1  VAL  54           QG1      VAL  54  -8.747  -0.895   1.884
  597    QG2  VAL  54           QG2      VAL  54  -6.409  -1.042  -0.231
  598    QQG  VAL  54           QQG      VAL  54  -7.578  -0.969   0.827
  599    H    SER  55           HN       SER  55 -10.241  -1.138  -2.110
  600    HA   SER  55           HA       SER  55  -9.494  -2.689  -4.504
  601   1HB   SER  55          2HB       SER  55 -11.356  -1.108  -5.401
  602   2HB   SER  55          3HB       SER  55 -11.796  -2.361  -4.242
  603    HG   SER  55           HG       SER  55 -11.360   0.393  -3.673
  604    QB   SER  55           QB       SER  55 -11.575  -1.735  -4.822
  605    H    VAL  56           HN       VAL  56  -8.696  -1.651  -6.402
  606    HA   VAL  56           HA       VAL  56  -6.640   0.254  -6.149
  607    HB   VAL  56           HB       VAL  56  -8.361  -0.407  -8.567
  608   1HG1  VAL  56          2HG1      VAL  56  -6.883   1.719  -8.752
  609   2HG1  VAL  56          3HG1      VAL  56  -5.502   0.632  -8.535
  610   3HG1  VAL  56          1HG1      VAL  56  -6.579   0.439  -9.932
  611   1HG2  VAL  56          3HG2      VAL  56  -7.154  -2.406  -7.492
  612   2HG2  VAL  56          1HG2      VAL  56  -6.654  -2.033  -9.146
  613   3HG2  VAL  56          2HG2      VAL  56  -5.636  -1.538  -7.778
  614    QG1  VAL  56           QG1      VAL  56  -6.321   0.930  -9.073
  615    QG2  VAL  56           QG2      VAL  56  -6.481  -1.992  -8.138
  616    QQG  VAL  56           QQG      VAL  56  -6.402  -0.531  -8.605
  617    H    ASP  57           HN       ASP  57 -10.100   0.734  -7.112
  618    HA   ASP  57           HA       ASP  57 -10.152   3.483  -7.461
  619   1HB   ASP  57          2HB       ASP  57 -12.135   1.456  -6.398
  620   2HB   ASP  57          3HB       ASP  57 -12.490   3.169  -6.169
  621    QB   ASP  57           QB       ASP  57 -12.313   2.313  -6.284
  622    CH2  TRP  58           CH2      TRP  58  -7.119   2.910   2.609
  623    H    TRP  58           HN       TRP  58  -9.858   1.721  -4.392
  624    HA   TRP  58           HA       TRP  58 -10.334   4.146  -2.821
  625   1HB   TRP  58          2HB       TRP  58 -11.129   1.959  -2.062
  626   2HB   TRP  58          3HB       TRP  58  -9.457   1.405  -1.931
  627    HD1  TRP  58           HD1      TRP  58 -11.964   3.798  -0.263
  628    HE1  TRP  58           HE1      TRP  58 -11.129   4.452   2.016
  629    HE3  TRP  58           HE3      TRP  58  -7.278   1.796  -0.605
  630    HZ2  TRP  58           HZ2      TRP  58  -8.624   4.068   3.605
  631    HZ3  TRP  58           HZ3      TRP  58  -5.690   1.989   1.290
  632    HH2  TRP  58           HH2      TRP  58  -6.372   3.086   3.362
  633    QB   TRP  58           QB       TRP  58 -10.293   1.682  -1.997
  634    H    LEU  59           HN       LEU  59  -7.643   2.146  -4.078
  635    HA   LEU  59           HA       LEU  59  -5.649   3.750  -2.771
  636   1HB   LEU  59          2HB       LEU  59  -5.628   1.698  -4.927
  637   2HB   LEU  59          3HB       LEU  59  -4.292   2.799  -4.906
  638    HG   LEU  59           HG       LEU  59  -5.223   1.044  -2.625
  639   1HD1  LEU  59          2HD1      LEU  59  -4.073  -0.080  -4.569
  640   2HD1  LEU  59          3HD1      LEU  59  -2.617   0.842  -4.184
  641   3HD1  LEU  59          1HD1      LEU  59  -3.267  -0.293  -3.000
  642   1HD2  LEU  59          1HD2      LEU  59  -3.649   3.395  -2.301
  643   2HD2  LEU  59          2HD2      LEU  59  -3.817   2.054  -1.159
  644   3HD2  LEU  59          3HD2      LEU  59  -2.482   2.096  -2.317
  645    QB   LEU  59           QB       LEU  59  -4.960   2.248  -4.916
  646    QD1  LEU  59           QD1      LEU  59  -3.319   0.156  -3.917
  647    QD2  LEU  59           QD2      LEU  59  -3.316   2.516  -1.926
  648    QQD  LEU  59           QQD      LEU  59  -3.318   1.335  -2.922
  649    H    LEU  60           HN       LEU  60  -7.638   4.403  -5.568
  650    HA   LEU  60           HA       LEU  60  -5.977   6.783  -6.245
  651   1HB   LEU  60          2HB       LEU  60  -8.540   5.773  -7.489
  652   2HB   LEU  60          3HB       LEU  60  -7.548   7.124  -8.062
  653    HG   LEU  60           HG       LEU  60  -6.669   4.199  -7.905
  654   1HD1  LEU  60          1HD1      LEU  60  -7.344   6.009 -10.253
  655   2HD1  LEU  60          2HD1      LEU  60  -6.700   4.352 -10.373
  656   3HD1  LEU  60          3HD1      LEU  60  -8.300   4.631  -9.659
  657   1HD2  LEU  60          3HD2      LEU  60  -5.129   6.654  -8.852
  658   2HD2  LEU  60          1HD2      LEU  60  -4.674   5.524  -7.558
  659   3HD2  LEU  60          2HD2      LEU  60  -4.680   4.980  -9.229
  660    QB   LEU  60           QB       LEU  60  -8.044   6.449  -7.776
  661    QD1  LEU  60           QD1      LEU  60  -7.448   4.997 -10.095
  662    QD2  LEU  60           QD2      LEU  60  -4.828   5.720  -8.546
  663    QQD  LEU  60           QQD      LEU  60  -6.138   5.359  -9.321
  664    H    ASN  61           HN       ASN  61  -9.395   6.297  -5.260
  665    HA   ASN  61           HA       ASN  61  -9.668   9.075  -4.363
  666   1HB   ASN  61          2HB       ASN  61 -11.501   6.660  -4.113
  667   2HB   ASN  61          3HB       ASN  61 -11.849   8.255  -3.437
  668   1HD2  ASN  61          2HD2      ASN  61 -12.493   7.645  -7.378
  669   2HD2  ASN  61          1HD2      ASN  61 -11.964   6.346  -6.328
  670    QB   ASN  61           QB       ASN  61 -11.675   7.457  -3.775
  671    QD2  ASN  61           QD2      ASN  61 -12.229   6.995  -6.853
  672    H    GLY  62           HN       GLY  62  -9.871   5.921  -2.557
  673   1HA   GLY  62          1HA       GLY  62  -9.181   5.501  -0.358
  674   2HA   GLY  62          2HA       GLY  62  -8.249   6.980  -0.467
  675    QA   GLY  62           QA       GLY  62  -8.714   6.241  -0.413
  676    H    THR  63           HN       THR  63 -11.621   6.008  -0.317
  677    HA   THR  63           HA       THR  63 -12.085   7.799   2.008
  678    HB   THR  63           HB       THR  63 -14.301   8.130   0.858
  679    HG1  THR  63          1HG       THR  63 -14.505   7.238  -1.064
  680   1HG2  THR  63          2HG2      THR  63 -12.431   9.862   0.988
  681   2HG2  THR  63          3HG2      THR  63 -11.835   9.264  -0.575
  682   3HG2  THR  63          1HG2      THR  63 -13.426  10.034  -0.476
  683    QG2  THR  63           QG2      THR  63 -12.563   9.720  -0.021
  684    H    SER  64           HN       SER  64 -12.245   6.350   3.543
  685    HA   SER  64           HA       SER  64 -13.646   3.768   3.266
  686   1HB   SER  64          2HB       SER  64 -11.594   4.013   4.695
  687   2HB   SER  64          3HB       SER  64 -12.486   5.134   5.745
  688    HG   SER  64           HG       SER  64 -13.599   3.487   6.533
  689    QB   SER  64           QB       SER  64 -12.040   4.573   5.220
  690    H    ASP  65           HN       ASP  65 -15.203   3.402   5.225
  691    HA   ASP  65           HA       ASP  65 -17.584   4.871   4.991
  692   1HB   ASP  65          2HB       ASP  65 -17.590   2.696   6.053
  693   2HB   ASP  65          3HB       ASP  65 -16.478   3.256   7.323
  694    QB   ASP  65           QB       ASP  65 -17.034   2.976   6.688
  695    H    SER  66           HN       SER  66 -18.400   6.667   5.956
  696    HA   SER  66           HA       SER  66 -17.312   7.976   8.238
  697   1HB   SER  66          2HB       SER  66 -15.494   8.511   6.515
  698   2HB   SER  66          3HB       SER  66 -16.715   9.412   5.611
  699    HG   SER  66           HG       SER  66 -15.872   9.863   8.300
  700    QB   SER  66           QB       SER  66 -16.104   8.962   6.063
  701    H    ASN  67           HN       ASN  67 -19.591   7.690   8.616
  702    HA   ASN  67           HA       ASN  67 -21.422   9.504   7.115
  703   1HB   ASN  67          2HB       ASN  67 -21.847   6.989   7.816
  704   2HB   ASN  67          3HB       ASN  67 -22.306   7.708   9.364
  705   1HD2  ASN  67          2HD2      ASN  67 -24.931   7.689   6.328
  706   2HD2  ASN  67          1HD2      ASN  67 -23.486   6.693   6.399
  707    QB   ASN  67           QB       ASN  67 -22.077   7.348   8.590
  708    QD2  ASN  67           QD2      ASN  67 -24.209   7.191   6.363
  709    H    VAL  68           HN       VAL  68 -19.604   9.326  10.062
  710    HA   VAL  68           HA       VAL  68 -21.124  10.823  11.860
  711    HB   VAL  68           HB       VAL  68 -18.097  10.786  11.499
  712   1HG1  VAL  68          2HG1      VAL  68 -18.804  12.573  13.040
  713   2HG1  VAL  68          3HG1      VAL  68 -19.743  11.393  13.989
  714   3HG1  VAL  68          1HG1      VAL  68 -17.969  11.280  13.890
  715   1HG2  VAL  68          1HG2      VAL  68 -20.046   8.776  12.559
  716   2HG2  VAL  68          2HG2      VAL  68 -18.418   8.554  11.885
  717   3HG2  VAL  68          3HG2      VAL  68 -18.621   9.060  13.565
  718    QG1  VAL  68           QG1      VAL  68 -18.838  11.749  13.640
  719    QG2  VAL  68           QG2      VAL  68 -19.028   8.797  12.670
  720    QQG  VAL  68           QQG      VAL  68 -18.933  10.272  13.155
  721    NH1  ARG  69           NH2      ARG  69 -25.130  17.055   9.674
  722    NH2  ARG  69           NH1      ARG  69 -26.726  16.345   8.151
  723    H    ARG  69           HN       ARG  69 -21.330  12.994  12.314
  724    HA   ARG  69           HA       ARG  69 -20.873  14.869  10.049
  725   1HB   ARG  69          2HB       ARG  69 -22.756  14.895  12.444
  726   2HB   ARG  69          3HB       ARG  69 -22.642  16.197  11.265
  727   1HG   ARG  69          2HG       ARG  69 -23.430  13.325  10.567
  728   2HG   ARG  69          3HG       ARG  69 -24.557  14.632  10.903
  729   1HD   ARG  69          2HD       ARG  69 -22.815  15.742   8.947
  730   2HD   ARG  69          3HD       ARG  69 -22.956  14.057   8.483
  731    HE   ARG  69           HE       ARG  69 -25.076  14.462   7.746
  732   1HH1  ARG  69          2HH2      ARG  69 -24.241  16.893  10.127
  733   2HH1  ARG  69          1HH2      ARG  69 -25.678  17.856   9.950
  734   1HH2  ARG  69          2HH1      ARG  69 -27.045  15.685   7.457
  735   2HH2  ARG  69          1HH1      ARG  69 -27.324  17.123   8.385
  736    QB   ARG  69           QB       ARG  69 -22.699  15.547  11.854
  737    QG   ARG  69           QG       ARG  69 -23.993  13.979  10.734
  738    QD   ARG  69           QD       ARG  69 -22.885  14.900   8.715
  739    QH1  ARG  69           QH2      ARG  69 -24.959  17.373  10.038
  740    QH2  ARG  69           QH1      ARG  69 -27.185  16.404   7.921
   
  Start of MODEL          15
 Raw file had 740 H/Q atoms
  Start of MODEL   15
    1    H    SER   1           HN       SER   1  -1.101  10.651  -0.360
    2    HA   SER   1           HA       SER   1  -2.014  10.272   1.764
    3   1HB   SER   1          2HB       SER   1  -4.662   9.732   0.454
    4   2HB   SER   1          3HB       SER   1  -4.312  10.095   2.149
    5    HG   SER   1           HG       SER   1  -4.902  12.060   1.160
    6    QB   SER   1           QB       SER   1  -4.487   9.913   1.302
    7    H    ILE   2           HN       ILE   2  -1.473   8.356  -0.814
    8    HA   ILE   2           HA       ILE   2  -2.486   5.876  -0.103
    9    HB   ILE   2           HB       ILE   2   0.347   6.074  -1.071
   10   1HG1  ILE   2          2HG1      ILE   2  -0.958   5.902  -3.432
   11   2HG1  ILE   2          3HG1      ILE   2  -2.120   6.918  -2.580
   12   1HG2  ILE   2          1HG2      ILE   2  -1.345   3.938  -0.529
   13   2HG2  ILE   2          2HG2      ILE   2  -1.608   4.153  -2.248
   14   3HG2  ILE   2          3HG2      ILE   2   0.021   3.885  -1.610
   15   1HD1  ILE   2          1HD1      ILE   2  -0.138   8.520  -2.119
   16   2HD1  ILE   2          2HD1      ILE   2   0.859   7.426  -3.069
   17   3HD1  ILE   2          3HD1      ILE   2  -0.497   8.265  -3.834
   18    QG1  ILE   2           QG1      ILE   2  -1.539   6.411  -3.006
   19    QG2  ILE   2           QG2      ILE   2  -0.978   3.992  -1.462
   20    QD1  ILE   2           QD1      ILE   2   0.074   8.070  -3.007
   21    H    SER   3           HN       SER   3   0.082   7.752   1.365
   22    HA   SER   3           HA       SER   3   1.261   5.987   3.171
   23   1HB   SER   3          2HB       SER   3   1.333   8.717   2.797
   24   2HB   SER   3          3HB       SER   3   0.332   8.678   4.232
   25    HG   SER   3           HG       SER   3   2.956   7.826   3.885
   26    QB   SER   3           QB       SER   3   0.833   8.698   3.514
   27    H    SER   4           HN       SER   4  -1.677   7.902   3.905
   28    HA   SER   4           HA       SER   4  -2.154   6.480   6.333
   29   1HB   SER   4          2HB       SER   4  -3.036   8.755   5.848
   30   2HB   SER   4          3HB       SER   4  -4.154   8.050   4.659
   31    HG   SER   4           HG       SER   4  -4.792   6.662   6.581
   32    QB   SER   4           QB       SER   4  -3.595   8.402   5.253
   33    NH1  ARG   5           NH2      ARG   5  -4.920   7.059  -2.846
   34    NH2  ARG   5           NH1      ARG   5  -6.069   8.885  -2.083
   35    H    ARG   5           HN       ARG   5  -3.311   6.015   2.955
   36    HA   ARG   5           HA       ARG   5  -5.313   4.117   3.591
   37   1HB   ARG   5          2HB       ARG   5  -3.592   4.312   1.126
   38   2HB   ARG   5          3HB       ARG   5  -4.965   3.366   1.147
   39   1HG   ARG   5          2HG       ARG   5  -6.413   5.368   1.588
   40   2HG   ARG   5          3HG       ARG   5  -4.968   6.375   1.607
   41   1HD   ARG   5          2HD       ARG   5  -4.539   5.367  -0.795
   42   2HD   ARG   5          3HD       ARG   5  -6.258   4.957  -0.725
   43    HE   ARG   5           HE       ARG   5  -6.382   7.525  -0.007
   44   1HH1  ARG   5          2HH2      ARG   5  -4.763   6.058  -2.850
   45   2HH1  ARG   5          1HH2      ARG   5  -4.833   7.490  -3.757
   46   1HH2  ARG   5          2HH1      ARG   5  -6.929   9.183  -1.626
   47   2HH2  ARG   5          1HH1      ARG   5  -5.926   9.321  -2.983
   48    QB   ARG   5           QB       ARG   5  -4.278   3.839   1.136
   49    QG   ARG   5           QG       ARG   5  -5.691   5.871   1.597
   50    QD   ARG   5           QD       ARG   5  -5.399   5.162  -0.760
   51    QH1  ARG   5           QH2      ARG   5  -4.797   6.774  -3.304
   52    QH2  ARG   5           QH1      ARG   5  -6.428   9.252  -2.305
   53    H    VAL   6           HN       VAL   6  -2.027   3.466   2.331
   54    HA   VAL   6           HA       VAL   6  -1.932   0.683   2.720
   55    HB   VAL   6           HB       VAL   6   0.136   2.909   2.451
   56   1HG1  VAL   6          2HG1      VAL   6   0.709  -0.016   2.996
   57   2HG1  VAL   6          3HG1      VAL   6   1.864   1.113   2.239
   58   3HG1  VAL   6          1HG1      VAL   6   1.257   1.444   3.865
   59   1HG2  VAL   6          3HG2      VAL   6  -1.231   1.905   0.485
   60   2HG2  VAL   6          1HG2      VAL   6   0.541   1.785   0.317
   61   3HG2  VAL   6          2HG2      VAL   6  -0.396   0.391   0.887
   62    QG1  VAL   6           QG1      VAL   6   1.277   0.847   3.033
   63    QG2  VAL   6           QG2      VAL   6  -0.362   1.360   0.563
   64    QQG  VAL   6           QQG      VAL   6   0.457   1.104   1.798
   65    H    LYS   7           HN       LYS   7  -0.643   3.286   4.866
   66    HA   LYS   7           HA       LYS   7   0.296   1.544   6.849
   67   1HB   LYS   7          2HB       LYS   7   0.798   4.001   6.483
   68   2HB   LYS   7          3HB       LYS   7  -0.742   4.357   7.269
   69   1HG   LYS   7          2HG       LYS   7   0.322   2.894   9.239
   70   2HG   LYS   7          3HG       LYS   7   1.819   3.129   8.332
   71   1HD   LYS   7          2HD       LYS   7   1.861   4.938   9.858
   72   2HD   LYS   7          3HD       LYS   7   1.324   5.629   8.336
   73   1HE   LYS   7          2HE       LYS   7  -0.154   6.572   9.942
   74   2HE   LYS   7          3HE       LYS   7  -1.114   5.295   9.202
   75   1HZ   LYS   7          2HZ       LYS   7   0.124   4.079  11.283
   76   2HZ   LYS   7          3HZ       LYS   7  -0.243   5.562  11.881
   77   3HZ   LYS   7          1HZ       LYS   7  -1.433   4.613  11.258
   78    QB   LYS   7           QB       LYS   7   0.028   4.179   6.876
   79    QG   LYS   7           QG       LYS   7   1.071   3.012   8.786
   80    QD   LYS   7           QD       LYS   7   1.592   5.283   9.097
   81    QE   LYS   7           QE       LYS   7  -0.633   5.934   9.572
   82    QZ   LYS   7           QZ       LYS   7  -0.517   4.751  11.474
   83    H    SER   8           HN       SER   8  -2.851   3.365   6.830
   84    HA   SER   8           HA       SER   8  -3.821   2.383   9.290
   85   1HB   SER   8          2HB       SER   8  -5.446   3.140   6.832
   86   2HB   SER   8          3HB       SER   8  -6.050   3.009   8.492
   87    HG   SER   8           HG       SER   8  -4.102   4.792   7.473
   88    QB   SER   8           QB       SER   8  -5.748   3.075   7.661
   89    H    LYS   9           HN       LYS   9  -4.286   1.038   5.957
   90    HA   LYS   9           HA       LYS   9  -5.896  -1.103   6.891
   91   1HB   LYS   9          2HB       LYS   9  -4.894  -0.249   4.372
   92   2HB   LYS   9          3HB       LYS   9  -4.264  -1.861   4.613
   93   1HG   LYS   9          2HG       LYS   9  -7.169  -0.977   4.610
   94   2HG   LYS   9          3HG       LYS   9  -6.290  -1.970   3.447
   95   1HD   LYS   9          2HD       LYS   9  -5.909  -3.598   5.483
   96   2HD   LYS   9          3HD       LYS   9  -7.278  -2.728   6.215
   97   1HE   LYS   9          2HE       LYS   9  -8.614  -3.239   4.089
   98   2HE   LYS   9          3HE       LYS   9  -7.226  -4.186   3.550
   99   1HZ   LYS   9          3HZ       LYS   9  -7.606  -5.390   5.768
  100   2HZ   LYS   9          1HZ       LYS   9  -9.133  -4.790   5.641
  101   3HZ   LYS   9          2HZ       LYS   9  -8.504  -5.744   4.444
  102    QB   LYS   9           QB       LYS   9  -4.580  -1.055   4.493
  103    QG   LYS   9           QG       LYS   9  -6.730  -1.472   4.028
  104    QD   LYS   9           QD       LYS   9  -6.594  -3.163   5.849
  105    QE   LYS   9           QE       LYS   9  -7.920  -3.713   3.820
  106    QZ   LYS   9           QZ       LYS   9  -8.415  -5.308   5.285
  107    NH1  ARG  10           NH2      ARG  10   2.503  -1.088   4.724
  108    NH2  ARG  10           NH1      ARG  10   2.961   1.016   5.511
  109    H    ARG  10           HN       ARG  10  -2.353  -0.763   6.511
  110    HA   ARG  10           HA       ARG  10  -1.545  -3.359   7.165
  111   1HB   ARG  10          2HB       ARG  10  -0.248  -0.897   6.777
  112   2HB   ARG  10          3HB       ARG  10   0.087  -1.250   8.470
  113   1HG   ARG  10          2HG       ARG  10   0.730  -3.616   7.619
  114   2HG   ARG  10          3HG       ARG  10   0.688  -2.896   6.015
  115   1HD   ARG  10          2HD       ARG  10   2.476  -2.286   8.384
  116   2HD   ARG  10          3HD       ARG  10   2.917  -2.800   6.747
  117    HE   ARG  10           HE       ARG  10   2.774  -0.142   7.764
  118   1HH1  ARG  10          2HH2      ARG  10   2.289  -2.057   4.900
  119   2HH1  ARG  10          1HH2      ARG  10   2.596  -0.773   3.772
  120   1HH2  ARG  10          2HH1      ARG  10   3.190   1.752   6.194
  121   2HH2  ARG  10          1HH1      ARG  10   3.131   1.346   4.576
  122    QB   ARG  10           QB       ARG  10  -0.080  -1.073   7.623
  123    QG   ARG  10           QG       ARG  10   0.709  -3.257   6.817
  124    QD   ARG  10           QD       ARG  10   2.696  -2.544   7.565
  125    QH1  ARG  10           QH2      ARG  10   2.442  -1.415   4.336
  126    QH2  ARG  10           QH1      ARG  10   3.160   1.549   5.384
  127    H    ILE  11           HN       ILE  11  -2.240  -0.608   9.352
  128    HA   ILE  11           HA       ILE  11  -1.758  -1.991  11.804
  129    HB   ILE  11           HB       ILE  11  -3.526   0.404  11.169
  130   1HG1  ILE  11          2HG1      ILE  11  -1.855   1.382  12.855
  131   2HG1  ILE  11          3HG1      ILE  11  -0.857  -0.044  12.589
  132   1HG2  ILE  11          3HG2      ILE  11  -3.009  -0.852  13.891
  133   2HG2  ILE  11          1HG2      ILE  11  -3.814   0.701  13.600
  134   3HG2  ILE  11          2HG2      ILE  11  -4.589  -0.779  13.084
  135   1HD1  ILE  11          2HD1      ILE  11  -1.752   1.910  10.436
  136   2HD1  ILE  11          3HD1      ILE  11  -0.211   1.998  11.313
  137   3HD1  ILE  11          1HD1      ILE  11  -0.523   0.606  10.284
  138    QG1  ILE  11           QG1      ILE  11  -1.356   0.669  12.722
  139    QG2  ILE  11           QG2      ILE  11  -3.804  -0.310  13.525
  140    QD1  ILE  11           QD1      ILE  11  -0.829   1.505  10.677
  141    H    GLN  12           HN       GLN  12  -4.864  -1.447  10.075
  142    HA   GLN  12           HA       GLN  12  -6.411  -3.105  11.774
  143   1HB   GLN  12          2HB       GLN  12  -6.726  -2.278   8.883
  144   2HB   GLN  12          3HB       GLN  12  -7.699  -3.612   9.495
  145   1HG   GLN  12          2HG       GLN  12  -8.200  -1.886  11.507
  146   2HG   GLN  12          3HG       GLN  12  -7.825  -0.713  10.241
  147   1HE2  GLN  12          2HE2      GLN  12 -11.183  -3.129  10.031
  148   2HE2  GLN  12          1HE2      GLN  12  -9.860  -3.549  11.101
  149    QB   GLN  12           QB       GLN  12  -7.213  -2.945   9.188
  150    QG   GLN  12           QG       GLN  12  -8.012  -1.300  10.874
  151    QE2  GLN  12           QE2      GLN  12 -10.521  -3.339  10.566
  152    H    LEU  13           HN       LEU  13  -4.428  -4.129   9.011
  153    HA   LEU  13           HA       LEU  13  -5.066  -6.958   9.266
  154   1HB   LEU  13          2HB       LEU  13  -3.134  -5.217   7.771
  155   2HB   LEU  13          3HB       LEU  13  -2.577  -6.832   8.082
  156    HG   LEU  13           HG       LEU  13  -3.825  -6.266   5.877
  157   1HD1  LEU  13          3HD1      LEU  13  -4.320  -8.774   7.509
  158   2HD1  LEU  13          1HD1      LEU  13  -4.661  -8.619   5.769
  159   3HD1  LEU  13          2HD1      LEU  13  -2.998  -8.455   6.360
  160   1HD2  LEU  13          2HD2      LEU  13  -5.914  -5.409   7.052
  161   2HD2  LEU  13          3HD2      LEU  13  -6.136  -6.651   5.786
  162   3HD2  LEU  13          1HD2      LEU  13  -6.271  -7.099   7.483
  163    QB   LEU  13           QB       LEU  13  -2.856  -6.024   7.927
  164    QD1  LEU  13           QD1      LEU  13  -3.993  -8.616   6.546
  165    QD2  LEU  13           QD2      LEU  13  -6.107  -6.387   6.774
  166    QQD  LEU  13           QQD      LEU  13  -5.050  -7.501   6.660
  167    H    GLY  14           HN       GLY  14  -2.820  -4.816  10.903
  168   1HA   GLY  14          1HA       GLY  14  -1.690  -5.158  12.865
  169   2HA   GLY  14          2HA       GLY  14  -2.280  -6.827  12.937
  170    QA   GLY  14           QA       GLY  14  -1.985  -5.992  12.901
  171    H    LEU  15           HN       LEU  15  -0.553  -5.265  10.217
  172    HA   LEU  15           HA       LEU  15   1.793  -7.078  10.692
  173   1HB   LEU  15          2HB       LEU  15   0.635  -6.283   7.995
  174   2HB   LEU  15          3HB       LEU  15   2.018  -7.335   8.285
  175    HG   LEU  15           HG       LEU  15  -0.884  -7.925   8.880
  176   1HD1  LEU  15          3HD1      LEU  15   0.012  -8.087   6.505
  177   2HD1  LEU  15          1HD1      LEU  15   1.102  -9.364   7.085
  178   3HD1  LEU  15          2HD1      LEU  15  -0.661  -9.593   7.157
  179   1HD2  LEU  15          1HD2      LEU  15   1.524  -9.211  10.010
  180   2HD2  LEU  15          2HD2      LEU  15  -0.148  -9.220  10.576
  181   3HD2  LEU  15          3HD2      LEU  15   0.354 -10.321   9.293
  182    QB   LEU  15           QB       LEU  15   1.326  -6.809   8.140
  183    QD1  LEU  15           QD1      LEU  15   0.151  -9.015   6.916
  184    QD2  LEU  15           QD2      LEU  15   0.577  -9.585   9.960
  185    QQD  LEU  15           QQD      LEU  15   0.364  -9.299   8.438
  186    H    ASN  16           HN       ASN  16   3.732  -6.310   9.625
  187    HA   ASN  16           HA       ASN  16   3.967  -3.341   9.852
  188   1HB   ASN  16          2HB       ASN  16   6.170  -3.507  10.383
  189   2HB   ASN  16          3HB       ASN  16   5.454  -4.861  11.246
  190   1HD2  ASN  16          2HD2      ASN  16   7.077  -7.312   9.064
  191   2HD2  ASN  16          1HD2      ASN  16   5.538  -7.058   9.850
  192    QB   ASN  16           QB       ASN  16   5.813  -4.184  10.814
  193    QD2  ASN  16           QD2      ASN  16   6.308  -7.185   9.457
  194    H    GLN  17           HN       GLN  17   5.633  -2.312   8.473
  195    HA   GLN  17           HA       GLN  17   4.855  -2.298   5.802
  196   1HB   GLN  17          2HB       GLN  17   6.940  -1.032   7.460
  197   2HB   GLN  17          3HB       GLN  17   7.456  -1.333   5.804
  198   1HG   GLN  17          2HG       GLN  17   5.195  -0.253   5.142
  199   2HG   GLN  17          3HG       GLN  17   5.236   0.373   6.829
  200   1HE2  GLN  17          2HE2      GLN  17   7.401   2.968   5.677
  201   2HE2  GLN  17          1HE2      GLN  17   5.780   2.691   6.357
  202    QB   GLN  17           QB       GLN  17   7.198  -1.183   6.632
  203    QG   GLN  17           QG       GLN  17   5.216   0.060   5.985
  204    QE2  GLN  17           QE2      GLN  17   6.590   2.830   6.017
  205    H    ALA  18           HN       ALA  18   7.629  -4.116   7.208
  206    HA   ALA  18           HA       ALA  18   8.626  -4.950   4.685
  207   1HB   ALA  18          2HB       ALA  18   9.779  -4.974   6.997
  208   2HB   ALA  18          3HB       ALA  18   8.961  -6.523   7.250
  209   3HB   ALA  18          1HB       ALA  18  10.091  -6.323   5.896
  210    QB   ALA  18           QB       ALA  18   9.610  -5.940   6.714
  211    H    GLU  19           HN       GLU  19   6.399  -6.541   7.012
  212    HA   GLU  19           HA       GLU  19   5.916  -8.973   5.609
  213   1HB   GLU  19          2HB       GLU  19   4.332  -7.226   7.503
  214   2HB   GLU  19          3HB       GLU  19   3.524  -8.571   6.707
  215   1HG   GLU  19          2HG       GLU  19   4.937 -10.199   7.662
  216   2HG   GLU  19          3HG       GLU  19   6.085  -9.003   8.271
  217    QB   GLU  19           QB       GLU  19   3.928  -7.899   7.105
  218    QG   GLU  19           QG       GLU  19   5.511  -9.601   7.967
  219    H    LEU  20           HN       LEU  20   4.201  -5.826   5.520
  220    HA   LEU  20           HA       LEU  20   2.361  -6.571   3.496
  221   1HB   LEU  20          2HB       LEU  20   1.980  -4.699   4.857
  222   2HB   LEU  20          3HB       LEU  20   3.458  -3.894   4.365
  223    HG   LEU  20           HG       LEU  20   1.627  -4.679   2.116
  224   1HD1  LEU  20          1HD1      LEU  20   0.053  -4.071   3.934
  225   2HD1  LEU  20          2HD1      LEU  20   0.602  -2.391   3.788
  226   3HD1  LEU  20          3HD1      LEU  20  -0.086  -3.210   2.393
  227   1HD2  LEU  20          2HD2      LEU  20   3.572  -2.561   2.752
  228   2HD2  LEU  20          3HD2      LEU  20   3.088  -3.237   1.201
  229   3HD2  LEU  20          1HD2      LEU  20   2.133  -1.938   1.939
  230    QB   LEU  20           QB       LEU  20   2.718  -4.296   4.612
  231    QD1  LEU  20           QD1      LEU  20   0.189  -3.223   3.372
  232    QD2  LEU  20           QD2      LEU  20   2.930  -2.579   1.964
  233    QQD  LEU  20           QQD      LEU  20   1.561  -2.901   2.668
  234    H    ALA  21           HN       ALA  21   5.651  -5.103   3.194
  235    HA   ALA  21           HA       ALA  21   5.674  -4.949   0.384
  236   1HB   ALA  21          3HB       ALA  21   7.363  -4.001   1.972
  237   2HB   ALA  21          1HB       ALA  21   8.082  -5.619   2.113
  238   3HB   ALA  21          2HB       ALA  21   8.041  -4.807   0.538
  239    QB   ALA  21           QB       ALA  21   7.829  -4.809   1.540
  240    H    GLN  22           HN       GLN  22   6.546  -7.724   2.494
  241    HA   GLN  22           HA       GLN  22   7.151  -9.525   0.351
  242   1HB   GLN  22          2HB       GLN  22   6.283  -9.922   3.232
  243   2HB   GLN  22          3HB       GLN  22   6.234 -11.264   2.095
  244   1HG   GLN  22          2HG       GLN  22   8.703 -10.642   1.528
  245   2HG   GLN  22          3HG       GLN  22   8.648  -9.688   3.019
  246   1HE2  GLN  22          2HE2      GLN  22   8.337 -13.833   3.161
  247   2HE2  GLN  22          1HE2      GLN  22   7.837 -12.971   1.717
  248    QB   GLN  22           QB       GLN  22   6.259 -10.592   2.663
  249    QG   GLN  22           QG       GLN  22   8.675 -10.164   2.273
  250    QE2  GLN  22           QE2      GLN  22   8.088 -13.402   2.439
  251    H    LYS  23           HN       LYS  23   4.012  -8.831   1.973
  252    HA   LYS  23           HA       LYS  23   2.493 -10.738   0.493
  253   1HB   LYS  23          2HB       LYS  23   1.640  -8.059   1.651
  254   2HB   LYS  23          3HB       LYS  23   0.544  -9.298   1.041
  255   1HG   LYS  23          2HG       LYS  23   2.487 -10.013   3.244
  256   2HG   LYS  23          3HG       LYS  23   1.012  -9.103   3.602
  257   1HD   LYS  23          2HD       LYS  23  -0.361 -10.855   2.498
  258   2HD   LYS  23          3HD       LYS  23   1.115 -11.791   2.179
  259   1HE   LYS  23          2HE       LYS  23   1.552 -11.834   4.672
  260   2HE   LYS  23          3HE       LYS  23   0.008 -11.005   4.929
  261   1HZ   LYS  23          2HZ       LYS  23   0.284 -13.624   3.608
  262   2HZ   LYS  23          3HZ       LYS  23  -0.102 -13.413   5.190
  263   3HZ   LYS  23          1HZ       LYS  23  -1.124 -12.876   4.019
  264    QB   LYS  23           QB       LYS  23   1.093  -8.679   1.346
  265    QG   LYS  23           QG       LYS  23   1.749  -9.558   3.423
  266    QD   LYS  23           QD       LYS  23   0.378 -11.324   2.338
  267    QE   LYS  23           QE       LYS  23   0.780 -11.420   4.801
  268    QZ   LYS  23           QZ       LYS  23  -0.314 -13.304   4.272
  269    H    VAL  24           HN       VAL  24   3.378  -7.375  -0.246
  270    HA   VAL  24           HA       VAL  24   1.993  -7.241  -2.787
  271    HB   VAL  24           HB       VAL  24   4.305  -5.666  -1.613
  272   1HG1  VAL  24          1HG1      VAL  24   2.475  -4.994  -3.964
  273   2HG1  VAL  24          2HG1      VAL  24   3.647  -3.879  -3.224
  274   3HG1  VAL  24          3HG1      VAL  24   4.213  -5.311  -4.085
  275   1HG2  VAL  24          2HG2      VAL  24   1.912  -5.626  -0.453
  276   2HG2  VAL  24          3HG2      VAL  24   2.814  -4.135  -0.782
  277   3HG2  VAL  24          1HG2      VAL  24   1.505  -4.640  -1.852
  278    QG1  VAL  24           QG1      VAL  24   3.445  -4.728  -3.758
  279    QG2  VAL  24           QG2      VAL  24   2.077  -4.800  -1.029
  280    QQG  VAL  24           QQG      VAL  24   2.761  -4.765  -2.393
  281    H    GLY  25           HN       GLY  25   5.122  -8.513  -1.725
  282   1HA   GLY  25          1HA       GLY  25   6.583  -9.870  -2.866
  283   2HA   GLY  25          2HA       GLY  25   5.609  -9.729  -4.340
  284    QA   GLY  25           QA       GLY  25   6.096  -9.799  -3.603
  285    H    THR  26           HN       THR  26   6.968  -7.138  -2.296
  286    HA   THR  26           HA       THR  26   9.054  -6.522  -4.309
  287    HB   THR  26           HB       THR  26   7.156  -5.075  -4.910
  288    HG1  THR  26          1HG       THR  26   9.170  -4.202  -5.209
  289   1HG2  THR  26          2HG2      THR  26   6.070  -4.932  -2.701
  290   2HG2  THR  26          3HG2      THR  26   7.396  -3.935  -2.102
  291   3HG2  THR  26          1HG2      THR  26   6.350  -3.331  -3.405
  292    QG2  THR  26           QG2      THR  26   6.606  -4.066  -2.736
  293    H    THR  27           HN       THR  27   9.731  -4.119  -2.837
  294    HA   THR  27           HA       THR  27  10.895  -5.306  -0.349
  295    HB   THR  27           HB       THR  27  12.735  -3.534  -0.988
  296    HG1  THR  27          1HG       THR  27  12.810  -3.095  -3.162
  297   1HG2  THR  27          2HG2      THR  27  13.030  -6.030  -1.094
  298   2HG2  THR  27          3HG2      THR  27  12.323  -6.018  -2.725
  299   3HG2  THR  27          1HG2      THR  27  13.868  -5.196  -2.421
  300    QG2  THR  27           QG2      THR  27  13.073  -5.748  -2.080
  301    H    GLN  28           HN       GLN  28  10.992  -3.995   1.447
  302    HA   GLN  28           HA       GLN  28   8.856  -2.402   2.027
  303   1HB   GLN  28          2HB       GLN  28  10.697  -3.428   3.574
  304   2HB   GLN  28          3HB       GLN  28  11.539  -1.878   3.346
  305   1HG   GLN  28          2HG       GLN  28   9.430  -0.726   4.113
  306   2HG   GLN  28          3HG       GLN  28   8.702  -2.326   4.343
  307   1HE2  GLN  28          2HE2      GLN  28  11.663  -1.079   6.967
  308   2HE2  GLN  28          1HE2      GLN  28  11.713  -0.555   5.295
  309    QB   GLN  28           QB       GLN  28  11.118  -2.653   3.460
  310    QG   GLN  28           QG       GLN  28   9.065  -1.527   4.228
  311    QE2  GLN  28           QE2      GLN  28  11.689  -0.817   6.131
  312    H    GLN  29           HN       GLN  29  11.956  -1.312   0.749
  313    HA   GLN  29           HA       GLN  29  11.814   1.412   0.795
  314   1HB   GLN  29          2HB       GLN  29  13.219   1.395  -1.118
  315   2HB   GLN  29          3HB       GLN  29  13.591  -0.069  -0.196
  316   1HG   GLN  29          2HG       GLN  29  12.063  -1.309  -1.789
  317   2HG   GLN  29          3HG       GLN  29  12.010   0.148  -2.798
  318   1HE2  GLN  29          2HE2      GLN  29  15.462  -0.032  -3.777
  319   2HE2  GLN  29          1HE2      GLN  29  14.286   1.152  -3.215
  320    QB   GLN  29           QB       GLN  29  13.404   0.663  -0.657
  321    QG   GLN  29           QG       GLN  29  12.037  -0.580  -2.293
  322    QE2  GLN  29           QE2      GLN  29  14.875   0.560  -3.497
  323    H    SER  30           HN       SER  30  10.131  -0.719  -1.521
  324    HA   SER  30           HA       SER  30   9.167   1.316  -3.235
  325   1HB   SER  30          2HB       SER  30   8.005  -1.448  -2.709
  326   2HB   SER  30          3HB       SER  30   7.743  -0.466  -4.157
  327    HG   SER  30           HG       SER  30   9.459  -2.179  -4.127
  328    QB   SER  30           QB       SER  30   7.873  -0.957  -3.433
  329    H    ILE  31           HN       ILE  31   7.715  -0.376  -0.422
  330    HA   ILE  31           HA       ILE  31   5.203   0.962  -0.540
  331    HB   ILE  31           HB       ILE  31   6.692  -0.491   1.691
  332   1HG1  ILE  31          2HG1      ILE  31   5.162  -2.236   1.294
  333   2HG1  ILE  31          3HG1      ILE  31   4.236  -1.261   0.101
  334   1HG2  ILE  31          2HG2      ILE  31   4.125   1.080   1.644
  335   2HG2  ILE  31          3HG2      ILE  31   4.128  -0.444   2.515
  336   3HG2  ILE  31          1HG2      ILE  31   5.279   0.816   2.966
  337   1HD1  ILE  31          1HD1      ILE  31   7.029  -2.377  -0.264
  338   2HD1  ILE  31          2HD1      ILE  31   5.523  -3.124  -0.835
  339   3HD1  ILE  31          3HD1      ILE  31   6.009  -1.594  -1.518
  340    QG1  ILE  31           QG1      ILE  31   4.699  -1.749   0.697
  341    QG2  ILE  31           QG2      ILE  31   4.511   0.484   2.375
  342    QD1  ILE  31           QD1      ILE  31   6.187  -2.365  -0.873
  343    H    GLU  32           HN       GLU  32   8.130   1.458   1.505
  344    HA   GLU  32           HA       GLU  32   7.377   3.737   2.849
  345   1HB   GLU  32          2HB       GLU  32   9.490   2.408   3.123
  346   2HB   GLU  32          3HB       GLU  32  10.156   3.264   1.723
  347   1HG   GLU  32          2HG       GLU  32  10.937   4.335   3.750
  348   2HG   GLU  32          3HG       GLU  32   9.798   5.441   2.962
  349    QB   GLU  32           QB       GLU  32   9.823   2.835   2.423
  350    QG   GLU  32           QG       GLU  32  10.367   4.888   3.356
  351    H    GLN  33           HN       GLN  33   8.880   3.555  -0.376
  352    HA   GLN  33           HA       GLN  33   8.946   6.231  -1.159
  353   1HB   GLN  33          2HB       GLN  33   9.901   5.032  -2.776
  354   2HB   GLN  33          3HB       GLN  33   8.938   3.609  -2.500
  355   1HG   GLN  33          2HG       GLN  33   7.190   4.271  -3.929
  356   2HG   GLN  33          3HG       GLN  33   7.743   5.949  -3.993
  357   1HE2  GLN  33          2HE2      GLN  33   9.822   3.112  -6.169
  358   2HE2  GLN  33          1HE2      GLN  33   8.920   2.618  -4.753
  359    QB   GLN  33           QB       GLN  33   9.419   4.321  -2.638
  360    QG   GLN  33           QG       GLN  33   7.466   5.110  -3.961
  361    QE2  GLN  33           QE2      GLN  33   9.371   2.865  -5.461
  362    H    LEU  34           HN       LEU  34   6.232   3.919  -1.527
  363    HA   LEU  34           HA       LEU  34   4.541   6.002  -2.578
  364   1HB   LEU  34          2HB       LEU  34   4.481   3.509  -3.105
  365   2HB   LEU  34          3HB       LEU  34   3.720   3.275  -1.521
  366    HG   LEU  34           HG       LEU  34   1.907   4.860  -2.293
  367   1HD1  LEU  34          2HD1      LEU  34   3.628   5.526  -4.374
  368   2HD1  LEU  34          3HD1      LEU  34   2.515   4.444  -5.161
  369   3HD1  LEU  34          1HD1      LEU  34   1.887   5.863  -4.346
  370   1HD2  LEU  34          2HD2      LEU  34   1.747   2.336  -2.384
  371   2HD2  LEU  34          3HD2      LEU  34   0.767   3.137  -3.620
  372   3HD2  LEU  34          1HD2      LEU  34   2.322   2.396  -4.058
  373    QB   LEU  34           QB       LEU  34   4.101   3.392  -2.313
  374    QD1  LEU  34           QD1      LEU  34   2.676   5.278  -4.627
  375    QD2  LEU  34           QD2      LEU  34   1.612   2.622  -3.354
  376    QQD  LEU  34           QQD      LEU  34   2.144   3.950  -3.990
  377    H    GLU  35           HN       GLU  35   5.108   4.764   0.654
  378    HA   GLU  35           HA       GLU  35   2.954   6.068   1.959
  379   1HB   GLU  35          2HB       GLU  35   5.641   5.026   2.848
  380   2HB   GLU  35          3HB       GLU  35   4.864   6.206   3.851
  381   1HG   GLU  35          2HG       GLU  35   2.799   4.374   3.480
  382   2HG   GLU  35          3HG       GLU  35   4.231   3.343   3.465
  383    QB   GLU  35           QB       GLU  35   5.253   5.616   3.349
  384    QG   GLU  35           QG       GLU  35   3.514   3.859   3.473
  385    H    ASN  36           HN       ASN  36   6.264   7.217   1.053
  386    HA   ASN  36           HA       ASN  36   5.606   9.864   2.076
  387   1HB   ASN  36          2HB       ASN  36   7.660  10.633   1.359
  388   2HB   ASN  36          3HB       ASN  36   7.899   9.008   2.005
  389   1HD2  ASN  36          2HD2      ASN  36   9.785   8.247  -0.865
  390   2HD2  ASN  36          1HD2      ASN  36   9.541   8.083   0.864
  391    QB   ASN  36           QB       ASN  36   7.780   9.820   1.683
  392    QD2  ASN  36           QD2      ASN  36   9.663   8.164  -0.001
  393    H    GLY  37           HN       GLY  37   4.530   8.268  -0.694
  394   1HA   GLY  37          1HA       GLY  37   3.202   8.927  -2.398
  395   2HA   GLY  37          2HA       GLY  37   2.954  10.444  -1.517
  396    QA   GLY  37           QA       GLY  37   3.078   9.685  -1.958
  397    H    LYS  38           HN       LYS  38   6.078   9.298  -2.774
  398    HA   LYS  38           HA       LYS  38   6.472  11.688  -4.303
  399   1HB   LYS  38          2HB       LYS  38   8.540  10.614  -5.122
  400   2HB   LYS  38          3HB       LYS  38   8.371  10.661  -3.373
  401   1HG   LYS  38          2HG       LYS  38   7.612   8.279  -3.397
  402   2HG   LYS  38          3HG       LYS  38   7.859   8.209  -5.142
  403   1HD   LYS  38          2HD       LYS  38  10.007   8.960  -3.103
  404   2HD   LYS  38          3HD       LYS  38   9.700   7.301  -3.597
  405   1HE   LYS  38          2HE       LYS  38   9.968   8.851  -6.018
  406   2HE   LYS  38          3HE       LYS  38  11.278   9.346  -4.939
  407   1HZ   LYS  38          2HZ       LYS  38  11.847   6.986  -4.735
  408   2HZ   LYS  38          3HZ       LYS  38  10.632   6.598  -5.780
  409   3HZ   LYS  38          1HZ       LYS  38  11.911   7.489  -6.302
  410    QB   LYS  38           QB       LYS  38   8.455  10.638  -4.248
  411    QG   LYS  38           QG       LYS  38   7.735   8.243  -4.270
  412    QD   LYS  38           QD       LYS  38   9.853   8.131  -3.350
  413    QE   LYS  38           QE       LYS  38  10.623   9.098  -5.478
  414    QZ   LYS  38           QZ       LYS  38  11.464   7.024  -5.606
  415    H    THR  39           HN       THR  39   4.769   8.823  -5.230
  416    HA   THR  39           HA       THR  39   5.154   9.513  -8.117
  417    HB   THR  39           HB       THR  39   5.908   7.178  -7.221
  418    HG1  THR  39          1HG       THR  39   5.896   7.554  -9.361
  419   1HG2  THR  39          1HG2      THR  39   3.608   6.809  -6.114
  420   2HG2  THR  39          2HG2      THR  39   2.986   6.529  -7.745
  421   3HG2  THR  39          3HG2      THR  39   4.257   5.478  -7.101
  422    QG2  THR  39           QG2      THR  39   3.617   6.272  -6.987
  423    H    LYS  40           HN       LYS  40   3.328   9.401  -9.442
  424    HA   LYS  40           HA       LYS  40   0.832  10.284  -8.136
  425   1HB   LYS  40          2HB       LYS  40   0.085  10.491 -10.574
  426   2HB   LYS  40          3HB       LYS  40   1.277  11.629  -9.945
  427   1HG   LYS  40          2HG       LYS  40   3.053  10.709 -11.114
  428   2HG   LYS  40          3HG       LYS  40   2.248   9.174 -11.441
  429   1HD   LYS  40          2HD       LYS  40   0.917  11.668 -12.485
  430   2HD   LYS  40          3HD       LYS  40   2.458  11.261 -13.212
  431   1HE   LYS  40          2HE       LYS  40   0.803   8.840 -13.043
  432   2HE   LYS  40          3HE       LYS  40  -0.129  10.132 -13.786
  433   1HZ   LYS  40          3HZ       LYS  40   2.595   9.469 -14.675
  434   2HZ   LYS  40          1HZ       LYS  40   1.267   8.741 -15.303
  435   3HZ   LYS  40          2HZ       LYS  40   1.461  10.363 -15.462
  436    QB   LYS  40           QB       LYS  40   0.681  11.060 -10.259
  437    QG   LYS  40           QG       LYS  40   2.650   9.942 -11.277
  438    QD   LYS  40           QD       LYS  40   1.687  11.465 -12.849
  439    QE   LYS  40           QE       LYS  40   0.337   9.486 -13.414
  440    QZ   LYS  40           QZ       LYS  40   1.775   9.524 -15.147
  441    NH1  ARG  41           NH2      ARG  41  -1.123   5.889 -14.565
  442    NH2  ARG  41           NH1      ARG  41  -3.353   5.945 -15.189
  443    H    ARG  41           HN       ARG  41   2.013   7.465 -10.018
  444    HA   ARG  41           HA       ARG  41  -0.311   5.977  -9.070
  445   1HB   ARG  41          2HB       ARG  41  -0.733   6.990 -11.480
  446   2HB   ARG  41          3HB       ARG  41   0.367   5.698 -11.985
  447   1HG   ARG  41          2HG       ARG  41  -1.296   4.318 -10.295
  448   2HG   ARG  41          3HG       ARG  41  -2.415   5.564 -10.826
  449   1HD   ARG  41          2HD       ARG  41  -0.820   3.844 -12.807
  450   2HD   ARG  41          3HD       ARG  41  -2.236   3.238 -11.995
  451    HE   ARG  41           HE       ARG  41  -3.673   4.511 -13.159
  452   1HH1  ARG  41          2HH2      ARG  41  -0.420   5.564 -13.918
  453   2HH1  ARG  41          1HH2      ARG  41  -0.849   6.395 -15.391
  454   1HH2  ARG  41          2HH1      ARG  41  -4.312   5.662 -15.048
  455   2HH2  ARG  41          1HH1      ARG  41  -3.147   6.528 -15.988
  456    QB   ARG  41           QB       ARG  41  -0.183   6.344 -11.732
  457    QG   ARG  41           QG       ARG  41  -1.856   4.941 -10.559
  458    QD   ARG  41           QD       ARG  41  -1.528   3.541 -12.401
  459    QH1  ARG  41           QH2      ARG  41  -0.634   5.980 -14.654
  460    QH2  ARG  41           QH1      ARG  41  -3.729   6.095 -15.517
  461    HA   PRO  42           HA       PRO  42   3.458   3.367  -8.910
  462   1HB   PRO  42          2HB       PRO  42   2.530   1.436  -7.177
  463   2HB   PRO  42          3HB       PRO  42   3.082   3.026  -6.652
  464   1HG   PRO  42          2HG       PRO  42   0.316   1.974  -7.066
  465   2HG   PRO  42          3HG       PRO  42   0.826   3.108  -5.813
  466   1HD   PRO  42          2HD       PRO  42  -0.472   3.792  -8.217
  467   2HD   PRO  42          3HD       PRO  42   0.408   4.939  -7.177
  468    QB   PRO  42           QB       PRO  42   2.806   2.231  -6.914
  469    QG   PRO  42           QG       PRO  42   0.571   2.540  -6.440
  470    QD   PRO  42           QD       PRO  42  -0.032   4.365  -7.696
  471    NH1  ARG  43           NH2      ARG  43   5.868   0.139 -15.912
  472    NH2  ARG  43           NH1      ARG  43   7.787  -0.665 -14.888
  473    H    ARG  43           HN       ARG  43   3.734   0.934  -9.185
  474    HA   ARG  43           HA       ARG  43   1.988  -0.006 -11.380
  475   1HB   ARG  43          2HB       ARG  43   4.672   0.093 -11.304
  476   2HB   ARG  43          3HB       ARG  43   4.489  -1.424 -10.424
  477   1HG   ARG  43          2HG       ARG  43   4.352  -2.448 -12.452
  478   2HG   ARG  43          3HG       ARG  43   2.749  -1.742 -12.611
  479   1HD   ARG  43          2HD       ARG  43   3.856  -1.092 -14.560
  480   2HD   ARG  43          3HD       ARG  43   3.934   0.367 -13.549
  481    HE   ARG  43           HE       ARG  43   6.246  -1.040 -12.932
  482   1HH1  ARG  43          2HH2      ARG  43   4.884   0.357 -15.856
  483   2HH1  ARG  43          1HH2      ARG  43   6.364   0.343 -16.766
  484   1HH2  ARG  43          2HH1      ARG  43   8.249  -1.098 -14.100
  485   2HH2  ARG  43          1HH1      ARG  43   8.336  -0.477 -15.714
  486    QB   ARG  43           QB       ARG  43   4.579  -0.666 -10.865
  487    QG   ARG  43           QG       ARG  43   3.550  -2.096 -12.532
  488    QD   ARG  43           QD       ARG  43   3.895  -0.362 -14.055
  489    QH1  ARG  43           QH2      ARG  43   5.624   0.350 -16.312
  490    QH2  ARG  43           QH1      ARG  43   8.292  -0.787 -14.906
  491    H    PHE  44           HN       PHE  44   2.983  -0.762  -8.087
  492    HA   PHE  44           HA       PHE  44   1.643  -3.393  -8.124
  493   1HB   PHE  44          2HB       PHE  44   2.660  -3.630  -5.914
  494   2HB   PHE  44          3HB       PHE  44   3.840  -3.292  -7.156
  495    HD1  PHE  44          1HD       PHE  44   5.088  -1.133  -7.176
  496    HD2  PHE  44          2HD       PHE  44   2.170  -2.019  -4.142
  497    HE1  PHE  44          1HE       PHE  44   5.837   0.841  -5.867
  498    HE2  PHE  44          2HE       PHE  44   2.990  -0.120  -2.782
  499    HZ   PHE  44           HZ       PHE  44   4.834   1.309  -3.642
  500    QB   PHE  44           QB       PHE  44   3.250  -3.461  -6.535
  501    QR   PHE  44           QR       PHE  44   4.021  -0.608  -4.992
  502    H    LEU  45           HN       LEU  45   0.171  -0.664  -8.263
  503    HA   LEU  45           HA       LEU  45  -1.206  -0.357  -5.808
  504   1HB   LEU  45          2HB       LEU  45  -1.316   1.080  -8.116
  505   2HB   LEU  45          3HB       LEU  45  -2.673   0.023  -8.416
  506    HG   LEU  45           HG       LEU  45  -3.591   0.719  -6.141
  507   1HD1  LEU  45          1HD1      LEU  45  -1.500   1.836  -5.243
  508   2HD1  LEU  45          2HD1      LEU  45  -1.638   3.025  -6.553
  509   3HD1  LEU  45          3HD1      LEU  45  -2.832   2.993  -5.314
  510   1HD2  LEU  45          3HD2      LEU  45  -4.236   1.597  -8.537
  511   2HD2  LEU  45          1HD2      LEU  45  -4.831   2.429  -7.093
  512   3HD2  LEU  45          2HD2      LEU  45  -3.460   3.091  -8.006
  513    QB   LEU  45           QB       LEU  45  -1.994   0.552  -8.266
  514    QD1  LEU  45           QD1      LEU  45  -1.990   2.618  -5.703
  515    QD2  LEU  45           QD2      LEU  45  -4.175   2.372  -7.879
  516    QQD  LEU  45           QQD      LEU  45  -3.082   2.495  -6.791
  517    HA   PRO  46           HA       PRO  46  -4.455  -3.508  -7.244
  518   1HB   PRO  46          2HB       PRO  46  -3.792  -5.437  -9.107
  519   2HB   PRO  46          3HB       PRO  46  -4.621  -3.898  -9.459
  520   1HG   PRO  46          2HG       PRO  46  -1.773  -4.631  -9.964
  521   2HG   PRO  46          3HG       PRO  46  -2.819  -3.488 -10.847
  522   1HD   PRO  46          2HD       PRO  46  -0.861  -2.894  -8.940
  523   2HD   PRO  46          3HD       PRO  46  -2.082  -1.748  -9.546
  524    QB   PRO  46           QB       PRO  46  -4.206  -4.668  -9.284
  525    QG   PRO  46           QG       PRO  46  -2.296  -4.060 -10.406
  526    QD   PRO  46           QD       PRO  46  -1.472  -2.321  -9.243
  527    H    GLU  47           HN       GLU  47  -1.086  -4.759  -7.502
  528    HA   GLU  47           HA       GLU  47  -1.382  -7.154  -6.083
  529   1HB   GLU  47          2HB       GLU  47   0.944  -5.195  -6.116
  530   2HB   GLU  47          3HB       GLU  47   1.033  -6.868  -5.568
  531   1HG   GLU  47          2HG       GLU  47  -0.143  -6.623  -8.297
  532   2HG   GLU  47          3HG       GLU  47   1.501  -5.981  -8.171
  533    QB   GLU  47           QB       GLU  47   0.988  -6.031  -5.842
  534    QG   GLU  47           QG       GLU  47   0.679  -6.302  -8.234
  535    H    LEU  48           HN       LEU  48  -0.610  -3.846  -4.825
  536    HA   LEU  48           HA       LEU  48  -0.605  -4.679  -2.080
  537   1HB   LEU  48          2HB       LEU  48   0.599  -2.775  -2.924
  538   2HB   LEU  48          3HB       LEU  48  -0.871  -1.985  -3.436
  539    HG   LEU  48           HG       LEU  48  -1.220  -2.603  -0.651
  540   1HD1  LEU  48          2HD1      LEU  48   1.618  -2.215  -1.161
  541   2HD1  LEU  48          3HD1      LEU  48   0.991  -0.894  -0.202
  542   3HD1  LEU  48          1HD1      LEU  48   0.731  -2.566   0.321
  543   1HD2  LEU  48          1HD2      LEU  48  -1.979  -0.667  -2.191
  544   2HD2  LEU  48          2HD2      LEU  48  -1.774  -0.387  -0.489
  545   3HD2  LEU  48          3HD2      LEU  48  -0.512   0.150  -1.644
  546    QB   LEU  48           QB       LEU  48  -0.136  -2.380  -3.180
  547    QD1  LEU  48           QD1      LEU  48   1.113  -1.892  -0.348
  548    QD2  LEU  48           QD2      LEU  48  -1.422  -0.301  -1.441
  549    QQD  LEU  48           QQD      LEU  48  -0.154  -1.097  -0.894
  550    H    ALA  49           HN       ALA  49  -3.127  -3.184  -4.152
  551    HA   ALA  49           HA       ALA  49  -5.139  -2.919  -2.242
  552   1HB   ALA  49          2HB       ALA  49  -5.300  -3.690  -5.172
  553   2HB   ALA  49          3HB       ALA  49  -6.721  -3.360  -4.184
  554   3HB   ALA  49          1HB       ALA  49  -5.536  -2.090  -4.457
  555    QB   ALA  49           QB       ALA  49  -5.852  -3.047  -4.604
  556    H    SER  50           HN       SER  50  -4.320  -5.817  -4.203
  557    HA   SER  50           HA       SER  50  -6.321  -7.461  -2.989
  558   1HB   SER  50          2HB       SER  50  -5.292  -9.292  -4.149
  559   2HB   SER  50          3HB       SER  50  -5.318  -7.877  -5.216
  560    HG   SER  50           HG       SER  50  -3.058  -7.554  -4.473
  561    QB   SER  50           QB       SER  50  -5.305  -8.585  -4.683
  562    H    ALA  51           HN       ALA  51  -2.822  -7.097  -2.346
  563    HA   ALA  51           HA       ALA  51  -2.465  -9.039  -0.387
  564   1HB   ALA  51          1HB       ALA  51  -1.181  -6.294  -0.665
  565   2HB   ALA  51          2HB       ALA  51  -0.575  -7.569   0.375
  566   3HB   ALA  51          3HB       ALA  51  -0.606  -7.812  -1.386
  567    QB   ALA  51           QB       ALA  51  -0.787  -7.225  -0.558
  568    H    LEU  52           HN       LEU  52  -3.457  -5.618   0.056
  569    HA   LEU  52           HA       LEU  52  -3.831  -5.929   2.946
  570   1HB   LEU  52          2HB       LEU  52  -4.522  -3.783   0.895
  571   2HB   LEU  52          3HB       LEU  52  -4.986  -3.644   2.591
  572    HG   LEU  52           HG       LEU  52  -2.126  -4.035   1.653
  573   1HD1  LEU  52          2HD1      LEU  52  -3.170  -1.853   0.935
  574   2HD1  LEU  52          3HD1      LEU  52  -3.371  -1.443   2.641
  575   3HD1  LEU  52          1HD1      LEU  52  -1.752  -1.699   1.978
  576   1HD2  LEU  52          1HD2      LEU  52  -3.492  -3.870   4.333
  577   2HD2  LEU  52          2HD2      LEU  52  -2.058  -4.755   3.852
  578   3HD2  LEU  52          3HD2      LEU  52  -1.960  -3.005   4.175
  579    QB   LEU  52           QB       LEU  52  -4.754  -3.714   1.743
  580    QD1  LEU  52           QD1      LEU  52  -2.764  -1.665   1.851
  581    QD2  LEU  52           QD2      LEU  52  -2.504  -3.876   4.120
  582    QQD  LEU  52           QQD      LEU  52  -2.634  -2.770   2.985
  583    H    GLY  53           HN       GLY  53  -5.884  -5.910   0.049
  584   1HA   GLY  53          1HA       GLY  53  -7.981  -6.887  -0.213
  585   2HA   GLY  53          2HA       GLY  53  -8.177  -7.053   1.542
  586    QA   GLY  53           QA       GLY  53  -8.079  -6.970   0.665
  587    H    VAL  54           HN       VAL  54  -7.648  -4.552  -0.964
  588    HA   VAL  54           HA       VAL  54 -10.016  -3.057  -0.094
  589    HB   VAL  54           HB       VAL  54  -8.867  -0.878  -0.216
  590   1HG1  VAL  54          2HG1      VAL  54  -9.179  -1.985   1.979
  591   2HG1  VAL  54          3HG1      VAL  54  -7.545  -2.670   1.807
  592   3HG1  VAL  54          1HG1      VAL  54  -7.770  -0.909   1.923
  593   1HG2  VAL  54          2HG2      VAL  54  -6.327  -2.545  -0.418
  594   2HG2  VAL  54          3HG2      VAL  54  -6.956  -1.408  -1.644
  595   3HG2  VAL  54          1HG2      VAL  54  -6.355  -0.822  -0.088
  596    QG1  VAL  54           QG1      VAL  54  -8.165  -1.855   1.903
  597    QG2  VAL  54           QG2      VAL  54  -6.546  -1.592  -0.716
  598    QQG  VAL  54           QQG      VAL  54  -7.355  -1.723   0.593
  599    H    SER  55           HN       SER  55 -10.335  -1.203  -1.793
  600    HA   SER  55           HA       SER  55 -10.350  -2.480  -4.400
  601   1HB   SER  55          2HB       SER  55 -11.974  -0.318  -4.524
  602   2HB   SER  55          3HB       SER  55 -12.446  -1.865  -3.799
  603    HG   SER  55           HG       SER  55 -12.912  -0.091  -2.460
  604    QB   SER  55           QB       SER  55 -12.209  -1.091  -4.161
  605    H    VAL  56           HN       VAL  56  -9.530  -1.565  -6.267
  606    HA   VAL  56           HA       VAL  56  -7.153   0.005  -5.994
  607    HB   VAL  56           HB       VAL  56  -8.827  -0.843  -8.388
  608   1HG1  VAL  56          3HG1      VAL  56  -6.106   0.489  -8.296
  609   2HG1  VAL  56          1HG1      VAL  56  -6.819  -0.246  -9.753
  610   3HG1  VAL  56          2HG1      VAL  56  -7.569   1.180  -9.024
  611   1HG2  VAL  56          2HG2      VAL  56  -7.346  -2.483  -6.812
  612   2HG2  VAL  56          3HG2      VAL  56  -7.417  -2.676  -8.570
  613   3HG2  VAL  56          1HG2      VAL  56  -6.044  -1.843  -7.820
  614    QG1  VAL  56           QG1      VAL  56  -6.831   0.475  -9.025
  615    QG2  VAL  56           QG2      VAL  56  -6.936  -2.333  -7.734
  616    QQG  VAL  56           QQG      VAL  56  -6.884  -0.930  -8.379
  617    H    ASP  57           HN       ASP  57 -10.466   0.810  -7.116
  618    HA   ASP  57           HA       ASP  57 -10.114   3.538  -7.771
  619   1HB   ASP  57          2HB       ASP  57 -12.555   3.634  -6.985
  620   2HB   ASP  57          3HB       ASP  57 -12.176   2.499  -8.289
  621    QB   ASP  57           QB       ASP  57 -12.366   3.066  -7.637
  622    CH2  TRP  58           CH2      TRP  58  -7.020   2.378   1.987
  623    H    TRP  58           HN       TRP  58 -10.582   1.907  -4.605
  624    HA   TRP  58           HA       TRP  58 -10.681   4.430  -3.144
  625   1HB   TRP  58          2HB       TRP  58 -11.704   2.498  -2.164
  626   2HB   TRP  58          3HB       TRP  58 -10.192   1.597  -2.219
  627    HD1  TRP  58           HD1      TRP  58 -11.941   4.290  -0.172
  628    HE1  TRP  58           HE1      TRP  58 -10.674   4.633   2.026
  629    HE3  TRP  58           HE3      TRP  58  -7.853   1.409  -1.174
  630    HZ2  TRP  58           HZ2      TRP  58  -8.095   3.803   3.178
  631    HZ3  TRP  58           HZ3      TRP  58  -5.998   1.247   0.486
  632    HH2  TRP  58           HH2      TRP  58  -6.176   2.312   2.656
  633    QB   TRP  58           QB       TRP  58 -10.949   2.047  -2.192
  634    H    LEU  59           HN       LEU  59  -8.104   2.130  -4.103
  635    HA   LEU  59           HA       LEU  59  -6.081   3.733  -2.808
  636   1HB   LEU  59          2HB       LEU  59  -6.132   1.446  -4.728
  637   2HB   LEU  59          3HB       LEU  59  -4.695   2.406  -4.701
  638    HG   LEU  59           HG       LEU  59  -5.912   0.877  -2.396
  639   1HD1  LEU  59          1HD1      LEU  59  -4.551  -0.219  -4.302
  640   2HD1  LEU  59          2HD1      LEU  59  -3.154   0.601  -3.608
  641   3HD1  LEU  59          3HD1      LEU  59  -4.086  -0.573  -2.630
  642   1HD2  LEU  59          1HD2      LEU  59  -3.544   2.800  -2.407
  643   2HD2  LEU  59          2HD2      LEU  59  -4.915   2.782  -1.274
  644   3HD2  LEU  59          3HD2      LEU  59  -3.703   1.509  -1.202
  645    QB   LEU  59           QB       LEU  59  -5.413   1.926  -4.715
  646    QD1  LEU  59           QD1      LEU  59  -3.931  -0.063  -3.514
  647    QD2  LEU  59           QD2      LEU  59  -4.053   2.363  -1.628
  648    QQD  LEU  59           QQD      LEU  59  -3.992   1.150  -2.570
  649    H    LEU  60           HN       LEU  60  -7.811   4.322  -5.745
  650    HA   LEU  60           HA       LEU  60  -5.802   6.285  -6.683
  651   1HB   LEU  60          2HB       LEU  60  -8.510   5.467  -7.763
  652   2HB   LEU  60          3HB       LEU  60  -7.479   6.691  -8.504
  653    HG   LEU  60           HG       LEU  60  -6.514   3.846  -8.042
  654   1HD1  LEU  60          3HD1      LEU  60  -7.917   5.004 -10.480
  655   2HD1  LEU  60          1HD1      LEU  60  -7.106   3.423 -10.416
  656   3HD1  LEU  60          2HD1      LEU  60  -8.530   3.726  -9.417
  657   1HD2  LEU  60          3HD2      LEU  60  -4.764   5.612  -8.530
  658   2HD2  LEU  60          1HD2      LEU  60  -4.882   4.356  -9.764
  659   3HD2  LEU  60          2HD2      LEU  60  -5.608   5.947 -10.053
  660    QB   LEU  60           QB       LEU  60  -7.994   6.080  -8.134
  661    QD1  LEU  60           QD1      LEU  60  -7.851   4.051 -10.105
  662    QD2  LEU  60           QD2      LEU  60  -5.084   5.305  -9.449
  663    QQD  LEU  60           QQD      LEU  60  -6.468   4.678  -9.777
  664    H    ASN  61           HN       ASN  61  -9.284   6.450  -5.788
  665    HA   ASN  61           HA       ASN  61  -9.035   9.318  -5.170
  666   1HB   ASN  61          2HB       ASN  61 -11.392   9.232  -4.518
  667   2HB   ASN  61          3HB       ASN  61 -11.077   8.816  -6.202
  668   1HD2  ASN  61          2HD2      ASN  61 -12.658   5.676  -5.945
  669   2HD2  ASN  61          1HD2      ASN  61 -11.948   6.901  -6.980
  670    QB   ASN  61           QB       ASN  61 -11.234   9.024  -5.359
  671    QD2  ASN  61           QD2      ASN  61 -12.303   6.289  -6.462
  672    H    GLY  62           HN       GLY  62 -10.025   6.413  -3.165
  673   1HA   GLY  62          1HA       GLY  62  -9.566   6.012  -0.943
  674   2HA   GLY  62          2HA       GLY  62  -8.288   7.215  -1.063
  675    QA   GLY  62           QA       GLY  62  -8.928   6.614  -1.003
  676    H    THR  63           HN       THR  63 -11.419   6.510   0.025
  677    HA   THR  63           HA       THR  63 -12.804   7.517   1.493
  678    HB   THR  63           HB       THR  63 -11.906   9.070   3.085
  679    HG1  THR  63          1HG       THR  63 -10.255   9.849   1.357
  680   1HG2  THR  63          3HG2      THR  63 -11.471   6.618   3.382
  681   2HG2  THR  63          1HG2      THR  63  -9.977   6.767   2.422
  682   3HG2  THR  63          2HG2      THR  63 -10.084   7.556   3.990
  683    QG2  THR  63           QG2      THR  63 -10.511   6.980   3.265
  684    H    SER  64           HN       SER  64 -14.173   8.204  -0.071
  685    HA   SER  64           HA       SER  64 -14.089  11.050  -0.913
  686   1HB   SER  64          2HB       SER  64 -13.507   9.232  -2.717
  687   2HB   SER  64          3HB       SER  64 -15.231   8.816  -2.630
  688    HG   SER  64           HG       SER  64 -14.307  11.475  -3.054
  689    QB   SER  64           QB       SER  64 -14.369   9.024  -2.673
  690    H    ASP  65           HN       ASP  65 -16.029  12.053  -0.595
  691    HA   ASP  65           HA       ASP  65 -17.870  12.508   0.621
  692   1HB   ASP  65          2HB       ASP  65 -19.916  11.672  -0.441
  693   2HB   ASP  65          3HB       ASP  65 -18.720  12.375  -1.535
  694    QB   ASP  65           QB       ASP  65 -19.318  12.023  -0.988
  695    H    SER  66           HN       SER  66 -17.381  11.957   2.631
  696    HA   SER  66           HA       SER  66 -17.762  11.116   4.686
  697   1HB   SER  66          2HB       SER  66 -19.626   9.005   3.508
  698   2HB   SER  66          3HB       SER  66 -19.480   9.493   5.191
  699    HG   SER  66           HG       SER  66 -20.087  11.670   4.407
  700    QB   SER  66           QB       SER  66 -19.553   9.249   4.350
  701    H    ASN  67           HN       ASN  67 -17.151   9.172   6.002
  702    HA   ASN  67           HA       ASN  67 -15.929   7.372   6.511
  703   1HB   ASN  67          2HB       ASN  67 -17.268   6.544   4.334
  704   2HB   ASN  67          3HB       ASN  67 -15.644   6.414   3.662
  705   1HD2  ASN  67          2HD2      ASN  67 -16.939   3.376   5.747
  706   2HD2  ASN  67          1HD2      ASN  67 -17.847   4.471   4.715
  707    QB   ASN  67           QB       ASN  67 -16.456   6.479   3.998
  708    QD2  ASN  67           QD2      ASN  67 -17.393   3.924   5.230
  709    H    VAL  68           HN       VAL  68 -13.896   8.068   7.246
  710    HA   VAL  68           HA       VAL  68 -11.752   8.314   5.281
  711    HB   VAL  68           HB       VAL  68 -12.806  10.496   5.218
  712   1HG1  VAL  68          1HG1      VAL  68 -13.498  10.475   7.734
  713   2HG1  VAL  68          2HG1      VAL  68 -11.865  11.107   8.020
  714   3HG1  VAL  68          3HG1      VAL  68 -12.984  11.998   6.983
  715   1HG2  VAL  68          2HG2      VAL  68 -10.418  10.298   4.743
  716   2HG2  VAL  68          3HG2      VAL  68 -10.770  11.834   5.546
  717   3HG2  VAL  68          1HG2      VAL  68 -10.028  10.507   6.458
  718    QG1  VAL  68           QG1      VAL  68 -12.783  11.193   7.579
  719    QG2  VAL  68           QG2      VAL  68 -10.405  10.880   5.582
  720    QQG  VAL  68           QQG      VAL  68 -11.594  11.036   6.581
  721    NH1  ARG  69           NH2      ARG  69  -8.014  10.084  10.457
  722    NH2  ARG  69           NH1      ARG  69  -8.026   9.280  12.626
  723    H    ARG  69           HN       ARG  69 -10.576   6.728   6.102
  724    HA   ARG  69           HA       ARG  69  -9.008   5.733   7.355
  725   1HB   ARG  69          2HB       ARG  69  -8.145   8.167   7.484
  726   2HB   ARG  69          3HB       ARG  69  -8.896   8.186   9.089
  727   1HG   ARG  69          2HG       ARG  69  -7.449   6.071   9.581
  728   2HG   ARG  69          3HG       ARG  69  -6.625   6.443   8.069
  729   1HD   ARG  69          2HD       ARG  69  -5.309   7.396   9.773
  730   2HD   ARG  69          3HD       ARG  69  -6.120   8.771   9.047
  731    HE   ARG  69           HE       ARG  69  -6.581   7.473  11.696
  732   1HH1  ARG  69          2HH2      ARG  69  -7.772   9.942   9.489
  733   2HH1  ARG  69          1HH2      ARG  69  -8.677  10.807  10.687
  734   1HH2  ARG  69          2HH1      ARG  69  -7.762   8.583  13.306
  735   2HH2  ARG  69          1HH1      ARG  69  -8.651  10.017  12.914
  736    QB   ARG  69           QB       ARG  69  -8.521   8.177   8.286
  737    QG   ARG  69           QG       ARG  69  -7.037   6.257   8.825
  738    QD   ARG  69           QD       ARG  69  -5.714   8.084   9.410
  739    QH1  ARG  69           QH2      ARG  69  -8.224  10.375  10.088
  740    QH2  ARG  69           QH1      ARG  69  -8.206   9.300  13.110
   
  Start of MODEL          16
 Raw file had 740 H/Q atoms
  Start of MODEL   16
    1    H    SER   1           HN       SER   1  -4.772  10.484   2.591
    2    HA   SER   1           HA       SER   1  -3.078  11.206   0.881
    3   1HB   SER   1          2HB       SER   1  -1.318  11.989   2.330
    4   2HB   SER   1          3HB       SER   1  -1.269  10.455   3.209
    5    HG   SER   1           HG       SER   1   0.404  10.409   1.799
    6    QB   SER   1           QB       SER   1  -1.293  11.222   2.770
    7    H    ILE   2           HN       ILE   2  -1.436   9.278   0.045
    8    HA   ILE   2           HA       ILE   2  -3.107   6.846  -0.175
    9    HB   ILE   2           HB       ILE   2  -0.245   7.337  -1.071
   10   1HG1  ILE   2          2HG1      ILE   2  -2.109   7.092  -3.261
   11   2HG1  ILE   2          3HG1      ILE   2  -2.789   8.285  -2.161
   12   1HG2  ILE   2          2HG2      ILE   2  -2.221   5.096  -1.667
   13   2HG2  ILE   2          3HG2      ILE   2  -0.702   5.356  -2.539
   14   3HG2  ILE   2          1HG2      ILE   2  -0.668   4.962  -0.823
   15   1HD1  ILE   2          1HD1      ILE   2  -0.614   9.520  -2.164
   16   2HD1  ILE   2          2HD1      ILE   2   0.057   8.311  -3.283
   17   3HD1  ILE   2          3HD1      ILE   2  -1.284   9.353  -3.799
   18    QG1  ILE   2           QG1      ILE   2  -2.448   7.689  -2.711
   19    QG2  ILE   2           QG2      ILE   2  -1.197   5.138  -1.676
   20    QD1  ILE   2           QD1      ILE   2  -0.614   9.062  -3.082
   21    H    SER   3           HN       SER   3  -0.168   8.058   1.444
   22    HA   SER   3           HA       SER   3   0.612   5.715   2.695
   23   1HB   SER   3          2HB       SER   3   1.714   7.296   4.350
   24   2HB   SER   3          3HB       SER   3   1.984   7.756   2.670
   25    HG   SER   3           HG       SER   3   0.962   9.263   4.516
   26    QB   SER   3           QB       SER   3   1.848   7.526   3.510
   27    H    SER   4           HN       SER   4  -1.423   8.308   4.032
   28    HA   SER   4           HA       SER   4  -1.932   7.077   6.473
   29   1HB   SER   4          2HB       SER   4  -3.848   8.548   6.753
   30   2HB   SER   4          3HB       SER   4  -2.443   9.400   6.093
   31    HG   SER   4           HG       SER   4  -4.843   8.637   4.828
   32    QB   SER   4           QB       SER   4  -3.146   8.974   6.423
   33    NH1  ARG   5           NH2      ARG   5  -6.054   9.302   0.495
   34    NH2  ARG   5           NH1      ARG   5  -8.136   9.537  -0.432
   35    H    ARG   5           HN       ARG   5  -3.881   6.737   3.479
   36    HA   ARG   5           HA       ARG   5  -5.850   4.913   4.431
   37   1HB   ARG   5          2HB       ARG   5  -4.528   4.934   1.696
   38   2HB   ARG   5          3HB       ARG   5  -6.005   4.195   2.069
   39   1HG   ARG   5          2HG       ARG   5  -7.269   6.083   2.293
   40   2HG   ARG   5          3HG       ARG   5  -5.877   7.158   2.446
   41   1HD   ARG   5          2HD       ARG   5  -5.254   6.711   0.063
   42   2HD   ARG   5          3HD       ARG   5  -6.477   5.471  -0.043
   43    HE   ARG   5           HE       ARG   5  -7.909   7.001  -0.732
   44   1HH1  ARG   5          2HH2      ARG   5  -5.337   8.686   0.877
   45   2HH1  ARG   5          1HH2      ARG   5  -5.898  10.290   0.383
   46   1HH2  ARG   5          2HH1      ARG   5  -9.023   9.148  -0.714
   47   2HH2  ARG   5          1HH1      ARG   5  -8.050  10.543  -0.423
   48    QB   ARG   5           QB       ARG   5  -5.266   4.565   1.883
   49    QG   ARG   5           QG       ARG   5  -6.573   6.621   2.370
   50    QD   ARG   5           QD       ARG   5  -5.865   6.091   0.010
   51    QH1  ARG   5           QH2      ARG   5  -5.618   9.488   0.630
   52    QH2  ARG   5           QH1      ARG   5  -8.536   9.845  -0.569
   53    H    VAL   6           HN       VAL   6  -2.726   4.190   2.765
   54    HA   VAL   6           HA       VAL   6  -2.917   1.389   2.964
   55    HB   VAL   6           HB       VAL   6  -0.591   3.315   2.712
   56   1HG1  VAL   6          1HG1      VAL   6  -0.308   0.504   3.313
   57   2HG1  VAL   6          2HG1      VAL   6   0.195   0.795   1.643
   58   3HG1  VAL   6          3HG1      VAL   6   0.913   1.746   2.929
   59   1HG2  VAL   6          3HG2      VAL   6  -2.267   3.175   0.825
   60   2HG2  VAL   6          1HG2      VAL   6  -0.636   2.668   0.366
   61   3HG2  VAL   6          2HG2      VAL   6  -1.891   1.455   0.681
   62    QG1  VAL   6           QG1      VAL   6   0.267   1.015   2.628
   63    QG2  VAL   6           QG2      VAL   6  -1.598   2.433   0.624
   64    QQG  VAL   6           QQG      VAL   6  -0.666   1.724   1.626
   65    H    LYS   7           HN       LYS   7  -1.464   3.726   5.230
   66    HA   LYS   7           HA       LYS   7  -0.355   1.774   6.961
   67   1HB   LYS   7          2HB       LYS   7   0.278   4.198   6.582
   68   2HB   LYS   7          3HB       LYS   7  -1.017   4.662   7.673
   69   1HG   LYS   7          2HG       LYS   7   0.941   2.587   8.639
   70   2HG   LYS   7          3HG       LYS   7   1.610   4.184   8.299
   71   1HD   LYS   7          2HD       LYS   7  -0.070   5.258   9.760
   72   2HD   LYS   7          3HD       LYS   7  -0.715   3.684  10.208
   73   1HE   LYS   7          2HE       LYS   7   2.120   4.750  10.715
   74   2HE   LYS   7          3HE       LYS   7   0.840   4.587  11.920
   75   1HZ   LYS   7          1HZ       LYS   7   1.183   2.102  10.768
   76   2HZ   LYS   7          2HZ       LYS   7   2.693   2.674  11.097
   77   3HZ   LYS   7          3HZ       LYS   7   1.571   2.571  12.292
   78    QB   LYS   7           QB       LYS   7  -0.369   4.431   7.127
   79    QG   LYS   7           QG       LYS   7   1.275   3.385   8.469
   80    QD   LYS   7           QD       LYS   7  -0.393   4.470   9.984
   81    QE   LYS   7           QE       LYS   7   1.479   4.668  11.318
   82    QZ   LYS   7           QZ       LYS   7   1.816   2.449  11.386
   83    H    SER   8           HN       SER   8  -3.470   3.691   7.152
   84    HA   SER   8           HA       SER   8  -4.297   2.612   9.666
   85   1HB   SER   8          2HB       SER   8  -6.619   3.075   8.805
   86   2HB   SER   8          3HB       SER   8  -5.558   4.477   8.959
   87    HG   SER   8           HG       SER   8  -6.832   4.391   7.060
   88    QB   SER   8           QB       SER   8  -6.088   3.776   8.882
   89    H    LYS   9           HN       LYS   9  -4.853   1.541   6.295
   90    HA   LYS   9           HA       LYS   9  -6.292  -0.798   6.995
   91   1HB   LYS   9          2HB       LYS   9  -6.062   0.209   4.697
   92   2HB   LYS   9          3HB       LYS   9  -4.428  -0.443   4.654
   93   1HG   LYS   9          2HG       LYS   9  -5.620  -2.109   3.587
   94   2HG   LYS   9          3HG       LYS   9  -5.638  -2.735   5.247
   95   1HD   LYS   9          2HD       LYS   9  -7.909  -1.458   5.408
   96   2HD   LYS   9          3HD       LYS   9  -7.826  -1.396   3.662
   97   1HE   LYS   9          2HE       LYS   9  -7.530  -3.942   3.634
   98   2HE   LYS   9          3HE       LYS   9  -7.669  -3.923   5.399
   99   1HZ   LYS   9          3HZ       LYS   9  -9.874  -3.111   5.207
  100   2HZ   LYS   9          1HZ       LYS   9  -9.810  -3.206   3.529
  101   3HZ   LYS   9          2HZ       LYS   9  -9.694  -4.551   4.446
  102    QB   LYS   9           QB       LYS   9  -5.246  -0.117   4.675
  103    QG   LYS   9           QG       LYS   9  -5.629  -2.422   4.416
  104    QD   LYS   9           QD       LYS   9  -7.868  -1.428   4.535
  105    QE   LYS   9           QE       LYS   9  -7.600  -3.932   4.516
  106    QZ   LYS   9           QZ       LYS   9  -9.793  -3.623   4.394
  107    NH1  ARG  10           NH2      ARG  10   1.867  -1.181   3.700
  108    NH2  ARG  10           NH1      ARG  10   2.449   0.825   4.670
  109    H    ARG  10           HN       ARG  10  -2.735  -0.304   6.672
  110    HA   ARG  10           HA       ARG  10  -1.905  -2.909   7.206
  111   1HB   ARG  10          2HB       ARG  10  -0.563  -0.665   6.748
  112   2HB   ARG  10          3HB       ARG  10  -0.460  -0.584   8.507
  113   1HG   ARG  10          2HG       ARG  10   1.317  -1.964   8.419
  114   2HG   ARG  10          3HG       ARG  10   0.232  -3.256   7.883
  115   1HD   ARG  10          2HD       ARG  10   1.963  -3.079   6.226
  116   2HD   ARG  10          3HD       ARG  10   0.458  -2.429   5.559
  117    HE   ARG  10           HE       ARG  10   2.364  -0.506   6.793
  118   1HH1  ARG  10          2HH2      ARG  10   1.631  -2.157   3.793
  119   2HH1  ARG  10          1HH2      ARG  10   1.953  -0.770   2.780
  120   1HH2  ARG  10          2HH1      ARG  10   2.495   1.536   5.399
  121   2HH2  ARG  10          1HH1      ARG  10   2.870   1.196   3.812
  122    QB   ARG  10           QB       ARG  10  -0.512  -0.624   7.627
  123    QG   ARG  10           QG       ARG  10   0.775  -2.610   8.151
  124    QD   ARG  10           QD       ARG  10   1.210  -2.753   5.893
  125    QH1  ARG  10           QH2      ARG  10   1.791  -1.464   3.287
  126    QH2  ARG  10           QH1      ARG  10   2.683   1.366   4.606
  127    H    ILE  11           HN       ILE  11  -2.717  -0.317   9.538
  128    HA   ILE  11           HA       ILE  11  -2.335  -1.806  11.928
  129    HB   ILE  11           HB       ILE  11  -3.877   0.674  11.192
  130   1HG1  ILE  11          2HG1      ILE  11  -2.690   1.408  13.315
  131   2HG1  ILE  11          3HG1      ILE  11  -1.793  -0.118  13.274
  132   1HG2  ILE  11          3HG2      ILE  11  -4.399  -0.826  13.785
  133   2HG2  ILE  11          1HG2      ILE  11  -4.812   0.872  13.482
  134   3HG2  ILE  11          2HG2      ILE  11  -5.599  -0.375  12.548
  135   1HD1  ILE  11          1HD1      ILE  11  -1.897   2.028  11.119
  136   2HD1  ILE  11          2HD1      ILE  11  -0.569   1.766  12.259
  137   3HD1  ILE  11          3HD1      ILE  11  -0.912   0.547  11.016
  138    QG1  ILE  11           QG1      ILE  11  -2.242   0.645  13.295
  139    QG2  ILE  11           QG2      ILE  11  -4.937  -0.110  13.272
  140    QD1  ILE  11           QD1      ILE  11  -1.126   1.447  11.465
  141    H    GLN  12           HN       GLN  12  -5.405  -1.286  10.138
  142    HA   GLN  12           HA       GLN  12  -6.838  -3.014  11.835
  143   1HB   GLN  12          2HB       GLN  12  -8.670  -2.765  10.555
  144   2HB   GLN  12          3HB       GLN  12  -7.713  -1.387  10.018
  145   1HG   GLN  12          2HG       GLN  12  -6.959  -2.939   8.078
  146   2HG   GLN  12          3HG       GLN  12  -8.198  -4.069   8.621
  147   1HE2  GLN  12          2HE2      GLN  12  -9.392  -0.451   6.982
  148   2HE2  GLN  12          1HE2      GLN  12  -8.188  -0.450   8.260
  149    QB   GLN  12           QB       GLN  12  -8.192  -2.076  10.286
  150    QG   GLN  12           QG       GLN  12  -7.579  -3.504   8.349
  151    QE2  GLN  12           QE2      GLN  12  -8.790  -0.451   7.621
  152    H    LEU  13           HN       LEU  13  -4.920  -3.877   9.001
  153    HA   LEU  13           HA       LEU  13  -5.507  -6.736   9.073
  154   1HB   LEU  13          2HB       LEU  13  -3.571  -4.875   7.714
  155   2HB   LEU  13          3HB       LEU  13  -3.047  -6.526   7.893
  156    HG   LEU  13           HG       LEU  13  -4.291  -5.757   5.739
  157   1HD1  LEU  13          2HD1      LEU  13  -4.837  -8.388   7.153
  158   2HD1  LEU  13          3HD1      LEU  13  -5.109  -8.079   5.419
  159   3HD1  LEU  13          1HD1      LEU  13  -3.469  -7.990   6.087
  160   1HD2  LEU  13          3HD2      LEU  13  -6.343  -4.946   6.971
  161   2HD2  LEU  13          1HD2      LEU  13  -6.647  -6.086   5.649
  162   3HD2  LEU  13          2HD2      LEU  13  -6.745  -6.643   7.309
  163    QB   LEU  13           QB       LEU  13  -3.309  -5.701   7.803
  164    QD1  LEU  13           QD1      LEU  13  -4.472  -8.152   6.219
  165    QD2  LEU  13           QD2      LEU  13  -6.578  -5.891   6.643
  166    QQD  LEU  13           QQD      LEU  13  -5.525  -7.022   6.431
  167    H    GLY  14           HN       GLY  14  -3.264  -4.636  10.806
  168   1HA   GLY  14          1HA       GLY  14  -2.080  -5.064  12.713
  169   2HA   GLY  14          2HA       GLY  14  -2.723  -6.715  12.755
  170    QA   GLY  14           QA       GLY  14  -2.402  -5.890  12.735
  171    H    LEU  15           HN       LEU  15  -1.019  -5.219  10.013
  172    HA   LEU  15           HA       LEU  15   1.299  -7.097  10.415
  173   1HB   LEU  15          2HB       LEU  15   0.124  -6.157   7.767
  174   2HB   LEU  15          3HB       LEU  15   1.516  -7.222   7.993
  175    HG   LEU  15           HG       LEU  15  -1.397  -7.855   8.587
  176   1HD1  LEU  15          3HD1      LEU  15  -0.650  -7.992   6.225
  177   2HD1  LEU  15          1HD1      LEU  15   0.648  -9.099   6.709
  178   3HD1  LEU  15          2HD1      LEU  15  -1.046  -9.586   6.882
  179   1HD2  LEU  15          1HD2      LEU  15   1.098  -9.358   9.416
  180   2HD2  LEU  15          2HD2      LEU  15  -0.363  -8.988  10.357
  181   3HD2  LEU  15          3HD2      LEU  15  -0.430 -10.206   9.087
  182    QB   LEU  15           QB       LEU  15   0.820  -6.690   7.881
  183    QD1  LEU  15           QD1      LEU  15  -0.350  -8.892   6.606
  184    QD2  LEU  15           QD2      LEU  15   0.101  -9.517   9.620
  185    QQD  LEU  15           QQD      LEU  15  -0.124  -9.205   8.113
  186    H    ASN  16           HN       ASN  16   3.222  -6.244   9.098
  187    HA   ASN  16           HA       ASN  16   3.389  -3.238   9.389
  188   1HB   ASN  16          2HB       ASN  16   5.792  -3.513   9.737
  189   2HB   ASN  16          3HB       ASN  16   4.847  -4.401  10.949
  190   1HD2  ASN  16          2HD2      ASN  16   6.941  -7.125  10.211
  191   2HD2  ASN  16          1HD2      ASN  16   7.013  -5.637  11.180
  192    QB   ASN  16           QB       ASN  16   5.319  -3.957  10.344
  193    QD2  ASN  16           QD2      ASN  16   6.977  -6.381  10.696
  194    H    GLN  17           HN       GLN  17   5.179  -2.344   7.968
  195    HA   GLN  17           HA       GLN  17   4.401  -2.571   5.236
  196   1HB   GLN  17          2HB       GLN  17   6.599  -1.227   6.781
  197   2HB   GLN  17          3HB       GLN  17   6.724  -1.332   5.002
  198   1HG   GLN  17          2HG       GLN  17   4.735  -0.103   4.760
  199   2HG   GLN  17          3HG       GLN  17   4.427  -0.092   6.525
  200   1HE2  GLN  17          2HE2      GLN  17   6.613   2.878   5.032
  201   2HE2  GLN  17          1HE2      GLN  17   5.367   2.018   4.145
  202    QB   GLN  17           QB       GLN  17   6.661  -1.279   5.891
  203    QG   GLN  17           QG       GLN  17   4.581  -0.097   5.642
  204    QE2  GLN  17           QE2      GLN  17   5.990   2.448   4.589
  205    H    ALA  18           HN       ALA  18   6.993  -4.213   7.066
  206    HA   ALA  18           HA       ALA  18   8.377  -5.291   4.856
  207   1HB   ALA  18          1HB       ALA  18   8.115  -6.295   7.716
  208   2HB   ALA  18          2HB       ALA  18   9.299  -6.881   6.536
  209   3HB   ALA  18          3HB       ALA  18   9.344  -5.191   7.075
  210    QB   ALA  18           QB       ALA  18   8.920  -6.122   7.109
  211    H    GLU  19           HN       GLU  19   5.958  -6.936   6.939
  212    HA   GLU  19           HA       GLU  19   5.583  -9.312   5.479
  213   1HB   GLU  19          2HB       GLU  19   3.746  -7.647   7.196
  214   2HB   GLU  19          3HB       GLU  19   3.223  -9.152   6.456
  215   1HG   GLU  19          2HG       GLU  19   4.226 -10.408   8.013
  216   2HG   GLU  19          3HG       GLU  19   5.781  -9.637   7.729
  217    QB   GLU  19           QB       GLU  19   3.485  -8.399   6.826
  218    QG   GLU  19           QG       GLU  19   5.003 -10.022   7.871
  219    H    LEU  20           HN       LEU  20   3.987  -6.060   5.173
  220    HA   LEU  20           HA       LEU  20   2.401  -7.069   3.076
  221   1HB   LEU  20          2HB       LEU  20   2.256  -4.834   4.562
  222   2HB   LEU  20          3HB       LEU  20   2.918  -4.116   3.104
  223    HG   LEU  20           HG       LEU  20   0.770  -6.065   2.436
  224   1HD1  LEU  20          2HD1      LEU  20   0.152  -5.348   4.853
  225   2HD1  LEU  20          3HD1      LEU  20  -0.254  -3.804   4.067
  226   3HD1  LEU  20          1HD1      LEU  20  -1.039  -5.330   3.561
  227   1HD2  LEU  20          2HD2      LEU  20   1.676  -4.281   1.009
  228   2HD2  LEU  20          3HD2      LEU  20  -0.090  -4.339   1.116
  229   3HD2  LEU  20          1HD2      LEU  20   0.810  -3.081   1.996
  230    QB   LEU  20           QB       LEU  20   2.587  -4.475   3.832
  231    QD1  LEU  20           QD1      LEU  20  -0.380  -4.827   4.160
  232    QD2  LEU  20           QD2      LEU  20   0.798  -3.900   1.374
  233    QQD  LEU  20           QQD      LEU  20   0.210  -4.363   2.767
  234    H    ALA  21           HN       ALA  21   5.543  -5.455   3.023
  235    HA   ALA  21           HA       ALA  21   5.866  -5.090   0.259
  236   1HB   ALA  21          3HB       ALA  21   7.429  -4.272   2.037
  237   2HB   ALA  21          1HB       ALA  21   8.032  -5.923   2.235
  238   3HB   ALA  21          2HB       ALA  21   8.229  -5.084   0.695
  239    QB   ALA  21           QB       ALA  21   7.896  -5.093   1.656
  240    H    GLN  22           HN       GLN  22   6.620  -7.999   2.287
  241    HA   GLN  22           HA       GLN  22   7.346  -9.535  -0.054
  242   1HB   GLN  22          2HB       GLN  22   7.250 -11.531   1.265
  243   2HB   GLN  22          3HB       GLN  22   8.157 -10.266   2.102
  244   1HG   GLN  22          2HG       GLN  22   6.400  -9.866   3.615
  245   2HG   GLN  22          3HG       GLN  22   5.229 -10.843   2.701
  246   1HE2  GLN  22          2HE2      GLN  22   7.562 -12.699   5.416
  247   2HE2  GLN  22          1HE2      GLN  22   7.759 -10.980   5.122
  248    QB   GLN  22           QB       GLN  22   7.704 -10.898   1.684
  249    QG   GLN  22           QG       GLN  22   5.814 -10.354   3.158
  250    QE2  GLN  22           QE2      GLN  22   7.660 -11.839   5.269
  251    H    LYS  23           HN       LYS  23   4.212  -9.023   1.593
  252    HA   LYS  23           HA       LYS  23   2.763 -10.999   0.138
  253   1HB   LYS  23          2HB       LYS  23   1.808  -8.384   1.336
  254   2HB   LYS  23          3HB       LYS  23   0.748  -9.645   0.729
  255   1HG   LYS  23          2HG       LYS  23   2.773 -10.688   2.611
  256   2HG   LYS  23          3HG       LYS  23   1.805  -9.433   3.341
  257   1HD   LYS  23          2HD       LYS  23   0.261 -11.522   1.814
  258   2HD   LYS  23          3HD       LYS  23   1.203 -12.120   3.162
  259   1HE   LYS  23          2HE       LYS  23  -0.344 -11.523   4.618
  260   2HE   LYS  23          3HE       LYS  23  -0.110  -9.821   4.237
  261   1HZ   LYS  23          1HZ       LYS  23  -1.963 -11.590   2.798
  262   2HZ   LYS  23          2HZ       LYS  23  -2.375 -10.558   4.000
  263   3HZ   LYS  23          3HZ       LYS  23  -1.813  -9.955   2.587
  264    QB   LYS  23           QB       LYS  23   1.278  -9.014   1.033
  265    QG   LYS  23           QG       LYS  23   2.289 -10.061   2.977
  266    QD   LYS  23           QD       LYS  23   0.732 -11.821   2.488
  267    QE   LYS  23           QE       LYS  23  -0.227 -10.672   4.427
  268    QZ   LYS  23           QZ       LYS  23  -2.050 -10.701   3.129
  269    H    VAL  24           HN       VAL  24   3.554  -7.612  -0.691
  270    HA   VAL  24           HA       VAL  24   2.212  -7.740  -3.285
  271    HB   VAL  24           HB       VAL  24   4.367  -5.892  -2.164
  272   1HG1  VAL  24          3HG1      VAL  24   2.782  -5.683  -4.754
  273   2HG1  VAL  24          1HG1      VAL  24   3.847  -4.425  -4.087
  274   3HG1  VAL  24          2HG1      VAL  24   4.526  -5.956  -4.658
  275   1HG2  VAL  24          3HG2      VAL  24   1.365  -5.707  -2.587
  276   2HG2  VAL  24          1HG2      VAL  24   2.223  -5.592  -1.046
  277   3HG2  VAL  24          2HG2      VAL  24   2.391  -4.300  -2.248
  278    QG1  VAL  24           QG1      VAL  24   3.718  -5.355  -4.500
  279    QG2  VAL  24           QG2      VAL  24   1.994  -5.200  -1.961
  280    QQG  VAL  24           QQG      VAL  24   2.856  -5.277  -3.229
  281    H    GLY  25           HN       GLY  25   5.493  -8.385  -2.075
  282   1HA   GLY  25          1HA       GLY  25   7.033  -9.879  -3.095
  283   2HA   GLY  25          2HA       GLY  25   6.223  -9.711  -4.656
  284    QA   GLY  25           QA       GLY  25   6.628  -9.795  -3.876
  285    H    THR  26           HN       THR  26   7.265  -7.227  -2.276
  286    HA   THR  26           HA       THR  26   9.548  -6.517  -3.937
  287    HB   THR  26           HB       THR  26   7.998  -5.040  -4.932
  288    HG1  THR  26          1HG       THR  26   9.850  -4.039  -4.681
  289   1HG2  THR  26          1HG2      THR  26   6.984  -4.551  -2.148
  290   2HG2  THR  26          2HG2      THR  26   6.921  -3.217  -3.323
  291   3HG2  THR  26          3HG2      THR  26   6.141  -4.752  -3.685
  292    QG2  THR  26           QG2      THR  26   6.682  -4.174  -3.052
  293    H    THR  27           HN       THR  27  10.451  -4.428  -2.571
  294    HA   THR  27           HA       THR  27  11.028  -5.525   0.148
  295    HB   THR  27           HB       THR  27  12.936  -3.678  -0.199
  296    HG1  THR  27          1HG       THR  27  11.957  -3.039  -2.253
  297   1HG2  THR  27          1HG2      THR  27  13.091  -6.335  -0.162
  298   2HG2  THR  27          2HG2      THR  27  13.336  -6.128  -1.905
  299   3HG2  THR  27          3HG2      THR  27  14.431  -5.346  -0.752
  300    QG2  THR  27           QG2      THR  27  13.619  -5.936  -0.940
  301    H    GLN  28           HN       GLN  28  10.864  -4.217   1.940
  302    HA   GLN  28           HA       GLN  28   8.816  -2.430   2.191
  303   1HB   GLN  28          2HB       GLN  28   9.866  -3.488   4.068
  304   2HB   GLN  28          3HB       GLN  28  11.382  -2.599   3.823
  305   1HG   GLN  28          2HG       GLN  28  10.356  -0.506   4.447
  306   2HG   GLN  28          3HG       GLN  28   8.742  -1.190   4.309
  307   1HE2  GLN  28          2HE2      GLN  28  10.860  -1.653   7.776
  308   2HE2  GLN  28          1HE2      GLN  28  11.600  -0.912   6.368
  309    QB   GLN  28           QB       GLN  28  10.624  -3.044   3.946
  310    QG   GLN  28           QG       GLN  28   9.549  -0.848   4.378
  311    QE2  GLN  28           QE2      GLN  28  11.230  -1.283   7.072
  312    H    GLN  29           HN       GLN  29  12.144  -1.572   1.196
  313    HA   GLN  29           HA       GLN  29  12.053   1.185   1.385
  314   1HB   GLN  29          2HB       GLN  29  13.692   1.223  -0.328
  315   2HB   GLN  29          3HB       GLN  29  13.946  -0.251   0.613
  316   1HG   GLN  29          2HG       GLN  29  12.850  -1.549  -1.175
  317   2HG   GLN  29          3HG       GLN  29  12.669  -0.085  -2.155
  318   1HE2  GLN  29          2HE2      GLN  29  16.014   0.176  -3.155
  319   2HE2  GLN  29          1HE2      GLN  29  14.503   1.055  -2.940
  320    QB   GLN  29           QB       GLN  29  13.819   0.487   0.143
  321    QG   GLN  29           QG       GLN  29  12.760  -0.817  -1.665
  322    QE2  GLN  29           QE2      GLN  29  15.259   0.616  -3.047
  323    H    SER  30           HN       SER  30  10.690  -0.856  -1.179
  324    HA   SER  30           HA       SER  30   9.845   1.304  -2.852
  325   1HB   SER  30          2HB       SER  30   8.800  -1.551  -2.788
  326   2HB   SER  30          3HB       SER  30   8.756  -0.412  -4.149
  327    HG   SER  30           HG       SER  30  10.526  -1.826  -4.328
  328    QB   SER  30           QB       SER  30   8.778  -0.982  -3.469
  329    H    ILE  31           HN       ILE  31   8.344  -0.551  -0.233
  330    HA   ILE  31           HA       ILE  31   5.683   0.536  -0.571
  331    HB   ILE  31           HB       ILE  31   7.013  -0.670   1.886
  332   1HG1  ILE  31          2HG1      ILE  31   7.124  -2.328   0.121
  333   2HG1  ILE  31          3HG1      ILE  31   5.856  -2.743   1.270
  334   1HG2  ILE  31          3HG2      ILE  31   4.132  -0.017   1.220
  335   2HG2  ILE  31          1HG2      ILE  31   4.593  -1.213   2.461
  336   3HG2  ILE  31          2HG2      ILE  31   5.139   0.462   2.598
  337   1HD1  ILE  31          1HD1      ILE  31   4.173  -1.743  -0.320
  338   2HD1  ILE  31          2HD1      ILE  31   5.476  -1.577  -1.516
  339   3HD1  ILE  31          3HD1      ILE  31   5.003  -3.177  -0.931
  340    QG1  ILE  31           QG1      ILE  31   6.491  -2.536   0.696
  341    QG2  ILE  31           QG2      ILE  31   4.621  -0.256   2.093
  342    QD1  ILE  31           QD1      ILE  31   4.884  -2.166  -0.923
  343    H    GLU  32           HN       GLU  32   8.492   1.406   1.490
  344    HA   GLU  32           HA       GLU  32   7.407   3.667   2.759
  345   1HB   GLU  32          2HB       GLU  32   9.612   2.570   3.270
  346   2HB   GLU  32          3HB       GLU  32  10.301   3.342   1.837
  347   1HG   GLU  32          2HG       GLU  32   9.051   4.841   4.176
  348   2HG   GLU  32          3HG       GLU  32  10.783   4.555   3.962
  349    QB   GLU  32           QB       GLU  32   9.956   2.956   2.553
  350    QG   GLU  32           QG       GLU  32   9.918   4.699   4.069
  351    H    GLN  33           HN       GLN  33   9.404   3.580  -0.248
  352    HA   GLN  33           HA       GLN  33   9.165   6.251  -0.828
  353   1HB   GLN  33          2HB       GLN  33  10.105   5.834  -2.810
  354   2HB   GLN  33          3HB       GLN  33  10.476   4.300  -2.009
  355   1HG   GLN  33          2HG       GLN  33   8.693   3.242  -3.318
  356   2HG   GLN  33          3HG       GLN  33   8.261   4.787  -4.051
  357   1HE2  GLN  33          2HE2      GLN  33  10.501   4.086  -6.679
  358   2HE2  GLN  33          1HE2      GLN  33   8.928   4.687  -6.182
  359    QB   GLN  33           QB       GLN  33  10.291   5.068  -2.409
  360    QG   GLN  33           QG       GLN  33   8.477   4.015  -3.685
  361    QE2  GLN  33           QE2      GLN  33   9.715   4.387  -6.430
  362    H    LEU  34           HN       LEU  34   6.906   3.681  -1.553
  363    HA   LEU  34           HA       LEU  34   5.119   5.151  -3.155
  364   1HB   LEU  34          2HB       LEU  34   5.159   2.582  -2.615
  365   2HB   LEU  34          3HB       LEU  34   4.139   2.984  -1.262
  366    HG   LEU  34           HG       LEU  34   2.754   2.295  -3.082
  367   1HD1  LEU  34          3HD1      LEU  34   1.814   4.421  -2.067
  368   2HD1  LEU  34          1HD1      LEU  34   2.540   5.307  -3.437
  369   3HD1  LEU  34          2HD1      LEU  34   1.323   4.075  -3.736
  370   1HD2  LEU  34          1HD2      LEU  34   4.917   3.375  -4.646
  371   2HD2  LEU  34          2HD2      LEU  34   3.576   2.375  -5.160
  372   3HD2  LEU  34          3HD2      LEU  34   3.452   4.151  -5.214
  373    QB   LEU  34           QB       LEU  34   4.649   2.783  -1.939
  374    QD1  LEU  34           QD1      LEU  34   1.892   4.601  -3.080
  375    QD2  LEU  34           QD2      LEU  34   3.981   3.301  -5.006
  376    QQD  LEU  34           QQD      LEU  34   2.937   3.951  -4.043
  377    H    GLU  35           HN       GLU  35   5.085   4.482   0.318
  378    HA   GLU  35           HA       GLU  35   2.919   6.168   1.046
  379   1HB   GLU  35          2HB       GLU  35   5.191   4.767   2.384
  380   2HB   GLU  35          3HB       GLU  35   4.564   6.158   3.263
  381   1HG   GLU  35          2HG       GLU  35   2.461   5.235   3.506
  382   2HG   GLU  35          3HG       GLU  35   2.593   4.197   2.061
  383    QB   GLU  35           QB       GLU  35   4.877   5.463   2.823
  384    QG   GLU  35           QG       GLU  35   2.527   4.715   2.783
  385    H    ASN  36           HN       ASN  36   6.320   6.971   0.374
  386    HA   ASN  36           HA       ASN  36   5.960   9.769   1.037
  387   1HB   ASN  36          2HB       ASN  36   8.131   8.065   0.097
  388   2HB   ASN  36          3HB       ASN  36   8.067   9.544  -0.851
  389   1HD2  ASN  36          2HD2      ASN  36   9.972   9.833   2.511
  390   2HD2  ASN  36          1HD2      ASN  36   9.495   8.285   1.894
  391    QB   ASN  36           QB       ASN  36   8.099   8.804  -0.377
  392    QD2  ASN  36           QD2      ASN  36   9.734   9.059   2.203
  393    H    GLY  37           HN       GLY  37   4.457   8.112  -1.410
  394   1HA   GLY  37          1HA       GLY  37   3.202   8.765  -3.191
  395   2HA   GLY  37          2HA       GLY  37   3.117  10.317  -2.361
  396    QA   GLY  37           QA       GLY  37   3.159   9.540  -2.776
  397    H    LYS  38           HN       LYS  38   5.897   8.708  -3.899
  398    HA   LYS  38           HA       LYS  38   6.654  11.227  -5.132
  399   1HB   LYS  38          2HB       LYS  38   8.245   8.852  -5.920
  400   2HB   LYS  38          3HB       LYS  38   8.721  10.443  -5.309
  401   1HG   LYS  38          2HG       LYS  38   7.779   9.603  -3.025
  402   2HG   LYS  38          3HG       LYS  38   7.768   8.007  -3.806
  403   1HD   LYS  38          2HD       LYS  38   9.643   8.257  -2.352
  404   2HD   LYS  38          3HD       LYS  38  10.199   8.031  -4.008
  405   1HE   LYS  38          2HE       LYS  38   9.812  10.868  -2.993
  406   2HE   LYS  38          3HE       LYS  38  11.139   9.943  -2.284
  407   1HZ   LYS  38          1HZ       LYS  38  10.804  10.306  -5.180
  408   2HZ   LYS  38          2HZ       LYS  38  11.782  11.229  -4.231
  409   3HZ   LYS  38          3HZ       LYS  38  12.083   9.622  -4.401
  410    QB   LYS  38           QB       LYS  38   8.483   9.648  -5.615
  411    QG   LYS  38           QG       LYS  38   7.773   8.804  -3.416
  412    QD   LYS  38           QD       LYS  38   9.921   8.144  -3.180
  413    QE   LYS  38           QE       LYS  38  10.476  10.405  -2.638
  414    QZ   LYS  38           QZ       LYS  38  11.556  10.385  -4.605
  415    H    THR  39           HN       THR  39   4.876   8.478  -6.214
  416    HA   THR  39           HA       THR  39   5.075   9.370  -9.052
  417    HB   THR  39           HB       THR  39   6.074   7.105  -8.633
  418    HG1  THR  39          1HG       THR  39   5.404   7.364 -10.644
  419   1HG2  THR  39          3HG2      THR  39   4.445   6.346  -6.852
  420   2HG2  THR  39          1HG2      THR  39   3.201   6.223  -8.109
  421   3HG2  THR  39          2HG2      THR  39   4.648   5.210  -8.195
  422    QG2  THR  39           QG2      THR  39   4.098   5.926  -7.719
  423    H    LYS  40           HN       LYS  40   3.081   8.967 -10.243
  424    HA   LYS  40           HA       LYS  40   0.766   9.951  -8.680
  425   1HB   LYS  40          2HB       LYS  40   1.229   9.626 -11.685
  426   2HB   LYS  40          3HB       LYS  40  -0.272  10.161 -10.928
  427   1HG   LYS  40          2HG       LYS  40   0.737  12.147 -11.551
  428   2HG   LYS  40          3HG       LYS  40   1.021  12.033  -9.816
  429   1HD   LYS  40          2HD       LYS  40   3.361  11.231 -10.309
  430   2HD   LYS  40          3HD       LYS  40   3.029  11.412 -12.047
  431   1HE   LYS  40          2HE       LYS  40   2.718  13.851 -11.719
  432   2HE   LYS  40          3HE       LYS  40   2.818  13.642  -9.961
  433   1HZ   LYS  40          1HZ       LYS  40   5.120  12.741 -10.426
  434   2HZ   LYS  40          2HZ       LYS  40   4.988  13.446 -11.909
  435   3HZ   LYS  40          3HZ       LYS  40   4.885  14.357 -10.548
  436    QB   LYS  40           QB       LYS  40   0.478   9.893 -11.307
  437    QG   LYS  40           QG       LYS  40   0.879  12.090 -10.684
  438    QD   LYS  40           QD       LYS  40   3.196  11.322 -11.178
  439    QE   LYS  40           QE       LYS  40   2.768  13.746 -10.840
  440    QZ   LYS  40           QZ       LYS  40   4.998  13.515 -10.961
  441    NH1  ARG  41           NH2      ARG  41  -3.524   1.592 -12.111
  442    NH2  ARG  41           NH1      ARG  41  -3.591   1.880 -14.409
  443    H    ARG  41           HN       ARG  41   1.755   7.143 -10.699
  444    HA   ARG  41           HA       ARG  41  -0.253   5.537  -9.305
  445   1HB   ARG  41          2HB       ARG  41  -1.373   6.505 -11.277
  446   2HB   ARG  41          3HB       ARG  41  -0.255   5.659 -12.347
  447   1HG   ARG  41          2HG       ARG  41  -1.838   4.187 -10.204
  448   2HG   ARG  41          3HG       ARG  41  -2.629   4.665 -11.694
  449   1HD   ARG  41          2HD       ARG  41  -0.070   3.291 -12.231
  450   2HD   ARG  41          3HD       ARG  41  -1.128   2.303 -11.257
  451    HE   ARG  41           HE       ARG  41  -1.501   3.231 -14.028
  452   1HH1  ARG  41          2HH2      ARG  41  -3.093   1.804 -11.224
  453   2HH1  ARG  41          1HH2      ARG  41  -4.361   1.028 -12.120
  454   1HH2  ARG  41          2HH1      ARG  41  -3.223   2.287 -15.256
  455   2HH2  ARG  41          1HH1      ARG  41  -4.440   1.337 -14.472
  456    QB   ARG  41           QB       ARG  41  -0.814   6.082 -11.812
  457    QG   ARG  41           QG       ARG  41  -2.233   4.426 -10.950
  458    QD   ARG  41           QD       ARG  41  -0.599   2.797 -11.745
  459    QH1  ARG  41           QH2      ARG  41  -3.726   1.416 -11.672
  460    QH2  ARG  41           QH1      ARG  41  -3.831   1.813 -14.864
  461    HA   PRO  42           HA       PRO  42   3.607   3.136  -9.847
  462   1HB   PRO  42          2HB       PRO  42   3.202   1.320  -7.810
  463   2HB   PRO  42          3HB       PRO  42   3.765   2.968  -7.540
  464   1HG   PRO  42          2HG       PRO  42   1.014   1.818  -7.233
  465   2HG   PRO  42          3HG       PRO  42   1.747   3.039  -6.202
  466   1HD   PRO  42          2HD       PRO  42  -0.055   3.614  -8.237
  467   2HD   PRO  42          3HD       PRO  42   1.135   4.785  -7.578
  468    QB   PRO  42           QB       PRO  42   3.483   2.144  -7.675
  469    QG   PRO  42           QG       PRO  42   1.381   2.428  -6.718
  470    QD   PRO  42           QD       PRO  42   0.540   4.200  -7.908
  471    NH1  ARG  43           NH2      ARG  43   1.851  -2.150 -15.740
  472    NH2  ARG  43           NH1      ARG  43   1.503   0.111 -16.108
  473    H    ARG  43           HN       ARG  43   4.079   0.852 -10.275
  474    HA   ARG  43           HA       ARG  43   2.083  -0.342 -12.004
  475   1HB   ARG  43          2HB       ARG  43   4.696  -0.295 -12.224
  476   2HB   ARG  43          3HB       ARG  43   4.684  -1.598 -11.040
  477   1HG   ARG  43          2HG       ARG  43   4.494  -3.019 -12.745
  478   2HG   ARG  43          3HG       ARG  43   2.830  -2.490 -12.953
  479   1HD   ARG  43          2HD       ARG  43   5.253  -1.131 -14.245
  480   2HD   ARG  43          3HD       ARG  43   4.382  -2.415 -15.036
  481    HE   ARG  43           HE       ARG  43   3.555   0.373 -14.660
  482   1HH1  ARG  43          2HH2      ARG  43   2.376  -2.881 -15.282
  483   2HH1  ARG  43          1HH2      ARG  43   1.056  -2.408 -16.305
  484   1HH2  ARG  43          2HH1      ARG  43   1.789   1.074 -15.998
  485   2HH2  ARG  43          1HH1      ARG  43   0.700  -0.089 -16.686
  486    QB   ARG  43           QB       ARG  43   4.690  -0.946 -11.632
  487    QG   ARG  43           QG       ARG  43   3.662  -2.754 -12.850
  488    QD   ARG  43           QD       ARG  43   4.818  -1.773 -14.641
  489    QH1  ARG  43           QH2      ARG  43   1.716  -2.645 -15.793
  490    QH2  ARG  43           QH1      ARG  43   1.244   0.492 -16.342
  491    H    PHE  44           HN       PHE  44   3.282  -0.905  -8.716
  492    HA   PHE  44           HA       PHE  44   1.773  -3.468  -8.531
  493   1HB   PHE  44          2HB       PHE  44   2.919  -3.694  -6.369
  494   2HB   PHE  44          3HB       PHE  44   4.000  -3.612  -7.735
  495    HD1  PHE  44          1HD       PHE  44   5.500  -1.679  -8.067
  496    HD2  PHE  44          2HD       PHE  44   2.842  -1.888  -4.679
  497    HE1  PHE  44          1HE       PHE  44   6.690   0.224  -7.013
  498    HE2  PHE  44          2HE       PHE  44   4.075  -0.027  -3.600
  499    HZ   PHE  44           HZ       PHE  44   6.003   1.028  -4.758
  500    QB   PHE  44           QB       PHE  44   3.459  -3.654  -7.052
  501    QR   PHE  44           QR       PHE  44   4.777  -0.843  -5.839
  502    H    LEU  45           HN       LEU  45   0.564  -0.611  -8.667
  503    HA   LEU  45           HA       LEU  45  -0.553  -0.084  -6.134
  504   1HB   LEU  45          2HB       LEU  45  -0.725   1.364  -8.327
  505   2HB   LEU  45          3HB       LEU  45  -2.068   0.325  -8.731
  506    HG   LEU  45           HG       LEU  45  -3.129   0.901  -6.534
  507   1HD1  LEU  45          1HD1      LEU  45  -1.042   1.904  -5.377
  508   2HD1  LEU  45          2HD1      LEU  45  -1.189   3.273  -6.482
  509   3HD1  LEU  45          3HD1      LEU  45  -2.480   2.931  -5.361
  510   1HD2  LEU  45          1HD2      LEU  45  -3.704   1.900  -8.735
  511   2HD2  LEU  45          2HD2      LEU  45  -4.080   2.890  -7.311
  512   3HD2  LEU  45          3HD2      LEU  45  -2.674   3.280  -8.321
  513    QB   LEU  45           QB       LEU  45  -1.396   0.844  -8.529
  514    QD1  LEU  45           QD1      LEU  45  -1.570   2.702  -5.740
  515    QD2  LEU  45           QD2      LEU  45  -3.486   2.690  -8.122
  516    QQD  LEU  45           QQD      LEU  45  -2.528   2.696  -6.931
  517    HA   PRO  46           HA       PRO  46  -4.210  -2.962  -7.131
  518   1HB   PRO  46          2HB       PRO  46  -3.821  -5.087  -8.868
  519   2HB   PRO  46          3HB       PRO  46  -4.600  -3.544  -9.296
  520   1HG   PRO  46          2HG       PRO  46  -1.855  -4.488  -9.960
  521   2HG   PRO  46          3HG       PRO  46  -2.898  -3.342 -10.842
  522   1HD   PRO  46          2HD       PRO  46  -0.744  -2.746  -9.166
  523   2HD   PRO  46          3HD       PRO  46  -1.945  -1.567  -9.748
  524    QB   PRO  46           QB       PRO  46  -4.211  -4.316  -9.082
  525    QG   PRO  46           QG       PRO  46  -2.376  -3.915 -10.401
  526    QD   PRO  46           QD       PRO  46  -1.345  -2.156  -9.457
  527    H    GLU  47           HN       GLU  47  -0.992  -4.506  -7.523
  528    HA   GLU  47           HA       GLU  47  -1.520  -6.739  -5.941
  529   1HB   GLU  47          2HB       GLU  47   1.141  -5.303  -6.253
  530   2HB   GLU  47          3HB       GLU  47   0.863  -7.002  -5.820
  531   1HG   GLU  47          2HG       GLU  47  -0.526  -6.975  -8.132
  532   2HG   GLU  47          3HG       GLU  47   0.565  -5.624  -8.488
  533    QB   GLU  47           QB       GLU  47   1.002  -6.152  -6.036
  534    QG   GLU  47           QG       GLU  47   0.019  -6.299  -8.310
  535    H    LEU  48           HN       LEU  48  -0.270  -3.516  -4.962
  536    HA   LEU  48           HA       LEU  48  -0.053  -4.055  -2.164
  537   1HB   LEU  48          2HB       LEU  48   0.809  -2.059  -3.521
  538   2HB   LEU  48          3HB       LEU  48  -0.821  -1.413  -3.468
  539    HG   LEU  48           HG       LEU  48   0.458  -0.315  -1.815
  540   1HD1  LEU  48          1HD1      LEU  48  -1.825  -1.074  -1.024
  541   2HD1  LEU  48          2HD1      LEU  48  -1.000  -2.404  -0.164
  542   3HD1  LEU  48          3HD1      LEU  48  -0.643  -0.729   0.248
  543   1HD2  LEU  48          1HD2      LEU  48   2.328  -1.888  -1.678
  544   2HD2  LEU  48          2HD2      LEU  48   1.755  -1.434  -0.061
  545   3HD2  LEU  48          3HD2      LEU  48   1.328  -3.006  -0.739
  546    QB   LEU  48           QB       LEU  48  -0.006  -1.736  -3.494
  547    QD1  LEU  48           QD1      LEU  48  -1.156  -1.402  -0.314
  548    QD2  LEU  48           QD2      LEU  48   1.804  -2.109  -0.826
  549    QQD  LEU  48           QQD      LEU  48   0.324  -1.756  -0.570
  550    H    ALA  49           HN       ALA  49  -2.716  -2.584  -4.071
  551    HA   ALA  49           HA       ALA  49  -4.508  -2.234  -2.010
  552   1HB   ALA  49          2HB       ALA  49  -4.760  -1.399  -4.374
  553   2HB   ALA  49          3HB       ALA  49  -5.267  -3.017  -4.860
  554   3HB   ALA  49          1HB       ALA  49  -6.237  -2.088  -3.710
  555    QB   ALA  49           QB       ALA  49  -5.421  -2.168  -4.314
  556    H    SER  50           HN       SER  50  -4.133  -5.185  -4.045
  557    HA   SER  50           HA       SER  50  -6.217  -6.645  -2.728
  558   1HB   SER  50          2HB       SER  50  -5.317  -8.555  -4.019
  559   2HB   SER  50          3HB       SER  50  -5.579  -7.109  -5.011
  560    HG   SER  50           HG       SER  50  -3.055  -7.940  -3.982
  561    QB   SER  50           QB       SER  50  -5.449  -7.832  -4.515
  562    H    ALA  51           HN       ALA  51  -2.630  -6.610  -2.372
  563    HA   ALA  51           HA       ALA  51  -2.381  -8.752  -0.551
  564   1HB   ALA  51          3HB       ALA  51  -0.748  -6.190  -0.810
  565   2HB   ALA  51          1HB       ALA  51  -0.273  -7.599   0.142
  566   3HB   ALA  51          2HB       ALA  51  -0.436  -7.744  -1.614
  567    QB   ALA  51           QB       ALA  51  -0.486  -7.178  -0.761
  568    H    LEU  52           HN       LEU  52  -3.172  -5.342  -0.047
  569    HA   LEU  52           HA       LEU  52  -3.440  -5.565   2.840
  570   1HB   LEU  52          2HB       LEU  52  -3.716  -3.470   0.738
  571   2HB   LEU  52          3HB       LEU  52  -4.851  -3.297   2.053
  572    HG   LEU  52           HG       LEU  52  -1.885  -3.668   2.395
  573   1HD1  LEU  52          1HD1      LEU  52  -2.723  -1.468   1.288
  574   2HD1  LEU  52          2HD1      LEU  52  -3.195  -1.012   2.912
  575   3HD1  LEU  52          3HD1      LEU  52  -1.506  -1.419   2.575
  576   1HD2  LEU  52          3HD2      LEU  52  -4.049  -3.867   4.275
  577   2HD2  LEU  52          1HD2      LEU  52  -2.354  -3.921   4.670
  578   3HD2  LEU  52          2HD2      LEU  52  -3.173  -2.378   4.671
  579    QB   LEU  52           QB       LEU  52  -4.283  -3.383   1.395
  580    QD1  LEU  52           QD1      LEU  52  -2.474  -1.299   2.259
  581    QD2  LEU  52           QD2      LEU  52  -3.192  -3.389   4.539
  582    QQD  LEU  52           QQD      LEU  52  -2.834  -2.345   3.399
  583    H    GLY  53           HN       GLY  53  -5.731  -5.527   0.094
  584   1HA   GLY  53          1HA       GLY  53  -7.697  -6.892   0.105
  585   2HA   GLY  53          2HA       GLY  53  -7.841  -6.725   1.856
  586    QA   GLY  53           QA       GLY  53  -7.769  -6.808   0.980
  587    H    VAL  54           HN       VAL  54  -7.417  -4.478  -0.915
  588    HA   VAL  54           HA       VAL  54 -10.001  -3.163  -0.515
  589    HB   VAL  54           HB       VAL  54  -8.677  -0.900  -0.713
  590   1HG1  VAL  54          1HG1      VAL  54 -10.102  -1.442   1.169
  591   2HG1  VAL  54          2HG1      VAL  54  -8.768  -2.344   1.921
  592   3HG1  VAL  54          3HG1      VAL  54  -8.640  -0.587   1.682
  593   1HG2  VAL  54          2HG2      VAL  54  -6.459  -1.899  -1.022
  594   2HG2  VAL  54          3HG2      VAL  54  -6.491  -0.843   0.385
  595   3HG2  VAL  54          1HG2      VAL  54  -6.513  -2.584   0.620
  596    QG1  VAL  54           QG1      VAL  54  -9.169  -1.458   1.591
  597    QG2  VAL  54           QG2      VAL  54  -6.487  -1.775  -0.005
  598    QQG  VAL  54           QQG      VAL  54  -7.829  -1.616   0.793
  599    H    SER  55           HN       SER  55 -10.103  -1.361  -2.322
  600    HA   SER  55           HA       SER  55  -9.243  -2.594  -4.836
  601   1HB   SER  55          2HB       SER  55 -11.008  -0.948  -5.628
  602   2HB   SER  55          3HB       SER  55 -11.577  -2.273  -4.598
  603    HG   SER  55           HG       SER  55 -12.036   0.208  -4.187
  604    QB   SER  55           QB       SER  55 -11.293  -1.610  -5.114
  605    H    VAL  56           HN       VAL  56  -8.525  -1.217  -6.555
  606    HA   VAL  56           HA       VAL  56  -6.362   0.576  -5.857
  607    HB   VAL  56           HB       VAL  56  -7.740  -0.424  -8.397
  608   1HG1  VAL  56          2HG1      VAL  56  -5.808   1.850  -8.190
  609   2HG1  VAL  56          3HG1      VAL  56  -5.802   0.785  -9.610
  610   3HG1  VAL  56          1HG1      VAL  56  -7.254   1.702  -9.184
  611   1HG2  VAL  56          2HG2      VAL  56  -6.165  -1.879  -7.197
  612   2HG2  VAL  56          3HG2      VAL  56  -5.523  -1.410  -8.787
  613   3HG2  VAL  56          1HG2      VAL  56  -4.898  -0.627  -7.313
  614    QG1  VAL  56           QG1      VAL  56  -6.288   1.446  -8.995
  615    QG2  VAL  56           QG2      VAL  56  -5.529  -1.305  -7.765
  616    QQG  VAL  56           QQG      VAL  56  -5.908   0.071  -8.380
  617    H    ASP  57           HN       ASP  57  -9.640   1.128  -7.242
  618    HA   ASP  57           HA       ASP  57  -9.604   3.937  -7.412
  619   1HB   ASP  57          2HB       ASP  57 -12.095   3.602  -6.705
  620   2HB   ASP  57          3HB       ASP  57 -11.524   2.829  -8.190
  621    QB   ASP  57           QB       ASP  57 -11.809   3.216  -7.447
  622    CH2  TRP  58           CH2      TRP  58  -7.150   2.133   2.507
  623    H    TRP  58           HN       TRP  58 -10.133   1.778  -4.555
  624    HA   TRP  58           HA       TRP  58 -10.526   3.997  -2.912
  625   1HB   TRP  58          2HB       TRP  58 -11.395   1.898  -2.158
  626   2HB   TRP  58          3HB       TRP  58  -9.796   1.171  -2.131
  627    HD1  TRP  58           HD1      TRP  58 -12.072   3.443   0.020
  628    HE1  TRP  58           HE1      TRP  58 -11.102   3.785   2.221
  629    HE3  TRP  58           HE3      TRP  58  -7.461   1.289  -0.783
  630    HZ2  TRP  58           HZ2      TRP  58  -8.645   3.138   3.685
  631    HZ3  TRP  58           HZ3      TRP  58  -5.808   1.267   1.104
  632    HH2  TRP  58           HH2      TRP  58  -6.369   2.245   3.234
  633    QB   TRP  58           QB       TRP  58 -10.595   1.534  -2.145
  634    H    LEU  59           HN       LEU  59  -7.612   2.083  -3.508
  635    HA   LEU  59           HA       LEU  59  -5.796   3.489  -1.872
  636   1HB   LEU  59          2HB       LEU  59  -5.567   2.041  -4.517
  637   2HB   LEU  59          3HB       LEU  59  -4.245   3.022  -4.059
  638    HG   LEU  59           HG       LEU  59  -5.252   0.496  -2.843
  639   1HD1  LEU  59          1HD1      LEU  59  -3.417   0.474  -4.487
  640   2HD1  LEU  59          2HD1      LEU  59  -2.434   1.500  -3.411
  641   3HD1  LEU  59          3HD1      LEU  59  -2.891  -0.139  -2.920
  642   1HD2  LEU  59          1HD2      LEU  59  -3.476   2.511  -1.364
  643   2HD2  LEU  59          2HD2      LEU  59  -5.034   1.863  -0.814
  644   3HD2  LEU  59          3HD2      LEU  59  -3.646   0.801  -0.904
  645    QB   LEU  59           QB       LEU  59  -4.906   2.532  -4.287
  646    QD1  LEU  59           QD1      LEU  59  -2.913   0.612  -3.606
  647    QD2  LEU  59           QD2      LEU  59  -4.052   1.725  -1.028
  648    QQD  LEU  59           QQD      LEU  59  -3.482   1.168  -2.316
  649    H    LEU  60           HN       LEU  60  -6.889   4.444  -5.160
  650    HA   LEU  60           HA       LEU  60  -5.363   6.907  -5.051
  651   1HB   LEU  60          2HB       LEU  60  -7.807   6.127  -6.684
  652   2HB   LEU  60          3HB       LEU  60  -7.023   7.698  -6.777
  653    HG   LEU  60           HG       LEU  60  -6.352   5.231  -8.121
  654   1HD1  LEU  60          2HD1      LEU  60  -6.617   7.505  -9.136
  655   2HD1  LEU  60          3HD1      LEU  60  -5.127   8.014  -8.323
  656   3HD1  LEU  60          1HD1      LEU  60  -5.076   6.748  -9.556
  657   1HD2  LEU  60          3HD2      LEU  60  -4.596   4.879  -6.409
  658   2HD2  LEU  60          1HD2      LEU  60  -3.931   5.272  -8.001
  659   3HD2  LEU  60          2HD2      LEU  60  -3.951   6.505  -6.737
  660    QB   LEU  60           QB       LEU  60  -7.416   6.913  -6.730
  661    QD1  LEU  60           QD1      LEU  60  -5.607   7.423  -9.005
  662    QD2  LEU  60           QD2      LEU  60  -4.159   5.552  -7.049
  663    QQD  LEU  60           QQD      LEU  60  -4.883   6.487  -8.027
  664    H    ASN  61           HN       ASN  61  -8.912   6.360  -4.462
  665    HA   ASN  61           HA       ASN  61  -8.864   8.545  -2.553
  666   1HB   ASN  61          2HB       ASN  61 -10.224  10.103  -3.651
  667   2HB   ASN  61          3HB       ASN  61  -8.778   9.812  -4.618
  668   1HD2  ASN  61          2HD2      ASN  61 -10.799   7.962  -7.152
  669   2HD2  ASN  61          1HD2      ASN  61  -9.364   7.634  -6.203
  670    QB   ASN  61           QB       ASN  61  -9.501   9.958  -4.134
  671    QD2  ASN  61           QD2      ASN  61 -10.081   7.798  -6.679
  672    H    GLY  62           HN       GLY  62  -9.636   6.065  -1.901
  673   1HA   GLY  62          1HA       GLY  62 -12.584   5.956  -2.002
  674   2HA   GLY  62          2HA       GLY  62 -11.473   4.799  -1.391
  675    QA   GLY  62           QA       GLY  62 -12.028   5.377  -1.697
  676    H    THR  63           HN       THR  63 -10.093   6.224   0.499
  677    HA   THR  63           HA       THR  63 -10.139   6.756   2.712
  678    HB   THR  63           HB       THR  63 -11.433   8.621   3.298
  679    HG1  THR  63          1HG       THR  63 -13.371   7.560   1.847
  680   1HG2  THR  63          2HG2      THR  63  -9.742   8.779   1.435
  681   2HG2  THR  63          3HG2      THR  63 -11.081   8.720   0.260
  682   3HG2  THR  63          1HG2      THR  63 -10.980  10.068   1.387
  683    QG2  THR  63           QG2      THR  63 -10.601   9.189   1.027
  684    H    SER  64           HN       SER  64 -10.456   4.906   4.005
  685    HA   SER  64           HA       SER  64 -12.968   4.659   5.301
  686   1HB   SER  64          2HB       SER  64 -13.372   3.552   2.907
  687   2HB   SER  64          3HB       SER  64 -12.523   2.178   3.635
  688    HG   SER  64           HG       SER  64 -14.830   2.182   4.022
  689    QB   SER  64           QB       SER  64 -12.948   2.865   3.271
  690    H    ASP  65           HN       ASP  65 -12.020   4.469   7.234
  691    HA   ASP  65           HA       ASP  65  -9.831   2.534   7.730
  692   1HB   ASP  65          2HB       ASP  65 -10.996   4.905   9.181
  693   2HB   ASP  65          3HB       ASP  65 -10.255   3.603  10.106
  694    QB   ASP  65           QB       ASP  65 -10.626   4.255   9.643
  695    H    SER  66           HN       SER  66 -10.547   0.562   7.884
  696    HA   SER  66           HA       SER  66 -11.914  -1.268   8.140
  697   1HB   SER  66          2HB       SER  66 -12.315  -1.521  10.767
  698   2HB   SER  66          3HB       SER  66 -10.730  -1.641  10.018
  699    HG   SER  66           HG       SER  66 -11.783   0.727  11.157
  700    QB   SER  66           QB       SER  66 -11.522  -1.581  10.392
  701    H    ASN  67           HN       ASN  67 -13.622   0.046   6.833
  702    HA   ASN  67           HA       ASN  67 -16.155  -0.520   8.195
  703   1HB   ASN  67          2HB       ASN  67 -15.262   2.040   8.408
  704   2HB   ASN  67          3HB       ASN  67 -16.063   2.172   6.849
  705   1HD2  ASN  67          2HD2      ASN  67 -19.305   1.258   8.444
  706   2HD2  ASN  67          1HD2      ASN  67 -18.418   0.745   7.022
  707    QB   ASN  67           QB       ASN  67 -15.663   2.106   7.629
  708    QD2  ASN  67           QD2      ASN  67 -18.862   1.002   7.733
  709    H    VAL  68           HN       VAL  68 -17.016  -1.922   6.761
  710    HA   VAL  68           HA       VAL  68 -16.698  -1.507   3.826
  711    HB   VAL  68           HB       VAL  68 -17.832  -3.829   5.442
  712   1HG1  VAL  68          2HG1      VAL  68 -18.839  -3.611   3.137
  713   2HG1  VAL  68          3HG1      VAL  68 -17.203  -3.690   2.459
  714   3HG1  VAL  68          1HG1      VAL  68 -17.868  -5.068   3.353
  715   1HG2  VAL  68          3HG2      VAL  68 -15.198  -3.542   3.920
  716   2HG2  VAL  68          1HG2      VAL  68 -15.363  -3.618   5.683
  717   3HG2  VAL  68          2HG2      VAL  68 -15.786  -5.021   4.700
  718    QG1  VAL  68           QG1      VAL  68 -17.970  -4.123   2.983
  719    QG2  VAL  68           QG2      VAL  68 -15.449  -4.061   4.767
  720    QQG  VAL  68           QQG      VAL  68 -16.709  -4.092   3.875
  721    NH1  ARG  69           NH2      ARG  69 -22.173   4.431   3.523
  722    NH2  ARG  69           NH1      ARG  69 -24.336   5.103   4.029
  723    H    ARG  69           HN       ARG  69 -18.463  -0.706   2.643
  724    HA   ARG  69           HA       ARG  69 -21.130  -0.896   3.397
  725   1HB   ARG  69          2HB       ARG  69 -20.123   0.965   5.019
  726   2HB   ARG  69          3HB       ARG  69 -20.180   1.995   3.609
  727   1HG   ARG  69          2HG       ARG  69 -22.507   0.439   4.864
  728   2HG   ARG  69          3HG       ARG  69 -22.125   2.123   5.171
  729   1HD   ARG  69          2HD       ARG  69 -22.408   2.036   2.351
  730   2HD   ARG  69          3HD       ARG  69 -23.589   0.885   2.918
  731    HE   ARG  69           HE       ARG  69 -24.864   2.647   3.675
  732   1HH1  ARG  69          2HH2      ARG  69 -21.545   3.683   3.252
  733   2HH1  ARG  69          1HH2      ARG  69 -21.804   5.362   3.630
  734   1HH2  ARG  69          2HH1      ARG  69 -25.314   4.888   4.162
  735   2HH2  ARG  69          1HH1      ARG  69 -24.033   6.058   4.150
  736    QB   ARG  69           QB       ARG  69 -20.151   1.480   4.314
  737    QG   ARG  69           QG       ARG  69 -22.316   1.281   5.017
  738    QD   ARG  69           QD       ARG  69 -22.999   1.460   2.634
  739    QH1  ARG  69           QH2      ARG  69 -21.674   4.523   3.440
  740    QH2  ARG  69           QH1      ARG  69 -24.673   5.473   4.156
   
  Start of MODEL          17
 Raw file had 740 H/Q atoms
  Start of MODEL   17
    1    H    SER   1           HN       SER   1  -3.109  11.490   5.069
    2    HA   SER   1           HA       SER   1  -2.859  11.868   2.365
    3   1HB   SER   1          2HB       SER   1  -0.411  11.677   2.761
    4   2HB   SER   1          3HB       SER   1  -1.158  12.523   4.122
    5    HG   SER   1           HG       SER   1   0.318  10.564   4.531
    6    QB   SER   1           QB       SER   1  -0.784  12.100   3.442
    7    H    ILE   2           HN       ILE   2  -1.140  10.395   1.033
    8    HA   ILE   2           HA       ILE   2  -2.005   7.809   0.437
    9    HB   ILE   2           HB       ILE   2  -0.703   8.936  -1.101
   10   1HG1  ILE   2          2HG1      ILE   2   1.087   7.515  -1.696
   11   2HG1  ILE   2          3HG1      ILE   2   1.307   6.908  -0.058
   12   1HG2  ILE   2          1HG2      ILE   2   0.962   9.790   1.203
   13   2HG2  ILE   2          2HG2      ILE   2   1.880   9.270  -0.197
   14   3HG2  ILE   2          3HG2      ILE   2   0.618  10.538  -0.325
   15   1HD1  ILE   2          1HD1      ILE   2  -1.353   6.496  -1.459
   16   2HD1  ILE   2          2HD1      ILE   2   0.033   5.481  -1.868
   17   3HD1  ILE   2          3HD1      ILE   2  -0.569   5.499  -0.212
   18    QG1  ILE   2           QG1      ILE   2   1.198   7.211  -0.877
   19    QG2  ILE   2           QG2      ILE   2   1.154   9.866   0.227
   20    QD1  ILE   2           QD1      ILE   2  -0.630   5.825  -1.180
   21    H    SER   3           HN       SER   3   1.095   8.445   2.358
   22    HA   SER   3           HA       SER   3   1.384   5.837   3.138
   23   1HB   SER   3          2HB       SER   3   2.836   6.690   4.873
   24   2HB   SER   3          3HB       SER   3   2.987   7.782   3.497
   25    HG   SER   3           HG       SER   3   2.032   8.320   5.963
   26    QB   SER   3           QB       SER   3   2.912   7.236   4.186
   27    H    SER   4           HN       SER   4  -0.670   8.346   4.612
   28    HA   SER   4           HA       SER   4  -1.400   6.856   6.869
   29   1HB   SER   4          2HB       SER   4  -2.073   9.306   6.004
   30   2HB   SER   4          3HB       SER   4  -3.588   8.427   5.613
   31    HG   SER   4           HG       SER   4  -3.476   7.734   7.876
   32    QB   SER   4           QB       SER   4  -2.830   8.867   5.808
   33    NH1  ARG   5           NH2      ARG   5  -4.861   9.667   0.224
   34    NH2  ARG   5           NH1      ARG   5  -3.822   9.061  -1.759
   35    H    ARG   5           HN       ARG   5  -2.709   6.573   3.490
   36    HA   ARG   5           HA       ARG   5  -4.953   4.935   4.373
   37   1HB   ARG   5          2HB       ARG   5  -4.002   4.736   1.528
   38   2HB   ARG   5          3HB       ARG   5  -5.612   4.803   2.225
   39   1HG   ARG   5          2HG       ARG   5  -5.127   7.244   2.812
   40   2HG   ARG   5          3HG       ARG   5  -3.710   7.050   1.736
   41   1HD   ARG   5          2HD       ARG   5  -6.060   6.002   0.431
   42   2HD   ARG   5          3HD       ARG   5  -6.407   7.618   1.012
   43    HE   ARG   5           HE       ARG   5  -4.575   6.751  -1.123
   44   1HH1  ARG   5          2HH2      ARG   5  -5.384   9.383   1.037
   45   2HH1  ARG   5          1HH2      ARG   5  -4.762  10.648   0.011
   46   1HH2  ARG   5          2HH1      ARG   5  -3.650   8.371  -2.479
   47   2HH2  ARG   5          1HH1      ARG   5  -3.593  10.020  -1.963
   48    QB   ARG   5           QB       ARG   5  -4.807   4.769   1.877
   49    QG   ARG   5           QG       ARG   5  -4.418   7.147   2.275
   50    QD   ARG   5           QD       ARG   5  -6.234   6.810   0.722
   51    QH1  ARG   5           QH2      ARG   5  -5.073  10.015   0.524
   52    QH2  ARG   5           QH1      ARG   5  -3.622   9.196  -2.221
   53    H    VAL   6           HN       VAL   6  -1.941   4.331   2.650
   54    HA   VAL   6           HA       VAL   6  -1.906   1.502   2.575
   55    HB   VAL   6           HB       VAL   6   0.063   3.772   2.419
   56   1HG1  VAL   6          1HG1      VAL   6   0.829   0.910   2.866
   57   2HG1  VAL   6          2HG1      VAL   6   1.904   2.068   2.042
   58   3HG1  VAL   6          3HG1      VAL   6   1.388   2.395   3.706
   59   1HG2  VAL   6          1HG2      VAL   6  -1.334   2.593   0.473
   60   2HG2  VAL   6          2HG2      VAL   6   0.359   3.070   0.223
   61   3HG2  VAL   6          3HG2      VAL   6  -0.026   1.392   0.610
   62    QG1  VAL   6           QG1      VAL   6   1.373   1.791   2.871
   63    QG2  VAL   6           QG2      VAL   6  -0.334   2.352   0.435
   64    QQG  VAL   6           QQG      VAL   6   0.520   2.072   1.653
   65    H    LYS   7           HN       LYS   7  -0.418   3.641   5.088
   66    HA   LYS   7           HA       LYS   7   0.332   1.431   6.687
   67   1HB   LYS   7          2HB       LYS   7   1.362   3.706   6.639
   68   2HB   LYS   7          3HB       LYS   7   0.029   4.311   7.618
   69   1HG   LYS   7          2HG       LYS   7   0.780   3.287   9.521
   70   2HG   LYS   7          3HG       LYS   7   1.312   1.831   8.675
   71   1HD   LYS   7          2HD       LYS   7   3.290   3.313   7.771
   72   2HD   LYS   7          3HD       LYS   7   2.760   4.484   8.969
   73   1HE   LYS   7          2HE       LYS   7   4.433   3.314  10.121
   74   2HE   LYS   7          3HE       LYS   7   2.953   2.523  10.695
   75   1HZ   LYS   7          3HZ       LYS   7   3.417   0.837   8.932
   76   2HZ   LYS   7          1HZ       LYS   7   4.897   1.561   8.714
   77   3HZ   LYS   7          2HZ       LYS   7   4.528   0.889  10.149
   78    QB   LYS   7           QB       LYS   7   0.696   4.008   7.129
   79    QG   LYS   7           QG       LYS   7   1.046   2.559   9.098
   80    QD   LYS   7           QD       LYS   7   3.025   3.899   8.370
   81    QE   LYS   7           QE       LYS   7   3.692   2.918  10.408
   82    QZ   LYS   7           QZ       LYS   7   4.281   1.095   9.265
   83    H    SER   8           HN       SER   8  -2.479   3.660   6.885
   84    HA   SER   8           HA       SER   8  -3.677   2.760   9.261
   85   1HB   SER   8          2HB       SER   8  -5.012   3.523   6.621
   86   2HB   SER   8          3HB       SER   8  -5.911   3.090   8.073
   87    HG   SER   8           HG       SER   8  -4.105   5.220   7.780
   88    QB   SER   8           QB       SER   8  -5.461   3.306   7.347
   89    H    LYS   9           HN       LYS   9  -3.821   1.273   5.913
   90    HA   LYS   9           HA       LYS   9  -5.635  -0.660   6.912
   91   1HB   LYS   9          2HB       LYS   9  -4.855   0.270   4.417
   92   2HB   LYS   9          3HB       LYS   9  -4.099  -1.290   4.463
   93   1HG   LYS   9          2HG       LYS   9  -7.039  -0.515   4.769
   94   2HG   LYS   9          3HG       LYS   9  -6.300  -1.459   3.479
   95   1HD   LYS   9          2HD       LYS   9  -5.723  -3.156   5.461
   96   2HD   LYS   9          3HD       LYS   9  -6.901  -2.265   6.379
   97   1HE   LYS   9          2HE       LYS   9  -7.876  -4.278   5.433
   98   2HE   LYS   9          3HE       LYS   9  -8.709  -2.798   4.925
   99   1HZ   LYS   9          3HZ       LYS   9  -6.801  -4.358   3.282
  100   2HZ   LYS   9          1HZ       LYS   9  -8.385  -4.370   3.119
  101   3HZ   LYS   9          2HZ       LYS   9  -7.578  -2.973   2.814
  102    QB   LYS   9           QB       LYS   9  -4.476  -0.510   4.440
  103    QG   LYS   9           QG       LYS   9  -6.669  -0.987   4.124
  104    QD   LYS   9           QD       LYS   9  -6.312  -2.711   5.920
  105    QE   LYS   9           QE       LYS   9  -8.292  -3.538   5.180
  106    QZ   LYS   9           QZ       LYS   9  -7.588  -3.901   3.072
  107    NH1  ARG  10           NH2      ARG  10   2.444  -0.861   3.620
  108    NH2  ARG  10           NH1      ARG  10   3.084   1.026   4.771
  109    H    ARG  10           HN       ARG  10  -2.132  -0.584   6.332
  110    HA   ARG  10           HA       ARG  10  -1.364  -3.174   7.021
  111   1HB   ARG  10          2HB       ARG  10  -0.048  -1.027   6.285
  112   2HB   ARG  10          3HB       ARG  10   0.142  -0.720   8.010
  113   1HG   ARG  10          2HG       ARG  10   1.802  -2.205   8.188
  114   2HG   ARG  10          3HG       ARG  10   0.858  -3.485   7.405
  115   1HD   ARG  10          2HD       ARG  10   2.824  -2.999   6.076
  116   2HD   ARG  10          3HD       ARG  10   1.356  -2.528   5.222
  117    HE   ARG  10           HE       ARG  10   3.047  -0.576   6.751
  118   1HH1  ARG  10          2HH2      ARG  10   2.228  -1.844   3.619
  119   2HH1  ARG  10          1HH2      ARG  10   2.504  -0.374   2.736
  120   1HH2  ARG  10          2HH1      ARG  10   3.225   1.669   5.556
  121   2HH2  ARG  10          1HH1      ARG  10   3.229   1.531   3.911
  122    QB   ARG  10           QB       ARG  10   0.047  -0.873   7.148
  123    QG   ARG  10           QG       ARG  10   1.330  -2.845   7.796
  124    QD   ARG  10           QD       ARG  10   2.089  -2.764   5.650
  125    QH1  ARG  10           QH2      ARG  10   2.366  -1.108   3.178
  126    QH2  ARG  10           QH1      ARG  10   3.226   1.600   4.733
  127    H    ILE  11           HN       ILE  11  -2.016  -0.412   9.182
  128    HA   ILE  11           HA       ILE  11  -1.501  -1.749  11.647
  129    HB   ILE  11           HB       ILE  11  -2.584   0.878  10.746
  130   1HG1  ILE  11          2HG1      ILE  11  -1.526   1.351  13.155
  131   2HG1  ILE  11          3HG1      ILE  11  -0.736  -0.190  12.882
  132   1HG2  ILE  11          2HG2      ILE  11  -3.726  -0.218  13.325
  133   2HG2  ILE  11          3HG2      ILE  11  -3.692   1.490  12.855
  134   3HG2  ILE  11          1HG2      ILE  11  -4.617   0.368  11.897
  135   1HD1  ILE  11          1HD1      ILE  11  -0.009   0.782  10.596
  136   2HD1  ILE  11          2HD1      ILE  11  -0.613   2.341  11.210
  137   3HD1  ILE  11          3HD1      ILE  11   0.723   1.519  12.038
  138    QG1  ILE  11           QG1      ILE  11  -1.131   0.580  13.018
  139    QG2  ILE  11           QG2      ILE  11  -4.012   0.547  12.693
  140    QD1  ILE  11           QD1      ILE  11   0.034   1.547  11.281
  141    H    GLN  12           HN       GLN  12  -4.544  -1.015   9.977
  142    HA   GLN  12           HA       GLN  12  -6.247  -2.283  11.769
  143   1HB   GLN  12          2HB       GLN  12  -6.614  -0.973   9.408
  144   2HB   GLN  12          3HB       GLN  12  -6.973  -2.622   8.880
  145   1HG   GLN  12          2HG       GLN  12  -8.661  -2.805  10.706
  146   2HG   GLN  12          3HG       GLN  12  -8.248  -1.172  11.255
  147   1HE2  GLN  12          2HE2      GLN  12  -9.781   0.457   8.396
  148   2HE2  GLN  12          1HE2      GLN  12  -8.332   0.561   9.385
  149    QB   GLN  12           QB       GLN  12  -6.794  -1.798   9.144
  150    QG   GLN  12           QG       GLN  12  -8.455  -1.989  10.981
  151    QE2  GLN  12           QE2      GLN  12  -9.056   0.508   8.890
  152    H    LEU  13           HN       LEU  13  -4.393  -3.749   9.128
  153    HA   LEU  13           HA       LEU  13  -5.231  -6.484   9.674
  154   1HB   LEU  13          2HB       LEU  13  -3.203  -5.050   8.007
  155   2HB   LEU  13          3HB       LEU  13  -2.761  -6.662   8.493
  156    HG   LEU  13           HG       LEU  13  -5.553  -6.609   7.559
  157   1HD1  LEU  13          2HD1      LEU  13  -3.640  -5.144   5.928
  158   2HD1  LEU  13          3HD1      LEU  13  -4.289  -6.556   5.076
  159   3HD1  LEU  13          1HD1      LEU  13  -5.398  -5.368   5.773
  160   1HD2  LEU  13          1HD2      LEU  13  -4.036  -8.609   7.969
  161   2HD2  LEU  13          2HD2      LEU  13  -4.911  -8.595   6.434
  162   3HD2  LEU  13          3HD2      LEU  13  -3.196  -8.166   6.470
  163    QB   LEU  13           QB       LEU  13  -2.981  -5.855   8.249
  164    QD1  LEU  13           QD1      LEU  13  -4.442  -5.690   5.592
  165    QD2  LEU  13           QD2      LEU  13  -4.047  -8.456   6.958
  166    QQD  LEU  13           QQD      LEU  13  -4.245  -7.073   6.275
  167    H    GLY  14           HN       GLY  14  -2.533  -4.460  10.826
  168   1HA   GLY  14          1HA       GLY  14  -1.460  -4.690  12.887
  169   2HA   GLY  14          2HA       GLY  14  -2.118  -6.319  13.091
  170    QA   GLY  14           QA       GLY  14  -1.789  -5.504  12.989
  171    H    LEU  15           HN       LEU  15  -0.449  -5.041  10.208
  172    HA   LEU  15           HA       LEU  15   1.878  -6.882  10.726
  173   1HB   LEU  15          2HB       LEU  15   0.471  -6.247   8.125
  174   2HB   LEU  15          3HB       LEU  15   2.000  -7.101   8.235
  175    HG   LEU  15           HG       LEU  15  -0.122  -8.279   9.959
  176   1HD1  LEU  15          3HD1      LEU  15  -1.068  -7.566   7.437
  177   2HD1  LEU  15          1HD1      LEU  15  -0.563  -9.244   7.239
  178   3HD1  LEU  15          2HD1      LEU  15  -1.692  -8.828   8.522
  179   1HD2  LEU  15          3HD2      LEU  15   1.874  -9.397   7.984
  180   2HD2  LEU  15          1HD2      LEU  15   1.942  -9.479   9.752
  181   3HD2  LEU  15          2HD2      LEU  15   0.720 -10.391   8.863
  182    QB   LEU  15           QB       LEU  15   1.236  -6.674   8.180
  183    QD1  LEU  15           QD1      LEU  15  -1.108  -8.546   7.733
  184    QD2  LEU  15           QD2      LEU  15   1.512  -9.756   8.866
  185    QQD  LEU  15           QQD      LEU  15   0.202  -9.151   8.299
  186    H    ASN  16           HN       ASN  16   3.799  -6.102   9.433
  187    HA   ASN  16           HA       ASN  16   4.008  -3.127   9.662
  188   1HB   ASN  16          2HB       ASN  16   6.305  -3.356  10.064
  189   2HB   ASN  16          3HB       ASN  16   5.545  -4.570  11.092
  190   1HD2  ASN  16          2HD2      ASN  16   6.832  -7.354   9.187
  191   2HD2  ASN  16          1HD2      ASN  16   5.644  -6.826  10.357
  192    QB   ASN  16           QB       ASN  16   5.925  -3.963  10.578
  193    QD2  ASN  16           QD2      ASN  16   6.238  -7.090   9.772
  194    H    GLN  17           HN       GLN  17   5.852  -2.368   8.173
  195    HA   GLN  17           HA       GLN  17   4.897  -2.359   5.485
  196   1HB   GLN  17          2HB       GLN  17   7.268  -1.325   6.978
  197   2HB   GLN  17          3HB       GLN  17   7.248  -1.235   5.192
  198   1HG   GLN  17          2HG       GLN  17   5.390   0.166   5.200
  199   2HG   GLN  17          3HG       GLN  17   4.934  -0.287   6.860
  200   1HE2  GLN  17          2HE2      GLN  17   7.196   2.993   6.284
  201   2HE2  GLN  17          1HE2      GLN  17   6.717   2.064   4.920
  202    QB   GLN  17           QB       GLN  17   7.258  -1.280   6.085
  203    QG   GLN  17           QG       GLN  17   5.162  -0.060   6.029
  204    QE2  GLN  17           QE2      GLN  17   6.957   2.528   5.602
  205    H    ALA  18           HN       ALA  18   7.782  -4.036   6.888
  206    HA   ALA  18           HA       ALA  18   8.706  -5.136   4.437
  207   1HB   ALA  18          2HB       ALA  18   9.953  -4.985   6.639
  208   2HB   ALA  18          3HB       ALA  18   9.019  -6.398   7.179
  209   3HB   ALA  18          1HB       ALA  18  10.080  -6.529   5.772
  210    QB   ALA  18           QB       ALA  18   9.684  -5.970   6.529
  211    H    GLU  19           HN       GLU  19   6.544  -6.427   6.966
  212    HA   GLU  19           HA       GLU  19   5.898  -8.931   5.823
  213   1HB   GLU  19          2HB       GLU  19   4.640  -7.069   7.766
  214   2HB   GLU  19          3HB       GLU  19   3.509  -8.097   6.910
  215   1HG   GLU  19          2HG       GLU  19   5.989  -9.314   8.152
  216   2HG   GLU  19          3HG       GLU  19   4.520  -9.024   9.093
  217    QB   GLU  19           QB       GLU  19   4.075  -7.583   7.337
  218    QG   GLU  19           QG       GLU  19   5.255  -9.169   8.623
  219    H    LEU  20           HN       LEU  20   4.299  -5.750   5.422
  220    HA   LEU  20           HA       LEU  20   2.415  -6.815   3.587
  221   1HB   LEU  20          2HB       LEU  20   2.252  -4.767   5.000
  222   2HB   LEU  20          3HB       LEU  20   3.188  -3.892   3.775
  223    HG   LEU  20           HG       LEU  20   1.071  -5.465   2.533
  224   1HD1  LEU  20          2HD1      LEU  20   0.115  -5.009   5.003
  225   2HD1  LEU  20          3HD1      LEU  20  -0.360  -3.479   4.250
  226   3HD1  LEU  20          1HD1      LEU  20  -0.867  -5.022   3.555
  227   1HD2  LEU  20          3HD2      LEU  20   2.268  -3.142   1.896
  228   2HD2  LEU  20          1HD2      LEU  20   0.789  -3.795   1.224
  229   3HD2  LEU  20          2HD2      LEU  20   0.682  -2.556   2.476
  230    QB   LEU  20           QB       LEU  20   2.720  -4.328   4.387
  231    QD1  LEU  20           QD1      LEU  20  -0.371  -4.503   4.269
  232    QD2  LEU  20           QD2      LEU  20   1.247  -3.165   1.865
  233    QQD  LEU  20           QQD      LEU  20   0.438  -3.834   3.068
  234    H    ALA  21           HN       ALA  21   5.626  -5.438   3.130
  235    HA   ALA  21           HA       ALA  21   5.626  -5.248   0.292
  236   1HB   ALA  21          1HB       ALA  21   7.625  -5.224   2.465
  237   2HB   ALA  21          2HB       ALA  21   8.225  -5.915   0.952
  238   3HB   ALA  21          3HB       ALA  21   7.510  -4.291   0.979
  239    QB   ALA  21           QB       ALA  21   7.786  -5.144   1.465
  240    H    GLN  22           HN       GLN  22   6.534  -8.020   2.449
  241    HA   GLN  22           HA       GLN  22   7.066  -9.728   0.175
  242   1HB   GLN  22          2HB       GLN  22   6.924 -11.638   1.649
  243   2HB   GLN  22          3HB       GLN  22   7.978 -10.380   2.305
  244   1HG   GLN  22          2HG       GLN  22   6.462  -9.792   3.966
  245   2HG   GLN  22          3HG       GLN  22   5.090 -10.634   3.208
  246   1HE2  GLN  22          2HE2      GLN  22   5.593 -13.646   4.835
  247   2HE2  GLN  22          1HE2      GLN  22   4.622 -12.706   3.719
  248    QB   GLN  22           QB       GLN  22   7.452 -11.009   1.977
  249    QG   GLN  22           QG       GLN  22   5.777 -10.213   3.587
  250    QE2  GLN  22           QE2      GLN  22   5.108 -13.177   4.277
  251    H    LYS  23           HN       LYS  23   4.106  -8.997   2.013
  252    HA   LYS  23           HA       LYS  23   2.537 -11.001   0.694
  253   1HB   LYS  23          2HB       LYS  23   1.186 -10.550   2.338
  254   2HB   LYS  23          3HB       LYS  23   2.256  -9.233   2.851
  255   1HG   LYS  23          2HG       LYS  23   0.975  -7.700   1.331
  256   2HG   LYS  23          3HG       LYS  23  -0.158  -9.044   1.060
  257   1HD   LYS  23          2HD       LYS  23   0.250  -7.305   3.490
  258   2HD   LYS  23          3HD       LYS  23  -1.220  -7.805   2.686
  259   1HE   LYS  23          2HE       LYS  23  -1.199  -8.806   4.810
  260   2HE   LYS  23          3HE       LYS  23  -0.900 -10.120   3.672
  261   1HZ   LYS  23          3HZ       LYS  23   1.327  -8.730   5.044
  262   2HZ   LYS  23          1HZ       LYS  23   0.540  -9.965   5.773
  263   3HZ   LYS  23          2HZ       LYS  23   1.339 -10.217   4.383
  264    QB   LYS  23           QB       LYS  23   1.721  -9.891   2.595
  265    QG   LYS  23           QG       LYS  23   0.409  -8.372   1.196
  266    QD   LYS  23           QD       LYS  23  -0.484  -7.555   3.089
  267    QE   LYS  23           QE       LYS  23  -1.050  -9.462   4.241
  268    QZ   LYS  23           QZ       LYS  23   1.069  -9.638   5.067
  269    H    VAL  24           HN       VAL  24   3.260  -7.651  -0.094
  270    HA   VAL  24           HA       VAL  24   1.499  -7.447  -2.400
  271    HB   VAL  24           HB       VAL  24   3.898  -5.899  -1.359
  272   1HG1  VAL  24          1HG1      VAL  24   2.157  -5.225  -3.755
  273   2HG1  VAL  24          2HG1      VAL  24   3.337  -4.138  -3.007
  274   3HG1  VAL  24          3HG1      VAL  24   3.888  -5.608  -3.825
  275   1HG2  VAL  24          3HG2      VAL  24   1.527  -5.777  -0.233
  276   2HG2  VAL  24          1HG2      VAL  24   2.331  -4.257  -0.683
  277   3HG2  VAL  24          2HG2      VAL  24   1.054  -4.941  -1.704
  278    QG1  VAL  24           QG1      VAL  24   3.127  -4.990  -3.529
  279    QG2  VAL  24           QG2      VAL  24   1.637  -4.992  -0.873
  280    QQG  VAL  24           QQG      VAL  24   2.382  -4.991  -2.201
  281    H    GLY  25           HN       GLY  25   4.868  -8.492  -1.798
  282   1HA   GLY  25          1HA       GLY  25   6.115  -9.929  -3.185
  283   2HA   GLY  25          2HA       GLY  25   4.993  -9.672  -4.528
  284    QA   GLY  25           QA       GLY  25   5.554  -9.799  -3.856
  285    H    THR  26           HN       THR  26   6.490  -7.219  -2.426
  286    HA   THR  26           HA       THR  26   8.432  -6.477  -4.510
  287    HB   THR  26           HB       THR  26   6.509  -4.992  -4.954
  288    HG1  THR  26          1HG       THR  26   7.902  -3.000  -4.569
  289   1HG2  THR  26          1HG2      THR  26   5.709  -4.883  -2.514
  290   2HG2  THR  26          2HG2      THR  26   6.989  -3.708  -2.230
  291   3HG2  THR  26          3HG2      THR  26   5.718  -3.356  -3.414
  292    QG2  THR  26           QG2      THR  26   6.139  -3.982  -2.720
  293    H    THR  27           HN       THR  27   9.078  -4.106  -2.883
  294    HA   THR  27           HA       THR  27  10.330  -5.402  -0.490
  295    HB   THR  27           HB       THR  27  12.252  -3.747  -1.099
  296    HG1  THR  27          1HG       THR  27  10.946  -3.970  -3.616
  297   1HG2  THR  27          1HG2      THR  27  11.658  -6.231  -2.770
  298   2HG2  THR  27          2HG2      THR  27  13.220  -5.389  -2.747
  299   3HG2  THR  27          3HG2      THR  27  12.591  -6.131  -1.264
  300    QG2  THR  27           QG2      THR  27  12.490  -5.918  -2.260
  301    H    GLN  28           HN       GLN  28  10.453  -4.089   1.327
  302    HA   GLN  28           HA       GLN  28   8.492  -2.225   1.878
  303   1HB   GLN  28          2HB       GLN  28   9.716  -3.178   3.657
  304   2HB   GLN  28          3HB       GLN  28  11.267  -2.570   3.047
  305   1HG   GLN  28          2HG       GLN  28  10.645  -0.263   3.595
  306   2HG   GLN  28          3HG       GLN  28   8.998  -0.758   3.983
  307   1HE2  GLN  28          2HE2      GLN  28  12.099  -1.706   6.573
  308   2HE2  GLN  28          1HE2      GLN  28  12.419  -1.538   4.855
  309    QB   GLN  28           QB       GLN  28  10.492  -2.874   3.352
  310    QG   GLN  28           QG       GLN  28   9.822  -0.510   3.790
  311    QE2  GLN  28           QE2      GLN  28  12.259  -1.622   5.713
  312    H    GLN  29           HN       GLN  29  11.668  -1.615   0.390
  313    HA   GLN  29           HA       GLN  29  11.747   1.141   0.463
  314   1HB   GLN  29          2HB       GLN  29  13.106  -0.928  -0.934
  315   2HB   GLN  29          3HB       GLN  29  12.454   0.090  -2.216
  316   1HG   GLN  29          2HG       GLN  29  14.690   0.833  -1.575
  317   2HG   GLN  29          3HG       GLN  29  13.505   2.079  -1.151
  318   1HE2  GLN  29          2HE2      GLN  29  14.395   2.023   2.283
  319   2HE2  GLN  29          1HE2      GLN  29  13.674   2.886   0.958
  320    QB   GLN  29           QB       GLN  29  12.780  -0.419  -1.575
  321    QG   GLN  29           QG       GLN  29  14.097   1.456  -1.364
  322    QE2  GLN  29           QE2      GLN  29  14.034   2.455   1.620
  323    H    SER  30           HN       SER  30   9.811  -0.872  -1.792
  324    HA   SER  30           HA       SER  30   8.846   1.295  -3.368
  325   1HB   SER  30          2HB       SER  30   7.522  -1.382  -2.770
  326   2HB   SER  30          3HB       SER  30   7.179  -0.290  -4.113
  327    HG   SER  30           HG       SER  30   9.591  -0.599  -4.507
  328    QB   SER  30           QB       SER  30   7.350  -0.836  -3.441
  329    H    ILE  31           HN       ILE  31   7.633  -0.293  -0.359
  330    HA   ILE  31           HA       ILE  31   5.222   1.212  -0.235
  331    HB   ILE  31           HB       ILE  31   6.856  -0.343   1.817
  332   1HG1  ILE  31          2HG1      ILE  31   4.945  -1.881   1.654
  333   2HG1  ILE  31          3HG1      ILE  31   4.231  -0.852   0.378
  334   1HG2  ILE  31          2HG2      ILE  31   4.159   1.011   2.085
  335   2HG2  ILE  31          3HG2      ILE  31   4.861  -0.213   3.178
  336   3HG2  ILE  31          1HG2      ILE  31   5.627   1.370   3.031
  337   1HD1  ILE  31          1HD1      ILE  31   6.888  -2.243   0.101
  338   2HD1  ILE  31          2HD1      ILE  31   5.347  -3.005  -0.331
  339   3HD1  ILE  31          3HD1      ILE  31   5.857  -1.559  -1.191
  340    QG1  ILE  31           QG1      ILE  31   4.588  -1.367   1.016
  341    QG2  ILE  31           QG2      ILE  31   4.883   0.723   2.765
  342    QD1  ILE  31           QD1      ILE  31   6.030  -2.269  -0.474
  343    H    GLU  32           HN       GLU  32   8.358   1.623   1.523
  344    HA   GLU  32           HA       GLU  32   7.689   3.995   2.860
  345   1HB   GLU  32          2HB       GLU  32   9.633   2.750   3.458
  346   2HB   GLU  32          3HB       GLU  32  10.391   2.984   1.875
  347   1HG   GLU  32          2HG       GLU  32  10.880   5.247   2.298
  348   2HG   GLU  32          3HG       GLU  32   9.638   5.392   3.554
  349    QB   GLU  32           QB       GLU  32  10.012   2.868   2.667
  350    QG   GLU  32           QG       GLU  32  10.259   5.320   2.926
  351    H    GLN  33           HN       GLN  33   9.298   3.655  -0.377
  352    HA   GLN  33           HA       GLN  33   9.422   6.428  -0.841
  353   1HB   GLN  33          2HB       GLN  33   9.804   6.016  -3.123
  354   2HB   GLN  33          3HB       GLN  33  10.585   4.709  -2.194
  355   1HG   GLN  33          2HG       GLN  33   8.658   3.322  -2.668
  356   2HG   GLN  33          3HG       GLN  33   7.961   4.556  -3.733
  357   1HE2  GLN  33          2HE2      GLN  33   9.541   2.968  -6.421
  358   2HE2  GLN  33          1HE2      GLN  33   8.064   3.617  -5.723
  359    QB   GLN  33           QB       GLN  33  10.195   5.363  -2.658
  360    QG   GLN  33           QG       GLN  33   8.310   3.939  -3.200
  361    QE2  GLN  33           QE2      GLN  33   8.803   3.292  -6.072
  362    H    LEU  34           HN       LEU  34   6.812   4.097  -1.739
  363    HA   LEU  34           HA       LEU  34   5.048   5.946  -2.891
  364   1HB   LEU  34          2HB       LEU  34   4.745   3.588  -3.103
  365   2HB   LEU  34          3HB       LEU  34   4.485   3.380  -1.363
  366    HG   LEU  34           HG       LEU  34   2.378   4.687  -1.504
  367   1HD1  LEU  34          3HD1      LEU  34   3.104   4.725  -4.459
  368   2HD1  LEU  34          1HD1      LEU  34   1.468   5.074  -3.860
  369   3HD1  LEU  34          2HD1      LEU  34   2.812   6.131  -3.405
  370   1HD2  LEU  34          2HD2      LEU  34   2.408   2.210  -1.759
  371   2HD2  LEU  34          3HD2      LEU  34   1.060   2.991  -2.609
  372   3HD2  LEU  34          1HD2      LEU  34   2.469   2.433  -3.528
  373    QB   LEU  34           QB       LEU  34   4.615   3.484  -2.233
  374    QD1  LEU  34           QD1      LEU  34   2.462   5.310  -3.908
  375    QD2  LEU  34           QD2      LEU  34   1.979   2.545  -2.632
  376    QQD  LEU  34           QQD      LEU  34   2.220   3.927  -3.270
  377    H    GLU  35           HN       GLU  35   5.291   4.976   0.514
  378    HA   GLU  35           HA       GLU  35   3.212   6.427   1.639
  379   1HB   GLU  35          2HB       GLU  35   5.941   5.598   2.720
  380   2HB   GLU  35          3HB       GLU  35   4.837   6.481   3.700
  381   1HG   GLU  35          2HG       GLU  35   3.098   4.583   3.143
  382   2HG   GLU  35          3HG       GLU  35   4.530   3.674   2.671
  383    QB   GLU  35           QB       GLU  35   5.389   6.039   3.210
  384    QG   GLU  35           QG       GLU  35   3.814   4.128   2.907
  385    H    ASN  36           HN       ASN  36   6.682   7.527   1.335
  386    HA   ASN  36           HA       ASN  36   5.679  10.297   1.782
  387   1HB   ASN  36          2HB       ASN  36   7.719  10.925   2.242
  388   2HB   ASN  36          3HB       ASN  36   7.912   9.205   2.624
  389   1HD2  ASN  36          2HD2      ASN  36   9.580   8.983  -0.832
  390   2HD2  ASN  36          1HD2      ASN  36   8.156   8.218  -0.169
  391    QB   ASN  36           QB       ASN  36   7.815  10.064   2.433
  392    QD2  ASN  36           QD2      ASN  36   8.868   8.601  -0.500
  393    H    GLY  37           HN       GLY  37   5.312   8.480  -0.782
  394   1HA   GLY  37          1HA       GLY  37   6.685  10.099  -2.844
  395   2HA   GLY  37          2HA       GLY  37   5.938   8.502  -3.026
  396    QA   GLY  37           QA       GLY  37   6.312   9.300  -2.935
  397    H    LYS  38           HN       LYS  38   3.528   9.200  -1.653
  398    HA   LYS  38           HA       LYS  38   1.392   9.793  -2.320
  399   1HB   LYS  38          2HB       LYS  38   2.475  12.514  -3.075
  400   2HB   LYS  38          3HB       LYS  38   0.990  12.070  -2.238
  401   1HG   LYS  38          2HG       LYS  38   2.093  12.725  -0.348
  402   2HG   LYS  38          3HG       LYS  38   2.869  11.163  -0.426
  403   1HD   LYS  38          2HD       LYS  38   4.706  12.393  -0.225
  404   2HD   LYS  38          3HD       LYS  38   4.639  12.353  -1.975
  405   1HE   LYS  38          2HE       LYS  38   4.805  14.576  -1.918
  406   2HE   LYS  38          3HE       LYS  38   3.120  14.625  -1.386
  407   1HZ   LYS  38          3HZ       LYS  38   5.459  14.419   0.411
  408   2HZ   LYS  38          1HZ       LYS  38   4.706  15.832   0.049
  409   3HZ   LYS  38          2HZ       LYS  38   3.900  14.661   0.878
  410    QB   LYS  38           QB       LYS  38   1.732  12.292  -2.657
  411    QG   LYS  38           QG       LYS  38   2.482  11.945  -0.387
  412    QD   LYS  38           QD       LYS  38   4.672  12.373  -1.101
  413    QE   LYS  38           QE       LYS  38   3.962  14.601  -1.652
  414    QZ   LYS  38           QZ       LYS  38   4.689  14.971   0.446
  415    H    THR  39           HN       THR  39   2.427   8.240  -4.082
  416    HA   THR  39           HA       THR  39   2.125   9.311  -6.782
  417    HB   THR  39           HB       THR  39   2.601   6.537  -5.678
  418    HG1  THR  39          1HG       THR  39   4.193   8.422  -5.772
  419   1HG2  THR  39          1HG2      THR  39   2.379   7.416  -8.568
  420   2HG2  THR  39          2HG2      THR  39   3.192   5.928  -8.034
  421   3HG2  THR  39          3HG2      THR  39   1.473   6.144  -7.703
  422    QG2  THR  39           QG2      THR  39   2.348   6.497  -8.102
  423    H    LYS  40           HN       LYS  40   0.467   9.117  -8.062
  424    HA   LYS  40           HA       LYS  40  -2.184   8.525  -7.100
  425   1HB   LYS  40          2HB       LYS  40  -2.806   8.899  -9.499
  426   2HB   LYS  40          3HB       LYS  40  -2.064  10.262  -8.661
  427   1HG   LYS  40          2HG       LYS  40  -0.032  10.115  -9.884
  428   2HG   LYS  40          3HG       LYS  40  -0.303   8.440 -10.309
  429   1HD   LYS  40          2HD       LYS  40  -0.736   9.233 -12.304
  430   2HD   LYS  40          3HD       LYS  40  -2.373   9.338 -11.686
  431   1HE   LYS  40          2HE       LYS  40  -0.284  11.582 -11.853
  432   2HE   LYS  40          3HE       LYS  40  -1.658  11.359 -12.940
  433   1HZ   LYS  40          1HZ       LYS  40  -1.862  11.952 -10.063
  434   2HZ   LYS  40          2HZ       LYS  40  -2.093  13.025 -11.288
  435   3HZ   LYS  40          3HZ       LYS  40  -3.131  11.764 -11.097
  436    QB   LYS  40           QB       LYS  40  -2.435   9.581  -9.080
  437    QG   LYS  40           QG       LYS  40  -0.168   9.277 -10.097
  438    QD   LYS  40           QD       LYS  40  -1.555   9.285 -11.995
  439    QE   LYS  40           QE       LYS  40  -0.970  11.470 -12.396
  440    QZ   LYS  40           QZ       LYS  40  -2.362  12.247 -10.816
  441    NH1  ARG  41           NH2      ARG  41  -1.658   1.266 -13.563
  442    NH2  ARG  41           NH1      ARG  41  -1.168   2.479 -15.476
  443    H    ARG  41           HN       ARG  41   0.076   6.808  -9.369
  444    HA   ARG  41           HA       ARG  41  -1.514   4.367  -8.916
  445   1HB   ARG  41          2HB       ARG  41  -2.254   5.619 -11.020
  446   2HB   ARG  41          3HB       ARG  41  -0.722   5.135 -11.736
  447   1HG   ARG  41          2HG       ARG  41  -1.228   2.780 -11.402
  448   2HG   ARG  41          3HG       ARG  41  -2.612   3.145 -10.385
  449   1HD   ARG  41          2HD       ARG  41  -3.695   2.623 -12.361
  450   2HD   ARG  41          3HD       ARG  41  -3.665   4.371 -12.375
  451    HE   ARG  41           HE       ARG  41  -2.399   4.328 -14.275
  452   1HH1  ARG  41          2HH2      ARG  41  -2.072   1.233 -12.643
  453   2HH1  ARG  41          1HH2      ARG  41  -1.186   0.445 -13.911
  454   1HH2  ARG  41          2HH1      ARG  41  -1.220   3.331 -16.015
  455   2HH2  ARG  41          1HH1      ARG  41  -0.694   1.686 -15.880
  456    QB   ARG  41           QB       ARG  41  -1.487   5.377 -11.378
  457    QG   ARG  41           QG       ARG  41  -1.920   2.962 -10.893
  458    QD   ARG  41           QD       ARG  41  -3.679   3.497 -12.368
  459    QH1  ARG  41           QH2      ARG  41  -1.629   0.839 -13.276
  460    QH2  ARG  41           QH1      ARG  41  -0.957   2.508 -15.948
  461    HA   PRO  42           HA       PRO  42   2.992   3.459  -8.628
  462   1HB   PRO  42          2HB       PRO  42   2.747   1.427  -6.739
  463   2HB   PRO  42          3HB       PRO  42   2.916   3.142  -6.349
  464   1HG   PRO  42          2HG       PRO  42   0.480   1.422  -6.386
  465   2HG   PRO  42          3HG       PRO  42   0.841   2.780  -5.290
  466   1HD   PRO  42          2HD       PRO  42  -0.831   2.888  -7.541
  467   2HD   PRO  42          3HD       PRO  42  -0.143   4.304  -6.762
  468    QB   PRO  42           QB       PRO  42   2.832   2.285  -6.544
  469    QG   PRO  42           QG       PRO  42   0.661   2.101  -5.838
  470    QD   PRO  42           QD       PRO  42  -0.487   3.596  -7.151
  471    NH1  ARG  43           NH2      ARG  43   8.151  -4.791 -11.269
  472    NH2  ARG  43           NH1      ARG  43   6.755  -5.916 -12.738
  473    H    ARG  43           HN       ARG  43   4.077   1.246  -8.799
  474    HA   ARG  43           HA       ARG  43   2.962  -0.121 -11.094
  475   1HB   ARG  43          2HB       ARG  43   5.449   0.310 -10.608
  476   2HB   ARG  43          3HB       ARG  43   5.331  -0.910  -9.336
  477   1HG   ARG  43          2HG       ARG  43   4.195  -2.161 -11.601
  478   2HG   ARG  43          3HG       ARG  43   5.513  -1.207 -12.276
  479   1HD   ARG  43          2HD       ARG  43   7.134  -2.306 -10.902
  480   2HD   ARG  43          3HD       ARG  43   5.883  -3.072  -9.887
  481    HE   ARG  43           HE       ARG  43   5.180  -4.034 -12.276
  482   1HH1  ARG  43          2HH2      ARG  43   8.310  -4.022 -10.636
  483   2HH1  ARG  43          1HH2      ARG  43   8.875  -5.486 -11.375
  484   1HH2  ARG  43          2HH1      ARG  43   5.870  -6.000 -13.219
  485   2HH2  ARG  43          1HH1      ARG  43   7.437  -6.649 -12.868
  486    QB   ARG  43           QB       ARG  43   5.391  -0.300  -9.972
  487    QG   ARG  43           QG       ARG  43   4.854  -1.684 -11.938
  488    QD   ARG  43           QD       ARG  43   6.508  -2.689 -10.394
  489    QH1  ARG  43           QH2      ARG  43   8.592  -4.754 -11.006
  490    QH2  ARG  43           QH1      ARG  43   6.653  -6.324 -13.044
  491    H    PHE  44           HN       PHE  44   3.163  -0.710  -7.636
  492    HA   PHE  44           HA       PHE  44   2.033  -3.465  -7.931
  493   1HB   PHE  44          2HB       PHE  44   2.641  -3.611  -5.503
  494   2HB   PHE  44          3HB       PHE  44   3.991  -3.469  -6.605
  495    HD1  PHE  44          1HD       PHE  44   5.258  -1.298  -6.774
  496    HD2  PHE  44          2HD       PHE  44   2.152  -1.915  -3.860
  497    HE1  PHE  44          1HE       PHE  44   5.803   0.879  -5.712
  498    HE2  PHE  44          2HE       PHE  44   2.935   0.061  -2.602
  499    HZ   PHE  44           HZ       PHE  44   4.766   1.465  -3.533
  500    QB   PHE  44           QB       PHE  44   3.316  -3.541  -6.054
  501    QR   PHE  44           QR       PHE  44   4.037  -0.568  -4.737
  502    H    LEU  45           HN       LEU  45   0.528  -0.922  -8.471
  503    HA   LEU  45           HA       LEU  45  -1.168  -0.470  -6.273
  504   1HB   LEU  45          2HB       LEU  45  -0.912   0.824  -8.512
  505   2HB   LEU  45          3HB       LEU  45  -2.133  -0.264  -9.156
  506    HG   LEU  45           HG       LEU  45  -2.791   2.069  -8.294
  507   1HD1  LEU  45          1HD1      LEU  45  -4.261  -0.402  -7.419
  508   2HD1  LEU  45          2HD1      LEU  45  -4.934   1.237  -7.477
  509   3HD1  LEU  45          3HD1      LEU  45  -4.373   0.446  -8.984
  510   1HD2  LEU  45          3HD2      LEU  45  -1.684   1.789  -5.947
  511   2HD2  LEU  45          1HD2      LEU  45  -3.351   2.340  -6.027
  512   3HD2  LEU  45          2HD2      LEU  45  -2.963   0.626  -5.648
  513    QB   LEU  45           QB       LEU  45  -1.523   0.280  -8.834
  514    QD1  LEU  45           QD1      LEU  45  -4.523   0.427  -7.960
  515    QD2  LEU  45           QD2      LEU  45  -2.666   1.585  -5.874
  516    QQD  LEU  45           QQD      LEU  45  -3.595   1.006  -6.917
  517    HA   PRO  46           HA       PRO  46  -4.076  -3.879  -7.932
  518   1HB   PRO  46          2HB       PRO  46  -2.954  -5.948  -9.416
  519   2HB   PRO  46          3HB       PRO  46  -3.848  -4.559 -10.087
  520   1HG   PRO  46          2HG       PRO  46  -0.918  -5.071 -10.085
  521   2HG   PRO  46          3HG       PRO  46  -1.889  -4.089 -11.212
  522   1HD   PRO  46          2HD       PRO  46  -0.277  -3.194  -9.106
  523   2HD   PRO  46          3HD       PRO  46  -1.443  -2.189 -10.000
  524    QB   PRO  46           QB       PRO  46  -3.401  -5.254  -9.752
  525    QG   PRO  46           QG       PRO  46  -1.403  -4.580 -10.648
  526    QD   PRO  46           QD       PRO  46  -0.860  -2.692  -9.553
  527    H    GLU  47           HN       GLU  47  -0.656  -4.941  -7.611
  528    HA   GLU  47           HA       GLU  47  -1.090  -7.188  -6.023
  529   1HB   GLU  47          2HB       GLU  47   1.235  -5.245  -5.806
  530   2HB   GLU  47          3HB       GLU  47   1.210  -6.960  -5.366
  531   1HG   GLU  47          2HG       GLU  47   1.062  -5.790  -8.183
  532   2HG   GLU  47          3HG       GLU  47   2.384  -6.703  -7.456
  533    QB   GLU  47           QB       GLU  47   1.222  -6.102  -5.586
  534    QG   GLU  47           QG       GLU  47   1.723  -6.246  -7.819
  535    H    LEU  48           HN       LEU  48  -0.671  -3.781  -5.011
  536    HA   LEU  48           HA       LEU  48  -0.921  -4.316  -2.213
  537   1HB   LEU  48          2HB       LEU  48   0.184  -2.342  -3.142
  538   2HB   LEU  48          3HB       LEU  48  -1.358  -1.755  -3.764
  539    HG   LEU  48           HG       LEU  48  -2.139  -1.697  -1.316
  540   1HD1  LEU  48          3HD1      LEU  48   0.826  -2.176  -0.799
  541   2HD1  LEU  48          1HD1      LEU  48  -0.363  -1.646   0.404
  542   3HD1  LEU  48          2HD1      LEU  48  -0.527  -3.241  -0.354
  543   1HD2  LEU  48          3HD2      LEU  48  -1.198   0.312  -2.631
  544   2HD2  LEU  48          1HD2      LEU  48  -1.166   0.381  -0.870
  545   3HD2  LEU  48          2HD2      LEU  48   0.325   0.017  -1.772
  546    QB   LEU  48           QB       LEU  48  -0.587  -2.049  -3.453
  547    QD1  LEU  48           QD1      LEU  48  -0.021  -2.354  -0.250
  548    QD2  LEU  48           QD2      LEU  48  -0.680   0.237  -1.758
  549    QQD  LEU  48           QQD      LEU  48  -0.350  -1.058  -1.004
  550    H    ALA  49           HN       ALA  49  -3.273  -3.377  -4.758
  551    HA   ALA  49           HA       ALA  49  -5.536  -3.123  -3.083
  552   1HB   ALA  49          3HB       ALA  49  -5.412  -2.476  -5.498
  553   2HB   ALA  49          1HB       ALA  49  -5.498  -4.193  -5.932
  554   3HB   ALA  49          2HB       ALA  49  -6.846  -3.419  -5.095
  555    QB   ALA  49           QB       ALA  49  -5.919  -3.363  -5.508
  556    H    SER  50           HN       SER  50  -4.317  -6.047  -4.753
  557    HA   SER  50           HA       SER  50  -6.220  -7.822  -3.572
  558   1HB   SER  50          2HB       SER  50  -3.494  -8.263  -4.867
  559   2HB   SER  50          3HB       SER  50  -4.605  -9.569  -4.410
  560    HG   SER  50           HG       SER  50  -6.195  -8.452  -5.749
  561    QB   SER  50           QB       SER  50  -4.049  -8.916  -4.639
  562    H    ALA  51           HN       ALA  51  -2.810  -7.090  -2.682
  563    HA   ALA  51           HA       ALA  51  -2.494  -8.864  -0.540
  564   1HB   ALA  51          3HB       ALA  51  -1.407  -6.080  -1.073
  565   2HB   ALA  51          1HB       ALA  51  -0.918  -7.004   0.322
  566   3HB   ALA  51          2HB       ALA  51  -0.585  -7.641  -1.307
  567    QB   ALA  51           QB       ALA  51  -0.970  -6.908  -0.686
  568    H    LEU  52           HN       LEU  52  -3.694  -5.475  -0.488
  569    HA   LEU  52           HA       LEU  52  -4.362  -5.714   2.312
  570   1HB   LEU  52          2HB       LEU  52  -4.533  -3.514   0.294
  571   2HB   LEU  52          3HB       LEU  52  -5.757  -3.535   1.524
  572    HG   LEU  52           HG       LEU  52  -4.372  -2.184   2.495
  573   1HD1  LEU  52          1HD1      LEU  52  -4.700  -4.207   3.961
  574   2HD1  LEU  52          2HD1      LEU  52  -3.056  -4.722   3.573
  575   3HD1  LEU  52          3HD1      LEU  52  -3.286  -3.224   4.430
  576   1HD2  LEU  52          1HD2      LEU  52  -2.506  -2.751   0.747
  577   2HD2  LEU  52          2HD2      LEU  52  -2.230  -1.785   2.220
  578   3HD2  LEU  52          3HD2      LEU  52  -1.758  -3.496   2.172
  579    QB   LEU  52           QB       LEU  52  -5.145  -3.525   0.909
  580    QD1  LEU  52           QD1      LEU  52  -3.681  -4.051   3.988
  581    QD2  LEU  52           QD2      LEU  52  -2.165  -2.677   1.713
  582    QQD  LEU  52           QQD      LEU  52  -2.923  -3.364   2.850
  583    H    GLY  53           HN       GLY  53  -6.078  -6.149  -0.745
  584   1HA   GLY  53          1HA       GLY  53  -8.135  -7.034  -1.177
  585   2HA   GLY  53          2HA       GLY  53  -8.433  -7.285   0.551
  586    QA   GLY  53           QA       GLY  53  -8.284  -7.159  -0.313
  587    H    VAL  54           HN       VAL  54  -7.708  -4.481  -1.573
  588    HA   VAL  54           HA       VAL  54 -10.277  -3.186  -0.855
  589    HB   VAL  54           HB       VAL  54  -9.013  -0.930  -0.986
  590   1HG1  VAL  54          3HG1      VAL  54  -8.936  -2.763   1.385
  591   2HG1  VAL  54          1HG1      VAL  54  -8.382  -1.066   1.472
  592   3HG1  VAL  54          2HG1      VAL  54 -10.053  -1.443   1.017
  593   1HG2  VAL  54          2HG2      VAL  54  -6.640  -2.691  -0.306
  594   2HG2  VAL  54          3HG2      VAL  54  -6.876  -1.751  -1.784
  595   3HG2  VAL  54          1HG2      VAL  54  -6.690  -0.925  -0.222
  596    QG1  VAL  54           QG1      VAL  54  -9.124  -1.758   1.291
  597    QG2  VAL  54           QG2      VAL  54  -6.736  -1.789  -0.771
  598    QQG  VAL  54           QQG      VAL  54  -7.930  -1.773   0.260
  599    H    SER  55           HN       SER  55 -10.615  -1.294  -2.446
  600    HA   SER  55           HA       SER  55 -10.494  -2.401  -5.108
  601   1HB   SER  55          2HB       SER  55 -11.934  -0.267  -5.383
  602   2HB   SER  55          3HB       SER  55 -12.550  -1.529  -4.327
  603    HG   SER  55           HG       SER  55 -11.322   0.887  -3.585
  604    QB   SER  55           QB       SER  55 -12.242  -0.897  -4.855
  605    H    VAL  56           HN       VAL  56  -9.253  -1.663  -6.759
  606    HA   VAL  56           HA       VAL  56  -6.853  -0.154  -6.439
  607    HB   VAL  56           HB       VAL  56  -8.614  -1.054  -8.759
  608   1HG1  VAL  56          3HG1      VAL  56  -6.481   1.021  -9.004
  609   2HG1  VAL  56          1HG1      VAL  56  -6.666  -0.193 -10.273
  610   3HG1  VAL  56          2HG1      VAL  56  -8.020   0.848  -9.830
  611   1HG2  VAL  56          3HG2      VAL  56  -5.905  -1.791  -7.644
  612   2HG2  VAL  56          1HG2      VAL  56  -7.304  -2.807  -7.975
  613   3HG2  VAL  56          2HG2      VAL  56  -6.321  -2.188  -9.309
  614    QG1  VAL  56           QG1      VAL  56  -7.056   0.559  -9.702
  615    QG2  VAL  56           QG2      VAL  56  -6.510  -2.262  -8.309
  616    QQG  VAL  56           QQG      VAL  56  -6.782  -0.852  -9.005
  617    H    ASP  57           HN       ASP  57 -10.132   1.028  -7.520
  618    HA   ASP  57           HA       ASP  57  -9.409   3.709  -7.966
  619   1HB   ASP  57          2HB       ASP  57 -11.816   4.131  -7.166
  620   2HB   ASP  57          3HB       ASP  57 -11.542   3.073  -8.564
  621    QB   ASP  57           QB       ASP  57 -11.679   3.602  -7.865
  622    CH2  TRP  58           CH2      TRP  58  -7.111   2.795   2.348
  623    H    TRP  58           HN       TRP  58 -10.062   1.994  -4.884
  624    HA   TRP  58           HA       TRP  58  -9.995   4.458  -3.328
  625   1HB   TRP  58          2HB       TRP  58 -11.095   2.438  -2.435
  626   2HB   TRP  58          3HB       TRP  58  -9.541   1.603  -2.347
  627    HD1  TRP  58           HD1      TRP  58 -11.442   4.551  -0.888
  628    HE1  TRP  58           HE1      TRP  58 -10.523   5.295   1.290
  629    HE3  TRP  58           HE3      TRP  58  -7.420   1.446  -0.773
  630    HZ2  TRP  58           HZ2      TRP  58  -8.407   4.320   3.168
  631    HZ3  TRP  58           HZ3      TRP  58  -5.939   1.381   1.219
  632    HH2  TRP  58           HH2      TRP  58  -6.446   2.774   3.199
  633    QB   TRP  58           QB       TRP  58 -10.318   2.020  -2.391
  634    H    LEU  59           HN       LEU  59  -7.695   1.738  -3.879
  635    HA   LEU  59           HA       LEU  59  -5.579   3.017  -2.487
  636   1HB   LEU  59          2HB       LEU  59  -5.888   0.767  -4.422
  637   2HB   LEU  59          3HB       LEU  59  -4.306   1.474  -4.330
  638    HG   LEU  59           HG       LEU  59  -5.834   0.272  -2.038
  639   1HD1  LEU  59          1HD1      LEU  59  -4.744  -1.153  -3.810
  640   2HD1  LEU  59          2HD1      LEU  59  -3.190  -0.486  -3.328
  641   3HD1  LEU  59          3HD1      LEU  59  -4.153  -1.433  -2.156
  642   1HD2  LEU  59          2HD2      LEU  59  -3.206   1.806  -2.022
  643   2HD2  LEU  59          3HD2      LEU  59  -4.573   1.961  -0.901
  644   3HD2  LEU  59          1HD2      LEU  59  -3.554   0.539  -0.830
  645    QB   LEU  59           QB       LEU  59  -5.097   1.120  -4.377
  646    QD1  LEU  59           QD1      LEU  59  -4.029  -1.024  -3.098
  647    QD2  LEU  59           QD2      LEU  59  -3.777   1.435  -1.251
  648    QQD  LEU  59           QQD      LEU  59  -3.903   0.206  -2.174
  649    H    LEU  60           HN       LEU  60  -6.681   3.588  -5.756
  650    HA   LEU  60           HA       LEU  60  -4.488   5.220  -6.629
  651   1HB   LEU  60          2HB       LEU  60  -7.336   4.724  -7.454
  652   2HB   LEU  60          3HB       LEU  60  -6.607   6.197  -8.046
  653    HG   LEU  60           HG       LEU  60  -5.103   3.598  -8.311
  654   1HD1  LEU  60          1HD1      LEU  60  -7.411   3.145  -9.169
  655   2HD1  LEU  60          2HD1      LEU  60  -7.225   4.481 -10.309
  656   3HD1  LEU  60          3HD1      LEU  60  -6.153   3.068 -10.411
  657   1HD2  LEU  60          3HD2      LEU  60  -4.693   6.294  -9.153
  658   2HD2  LEU  60          1HD2      LEU  60  -3.784   4.850  -9.602
  659   3HD2  LEU  60          2HD2      LEU  60  -5.120   5.409 -10.619
  660    QB   LEU  60           QB       LEU  60  -6.972   5.460  -7.750
  661    QD1  LEU  60           QD1      LEU  60  -6.930   3.564  -9.963
  662    QD2  LEU  60           QD2      LEU  60  -4.532   5.518  -9.791
  663    QQD  LEU  60           QQD      LEU  60  -5.730   4.541  -9.878
  664    H    ASN  61           HN       ASN  61  -7.785   6.255  -5.639
  665    HA   ASN  61           HA       ASN  61  -6.682   8.974  -5.161
  666   1HB   ASN  61          2HB       ASN  61  -9.115   9.580  -4.827
  667   2HB   ASN  61          3HB       ASN  61  -8.590   9.095  -6.442
  668   1HD2  ASN  61          2HD2      ASN  61 -11.088   6.630  -6.629
  669   2HD2  ASN  61          1HD2      ASN  61 -10.129   7.843  -7.471
  670    QB   ASN  61           QB       ASN  61  -8.852   9.337  -5.634
  671    QD2  ASN  61           QD2      ASN  61 -10.608   7.237  -7.050
  672    H    GLY  62           HN       GLY  62  -8.486   6.534  -3.332
  673   1HA   GLY  62          1HA       GLY  62  -7.743   6.024  -1.048
  674   2HA   GLY  62          2HA       GLY  62  -7.652   7.767  -0.753
  675    QA   GLY  62           QA       GLY  62  -7.698   6.896  -0.900
  676    H    THR  63           HN       THR  63 -10.343   6.774  -2.685
  677    HA   THR  63           HA       THR  63 -12.198   6.892  -0.411
  678    HB   THR  63           HB       THR  63 -13.118   8.874  -1.063
  679    HG1  THR  63          1HG       THR  63 -12.347   8.421  -3.498
  680   1HG2  THR  63          2HG2      THR  63 -10.991   9.353   0.156
  681   2HG2  THR  63          3HG2      THR  63 -10.161   9.521  -1.417
  682   3HG2  THR  63          1HG2      THR  63 -11.438  10.642  -0.970
  683    QG2  THR  63           QG2      THR  63 -10.863   9.839  -0.744
  684    H    SER  64           HN       SER  64 -13.619   5.226  -0.938
  685    HA   SER  64           HA       SER  64 -14.607   5.030  -3.734
  686   1HB   SER  64          2HB       SER  64 -12.921   3.253  -3.444
  687   2HB   SER  64          3HB       SER  64 -13.801   2.641  -2.024
  688    HG   SER  64           HG       SER  64 -14.234   2.320  -4.690
  689    QB   SER  64           QB       SER  64 -13.361   2.947  -2.734
  690    H    ASP  65           HN       ASP  65 -16.713   5.454  -3.597
  691    HA   ASP  65           HA       ASP  65 -18.526   4.124  -1.869
  692   1HB   ASP  65          2HB       ASP  65 -19.318   6.084  -0.618
  693   2HB   ASP  65          3HB       ASP  65 -17.620   5.806  -0.226
  694    QB   ASP  65           QB       ASP  65 -18.470   5.945  -0.422
  695    H    SER  66           HN       SER  66 -20.749   5.115  -2.352
  696    HA   SER  66           HA       SER  66 -22.333   5.408  -3.994
  697   1HB   SER  66          2HB       SER  66 -20.595   7.879  -3.996
  698   2HB   SER  66          3HB       SER  66 -22.004   7.768  -5.065
  699    HG   SER  66           HG       SER  66 -22.485   8.639  -2.971
  700    QB   SER  66           QB       SER  66 -21.300   7.823  -4.531
  701    H    ASN  67           HN       ASN  67 -21.568   3.544  -5.206
  702    HA   ASN  67           HA       ASN  67 -21.286   2.479  -7.147
  703   1HB   ASN  67          2HB       ASN  67 -22.134   5.085  -8.060
  704   2HB   ASN  67          3HB       ASN  67 -20.834   4.555  -9.121
  705   1HD2  ASN  67          2HD2      ASN  67 -24.370   3.361 -10.089
  706   2HD2  ASN  67          1HD2      ASN  67 -23.863   4.882  -9.366
  707    QB   ASN  67           QB       ASN  67 -21.485   4.820  -8.591
  708    QD2  ASN  67           QD2      ASN  67 -24.116   4.121  -9.728
  709    H    VAL  68           HN       VAL  68 -19.389   1.393  -7.210
  710    HA   VAL  68           HA       VAL  68 -16.841   2.658  -6.797
  711    HB   VAL  68           HB       VAL  68 -17.532  -0.104  -7.861
  712   1HG1  VAL  68          2HG1      VAL  68 -15.086   0.785  -8.252
  713   2HG1  VAL  68          3HG1      VAL  68 -14.931   0.667  -6.497
  714   3HG1  VAL  68          1HG1      VAL  68 -15.309  -0.772  -7.458
  715   1HG2  VAL  68          1HG2      VAL  68 -16.832   0.818  -5.036
  716   2HG2  VAL  68          2HG2      VAL  68 -18.427   0.253  -5.571
  717   3HG2  VAL  68          3HG2      VAL  68 -17.054  -0.864  -5.554
  718    QG1  VAL  68           QG1      VAL  68 -15.109   0.227  -7.402
  719    QG2  VAL  68           QG2      VAL  68 -17.437   0.069  -5.387
  720    QQG  VAL  68           QQG      VAL  68 -16.273   0.148  -6.394
  721    NH1  ARG  69           NH2      ARG  69 -12.020   7.540 -11.977
  722    NH2  ARG  69           NH1      ARG  69 -13.831   8.678 -11.086
  723    H    ARG  69           HN       ARG  69 -16.862   4.310  -8.369
  724    HA   ARG  69           HA       ARG  69 -16.013   5.327 -10.182
  725   1HB   ARG  69          2HB       ARG  69 -15.064   2.553 -10.962
  726   2HB   ARG  69          3HB       ARG  69 -14.791   3.954 -11.976
  727   1HG   ARG  69          2HG       ARG  69 -13.923   4.167  -9.090
  728   2HG   ARG  69          3HG       ARG  69 -13.052   3.073 -10.167
  729   1HD   ARG  69          2HD       ARG  69 -11.915   5.182 -10.200
  730   2HD   ARG  69          3HD       ARG  69 -12.654   4.858 -11.785
  731    HE   ARG  69           HE       ARG  69 -14.402   6.422 -10.108
  732   1HH1  ARG  69          2HH2      ARG  69 -11.514   6.674 -12.090
  733   2HH1  ARG  69          1HH2      ARG  69 -11.681   8.368 -12.441
  734   1HH2  ARG  69          2HH1      ARG  69 -14.685   8.683 -10.545
  735   2HH2  ARG  69          1HH1      ARG  69 -13.529   9.542 -11.510
  736    QB   ARG  69           QB       ARG  69 -14.927   3.254 -11.469
  737    QG   ARG  69           QG       ARG  69 -13.488   3.620  -9.629
  738    QD   ARG  69           QD       ARG  69 -12.285   5.020 -10.993
  739    QH1  ARG  69           QH2      ARG  69 -11.597   7.521 -12.265
  740    QH2  ARG  69           QH1      ARG  69 -14.107   9.112 -11.027
   
  Start of MODEL          18
 Raw file had 740 H/Q atoms
  Start of MODEL   18
    1    H    SER   1           HN       SER   1  -4.259  10.443   5.192
    2    HA   SER   1           HA       SER   1  -4.132  11.243   2.429
    3   1HB   SER   1          2HB       SER   1  -1.652  11.408   3.063
    4   2HB   SER   1          3HB       SER   1  -2.732  12.262   4.176
    5    HG   SER   1           HG       SER   1  -1.435  10.932   5.446
    6    QB   SER   1           QB       SER   1  -2.192  11.835   3.620
    7    H    ILE   2           HN       ILE   2  -2.181  10.083   1.084
    8    HA   ILE   2           HA       ILE   2  -2.865   7.401   0.543
    9    HB   ILE   2           HB       ILE   2  -0.284   8.940   0.117
   10   1HG1  ILE   2          2HG1      ILE   2  -2.767   9.299  -1.083
   11   2HG1  ILE   2          3HG1      ILE   2  -1.210   9.818  -1.717
   12   1HG2  ILE   2          3HG2      ILE   2  -1.082   6.152  -0.816
   13   2HG2  ILE   2          1HG2      ILE   2   0.203   7.115  -1.575
   14   3HG2  ILE   2          2HG2      ILE   2   0.338   6.634   0.115
   15   1HD1  ILE   2          2HD1      ILE   2  -2.404   7.102  -2.377
   16   2HD1  ILE   2          3HD1      ILE   2  -2.671   8.582  -3.327
   17   3HD1  ILE   2          1HD1      ILE   2  -1.049   7.924  -3.177
   18    QG1  ILE   2           QG1      ILE   2  -1.989   9.558  -1.401
   19    QG2  ILE   2           QG2      ILE   2  -0.180   6.634  -0.759
   20    QD1  ILE   2           QD1      ILE   2  -2.042   7.869  -2.960
   21    H    SER   3           HN       SER   3  -0.061   8.652   2.438
   22    HA   SER   3           HA       SER   3   0.790   6.252   3.452
   23   1HB   SER   3          2HB       SER   3   2.067   8.279   3.919
   24   2HB   SER   3          3HB       SER   3   0.729   8.981   4.835
   25    HG   SER   3           HG       SER   3   1.077   7.190   6.338
   26    QB   SER   3           QB       SER   3   1.398   8.630   4.377
   27    H    SER   4           HN       SER   4  -1.781   8.325   4.953
   28    HA   SER   4           HA       SER   4  -2.116   6.512   7.104
   29   1HB   SER   4          2HB       SER   4  -4.104   7.606   7.676
   30   2HB   SER   4          3HB       SER   4  -3.011   8.847   7.052
   31    HG   SER   4           HG       SER   4  -5.253   7.616   5.805
   32    QB   SER   4           QB       SER   4  -3.558   8.227   7.364
   33    NH1  ARG   5           NH2      ARG   5  -4.517   5.544  -0.672
   34    NH2  ARG   5           NH1      ARG   5  -4.992   7.535  -1.715
   35    H    ARG   5           HN       ARG   5  -3.607   6.504   3.822
   36    HA   ARG   5           HA       ARG   5  -5.474   4.412   4.359
   37   1HB   ARG   5          2HB       ARG   5  -3.962   5.034   1.815
   38   2HB   ARG   5          3HB       ARG   5  -5.186   3.933   1.870
   39   1HG   ARG   5          2HG       ARG   5  -6.570   5.936   3.065
   40   2HG   ARG   5          3HG       ARG   5  -5.427   6.915   2.157
   41   1HD   ARG   5          2HD       ARG   5  -6.782   4.793   0.541
   42   2HD   ARG   5          3HD       ARG   5  -7.824   6.017   1.240
   43    HE   ARG   5           HE       ARG   5  -7.073   7.470  -0.347
   44   1HH1  ARG   5          2HH2      ARG   5  -4.769   4.825  -0.016
   45   2HH1  ARG   5          1HH2      ARG   5  -3.860   5.327  -1.421
   46   1HH2  ARG   5          2HH1      ARG   5  -5.563   8.347  -1.868
   47   2HH2  ARG   5          1HH1      ARG   5  -4.341   7.332  -2.471
   48    QB   ARG   5           QB       ARG   5  -4.575   4.484   1.842
   49    QG   ARG   5           QG       ARG   5  -5.999   6.425   2.610
   50    QD   ARG   5           QD       ARG   5  -7.303   5.405   0.890
   51    QH1  ARG   5           QH2      ARG   5  -4.315   5.076  -0.719
   52    QH2  ARG   5           QH1      ARG   5  -4.952   7.839  -2.170
   53    H    VAL   6           HN       VAL   6  -2.185   4.138   2.891
   54    HA   VAL   6           HA       VAL   6  -2.266   1.289   2.863
   55    HB   VAL   6           HB       VAL   6   0.046   3.275   2.734
   56   1HG1  VAL   6          3HG1      VAL   6   0.064   0.247   2.704
   57   2HG1  VAL   6          1HG1      VAL   6   1.184   1.140   1.664
   58   3HG1  VAL   6          2HG1      VAL   6   1.212   1.415   3.411
   59   1HG2  VAL   6          2HG2      VAL   6  -1.378   1.542   0.696
   60   2HG2  VAL   6          3HG2      VAL   6  -1.532   3.310   0.824
   61   3HG2  VAL   6          1HG2      VAL   6   0.011   2.590   0.333
   62    QG1  VAL   6           QG1      VAL   6   0.820   0.934   2.593
   63    QG2  VAL   6           QG2      VAL   6  -0.967   2.481   0.617
   64    QQG  VAL   6           QQG      VAL   6  -0.073   1.708   1.606
   65    H    LYS   7           HN       LYS   7  -0.710   3.529   5.178
   66    HA   LYS   7           HA       LYS   7   0.310   1.550   6.913
   67   1HB   LYS   7          2HB       LYS   7   0.977   3.940   6.724
   68   2HB   LYS   7          3HB       LYS   7  -0.509   4.403   7.579
   69   1HG   LYS   7          2HG       LYS   7   0.269   3.110   9.554
   70   2HG   LYS   7          3HG       LYS   7   1.723   2.629   8.665
   71   1HD   LYS   7          2HD       LYS   7   2.698   4.497   9.564
   72   2HD   LYS   7          3HD       LYS   7   1.809   5.359   8.324
   73   1HE   LYS   7          2HE       LYS   7   1.221   6.536  10.270
   74   2HE   LYS   7          3HE       LYS   7  -0.164   5.468  10.018
   75   1HZ   LYS   7          2HZ       LYS   7   1.489   4.006  11.576
   76   2HZ   LYS   7          3HZ       LYS   7   1.756   5.526  12.140
   77   3HZ   LYS   7          1HZ       LYS   7   0.233   4.910  12.134
   78    QB   LYS   7           QB       LYS   7   0.235   4.172   7.151
   79    QG   LYS   7           QG       LYS   7   0.996   2.870   9.109
   80    QD   LYS   7           QD       LYS   7   2.254   4.928   8.944
   81    QE   LYS   7           QE       LYS   7   0.528   6.002  10.145
   82    QZ   LYS   7           QZ       LYS   7   1.159   4.814  11.950
   83    H    SER   8           HN       SER   8  -2.759   3.437   7.201
   84    HA   SER   8           HA       SER   8  -3.607   2.300   9.649
   85   1HB   SER   8          2HB       SER   8  -4.627   4.328   8.629
   86   2HB   SER   8          3HB       SER   8  -5.391   3.287   7.391
   87    HG   SER   8           HG       SER   8  -6.826   3.626   9.069
   88    QB   SER   8           QB       SER   8  -5.009   3.807   8.010
   89    H    LYS   9           HN       LYS   9  -4.324   1.332   6.222
   90    HA   LYS   9           HA       LYS   9  -5.978  -0.837   7.018
   91   1HB   LYS   9          2HB       LYS   9  -5.747   0.300   4.694
   92   2HB   LYS   9          3HB       LYS   9  -4.339  -0.737   4.475
   93   1HG   LYS   9          2HG       LYS   9  -6.189  -1.840   3.448
   94   2HG   LYS   9          3HG       LYS   9  -5.914  -2.715   4.957
   95   1HD   LYS   9          2HD       LYS   9  -7.746  -0.935   5.841
   96   2HD   LYS   9          3HD       LYS   9  -8.168  -0.836   4.155
   97   1HE   LYS   9          2HE       LYS   9  -7.905  -3.631   5.306
   98   2HE   LYS   9          3HE       LYS   9  -9.167  -2.621   6.014
   99   1HZ   LYS   9          2HZ       LYS   9 -10.048  -2.304   3.755
  100   2HZ   LYS   9          3HZ       LYS   9  -8.975  -3.386   3.155
  101   3HZ   LYS   9          1HZ       LYS   9 -10.032  -3.891   4.257
  102    QB   LYS   9           QB       LYS   9  -5.043  -0.218   4.585
  103    QG   LYS   9           QG       LYS   9  -6.052  -2.277   4.202
  104    QD   LYS   9           QD       LYS   9  -7.957  -0.885   4.997
  105    QE   LYS   9           QE       LYS   9  -8.536  -3.127   5.660
  106    QZ   LYS   9           QZ       LYS   9  -9.685  -3.193   3.722
  107    NH1  ARG  10           NH2      ARG  10   2.152  -0.896   4.408
  108    NH2  ARG  10           NH1      ARG  10   2.567   0.999   5.699
  109    H    ARG  10           HN       ARG  10  -2.444  -0.583   6.533
  110    HA   ARG  10           HA       ARG  10  -1.827  -3.314   6.885
  111   1HB   ARG  10          2HB       ARG  10  -0.347  -0.921   6.608
  112   2HB   ARG  10          3HB       ARG  10   0.103  -1.510   8.208
  113   1HG   ARG  10          2HG       ARG  10   0.414  -3.822   7.014
  114   2HG   ARG  10          3HG       ARG  10   0.350  -2.865   5.527
  115   1HD   ARG  10          2HD       ARG  10   2.274  -2.775   7.813
  116   2HD   ARG  10          3HD       ARG  10   2.655  -3.076   6.100
  117    HE   ARG  10           HE       ARG  10   2.909  -0.686   7.485
  118   1HH1  ARG  10          2HH2      ARG  10   2.024  -1.895   4.379
  119   2HH1  ARG  10          1HH2      ARG  10   2.147  -0.368   3.548
  120   1HH2  ARG  10          2HH1      ARG  10   2.657   1.441   6.598
  121   2HH2  ARG  10          1HH1      ARG  10   2.899   1.592   4.927
  122    QB   ARG  10           QB       ARG  10  -0.123  -1.215   7.408
  123    QG   ARG  10           QG       ARG  10   0.381  -3.343   6.270
  124    QD   ARG  10           QD       ARG  10   2.465  -2.925   6.957
  125    QH1  ARG  10           QH2      ARG  10   2.086  -1.132   3.964
  126    QH2  ARG  10           QH1      ARG  10   2.778   1.517   5.762
  127    H    ILE  11           HN       ILE  11  -2.151  -0.688   9.225
  128    HA   ILE  11           HA       ILE  11  -1.601  -2.074  11.619
  129    HB   ILE  11           HB       ILE  11  -2.893   0.475  10.811
  130   1HG1  ILE  11          2HG1      ILE  11  -1.698   1.199  12.910
  131   2HG1  ILE  11          3HG1      ILE  11  -0.984  -0.415  12.995
  132   1HG2  ILE  11          3HG2      ILE  11  -3.723  -0.732  13.464
  133   2HG2  ILE  11          1HG2      ILE  11  -3.887   0.977  13.003
  134   3HG2  ILE  11          2HG2      ILE  11  -4.793  -0.233  12.122
  135   1HD1  ILE  11          3HD1      ILE  11  -0.793   1.568  10.687
  136   2HD1  ILE  11          1HD1      ILE  11   0.483   1.263  11.876
  137   3HD1  ILE  11          2HD1      ILE  11   0.025  -0.015  10.723
  138    QG1  ILE  11           QG1      ILE  11  -1.342   0.391  12.953
  139    QG2  ILE  11           QG2      ILE  11  -4.134   0.004  12.863
  140    QD1  ILE  11           QD1      ILE  11  -0.095   0.938  11.096
  141    H    GLN  12           HN       GLN  12  -4.798  -1.486  10.083
  142    HA   GLN  12           HA       GLN  12  -6.248  -3.170  11.829
  143   1HB   GLN  12          2HB       GLN  12  -7.495  -1.732  10.490
  144   2HB   GLN  12          3HB       GLN  12  -6.776  -2.301   8.974
  145   1HG   GLN  12          2HG       GLN  12  -8.007  -4.259   8.932
  146   2HG   GLN  12          3HG       GLN  12  -8.239  -4.298  10.690
  147   1HE2  GLN  12          2HE2      GLN  12 -11.344  -2.717  10.647
  148   2HE2  GLN  12          1HE2      GLN  12 -10.117  -3.576  11.556
  149    QB   GLN  12           QB       GLN  12  -7.136  -2.016   9.732
  150    QG   GLN  12           QG       GLN  12  -8.124  -4.279   9.811
  151    QE2  GLN  12           QE2      GLN  12 -10.731  -3.147  11.102
  152    H    LEU  13           HN       LEU  13  -4.595  -4.055   8.777
  153    HA   LEU  13           HA       LEU  13  -5.168  -6.888   8.968
  154   1HB   LEU  13          2HB       LEU  13  -3.381  -5.069   7.384
  155   2HB   LEU  13          3HB       LEU  13  -2.798  -6.703   7.556
  156    HG   LEU  13           HG       LEU  13  -4.262  -6.088   5.519
  157   1HD1  LEU  13          1HD1      LEU  13  -4.325  -8.552   7.234
  158   2HD1  LEU  13          2HD1      LEU  13  -5.406  -8.479   5.824
  159   3HD1  LEU  13          3HD1      LEU  13  -3.653  -8.287   5.611
  160   1HD2  LEU  13          3HD2      LEU  13  -6.150  -5.087   6.886
  161   2HD2  LEU  13          1HD2      LEU  13  -6.608  -6.287   5.662
  162   3HD2  LEU  13          2HD2      LEU  13  -6.589  -6.747   7.364
  163    QB   LEU  13           QB       LEU  13  -3.089  -5.886   7.470
  164    QD1  LEU  13           QD1      LEU  13  -4.461  -8.440   6.223
  165    QD2  LEU  13           QD2      LEU  13  -6.449  -6.040   6.637
  166    QQD  LEU  13           QQD      LEU  13  -5.455  -7.240   6.430
  167    H    GLY  14           HN       GLY  14  -3.018  -4.893  10.779
  168   1HA   GLY  14          1HA       GLY  14  -1.744  -5.402  12.594
  169   2HA   GLY  14          2HA       GLY  14  -2.332  -7.075  12.543
  170    QA   GLY  14           QA       GLY  14  -2.038  -6.238  12.569
  171    H    LEU  15           HN       LEU  15  -0.795  -5.385   9.825
  172    HA   LEU  15           HA       LEU  15   1.610  -7.169  10.076
  173   1HB   LEU  15          2HB       LEU  15   0.323  -6.161   7.514
  174   2HB   LEU  15          3HB       LEU  15   1.770  -7.163   7.652
  175    HG   LEU  15           HG       LEU  15  -1.088  -7.964   8.326
  176   1HD1  LEU  15          3HD1      LEU  15  -0.436  -7.906   5.920
  177   2HD1  LEU  15          1HD1      LEU  15   0.893  -9.033   6.274
  178   3HD1  LEU  15          2HD1      LEU  15  -0.795  -9.544   6.496
  179   1HD2  LEU  15          2HD2      LEU  15   1.530  -9.427   8.858
  180   2HD2  LEU  15          3HD2      LEU  15   0.175  -9.134   9.972
  181   3HD2  LEU  15          1HD2      LEU  15  -0.014 -10.285   8.652
  182    QB   LEU  15           QB       LEU  15   1.046  -6.662   7.583
  183    QD1  LEU  15           QD1      LEU  15  -0.113  -8.828   6.230
  184    QD2  LEU  15           QD2      LEU  15   0.563  -9.615   9.160
  185    QQD  LEU  15           QQD      LEU  15   0.226  -9.222   7.695
  186    H    ASN  16           HN       ASN  16   3.468  -6.209   8.871
  187    HA   ASN  16           HA       ASN  16   3.709  -3.272   9.413
  188   1HB   ASN  16          2HB       ASN  16   6.066  -3.626   9.832
  189   2HB   ASN  16          3HB       ASN  16   5.100  -4.602  10.948
  190   1HD2  ASN  16          2HD2      ASN  16   6.056  -7.736   9.612
  191   2HD2  ASN  16          1HD2      ASN  16   4.880  -6.792  10.540
  192    QB   ASN  16           QB       ASN  16   5.583  -4.114  10.389
  193    QD2  ASN  16           QD2      ASN  16   5.468  -7.264  10.076
  194    H    GLN  17           HN       GLN  17   5.584  -2.475   8.121
  195    HA   GLN  17           HA       GLN  17   4.752  -2.432   5.368
  196   1HB   GLN  17          2HB       GLN  17   7.115  -1.329   6.876
  197   2HB   GLN  17          3HB       GLN  17   6.946  -1.136   5.109
  198   1HG   GLN  17          2HG       GLN  17   5.010   0.181   5.384
  199   2HG   GLN  17          3HG       GLN  17   4.906  -0.193   7.135
  200   1HE2  GLN  17          2HE2      GLN  17   6.851   3.072   6.138
  201   2HE2  GLN  17          1HE2      GLN  17   5.482   2.410   5.297
  202    QB   GLN  17           QB       GLN  17   7.030  -1.233   5.992
  203    QG   GLN  17           QG       GLN  17   4.958  -0.006   6.260
  204    QE2  GLN  17           QE2      GLN  17   6.166   2.742   5.717
  205    H    ALA  18           HN       ALA  18   7.279  -4.324   7.043
  206    HA   ALA  18           HA       ALA  18   8.609  -5.147   4.615
  207   1HB   ALA  18          3HB       ALA  18   9.347  -5.189   7.220
  208   2HB   ALA  18          1HB       ALA  18   8.766  -6.860   7.065
  209   3HB   ALA  18          2HB       ALA  18  10.037  -6.259   5.988
  210    QB   ALA  18           QB       ALA  18   9.383  -6.102   6.758
  211    H    GLU  19           HN       GLU  19   6.375  -6.812   6.935
  212    HA   GLU  19           HA       GLU  19   5.860  -9.072   5.353
  213   1HB   GLU  19          2HB       GLU  19   4.400  -7.675   7.557
  214   2HB   GLU  19          3HB       GLU  19   3.464  -8.794   6.562
  215   1HG   GLU  19          2HG       GLU  19   4.445  -9.915   8.525
  216   2HG   GLU  19          3HG       GLU  19   4.954 -10.628   6.984
  217    QB   GLU  19           QB       GLU  19   3.932  -8.234   7.060
  218    QG   GLU  19           QG       GLU  19   4.699 -10.271   7.754
  219    H    LEU  20           HN       LEU  20   4.250  -5.878   5.195
  220    HA   LEU  20           HA       LEU  20   2.387  -6.813   3.220
  221   1HB   LEU  20          2HB       LEU  20   2.199  -4.665   4.617
  222   2HB   LEU  20          3HB       LEU  20   3.281  -3.931   3.408
  223    HG   LEU  20           HG       LEU  20   1.533  -5.084   1.715
  224   1HD1  LEU  20          1HD1      LEU  20   0.322  -6.196   3.709
  225   2HD1  LEU  20          2HD1      LEU  20  -0.283  -4.583   4.095
  226   3HD1  LEU  20          3HD1      LEU  20  -0.690  -5.345   2.538
  227   1HD2  LEU  20          1HD2      LEU  20   1.955  -2.624   1.974
  228   2HD2  LEU  20          2HD2      LEU  20   0.313  -3.095   1.503
  229   3HD2  LEU  20          3HD2      LEU  20   0.613  -2.584   3.158
  230    QB   LEU  20           QB       LEU  20   2.740  -4.298   4.012
  231    QD1  LEU  20           QD1      LEU  20  -0.217  -5.375   3.448
  232    QD2  LEU  20           QD2      LEU  20   0.960  -2.768   2.212
  233    QQD  LEU  20           QQD      LEU  20   0.371  -4.071   2.830
  234    H    ALA  21           HN       ALA  21   5.578  -5.147   2.943
  235    HA   ALA  21           HA       ALA  21   5.691  -4.990   0.151
  236   1HB   ALA  21          2HB       ALA  21   7.930  -5.481   2.161
  237   2HB   ALA  21          3HB       ALA  21   8.134  -5.052   0.460
  238   3HB   ALA  21          1HB       ALA  21   7.319  -3.925   1.573
  239    QB   ALA  21           QB       ALA  21   7.794  -4.819   1.398
  240    H    GLN  22           HN       GLN  22   6.822  -7.735   2.202
  241    HA   GLN  22           HA       GLN  22   7.519  -9.282  -0.154
  242   1HB   GLN  22          2HB       GLN  22   7.511 -11.266   1.411
  243   2HB   GLN  22          3HB       GLN  22   8.709  -9.998   1.674
  244   1HG   GLN  22          2HG       GLN  22   7.882  -9.399   3.697
  245   2HG   GLN  22          3HG       GLN  22   6.208  -9.621   3.176
  246   1HE2  GLN  22          2HE2      GLN  22   7.810 -12.453   5.464
  247   2HE2  GLN  22          1HE2      GLN  22   8.461 -10.851   5.296
  248    QB   GLN  22           QB       GLN  22   8.110 -10.632   1.543
  249    QG   GLN  22           QG       GLN  22   7.045  -9.510   3.436
  250    QE2  GLN  22           QE2      GLN  22   8.136 -11.652   5.380
  251    H    LYS  23           HN       LYS  23   4.500  -9.136   1.826
  252    HA   LYS  23           HA       LYS  23   3.135 -11.235   0.458
  253   1HB   LYS  23          2HB       LYS  23   2.173  -8.684   1.782
  254   2HB   LYS  23          3HB       LYS  23   1.066  -9.866   1.110
  255   1HG   LYS  23          2HG       LYS  23   3.144 -10.951   2.985
  256   2HG   LYS  23          3HG       LYS  23   1.944  -9.852   3.687
  257   1HD   LYS  23          2HD       LYS  23   0.113 -11.224   2.637
  258   2HD   LYS  23          3HD       LYS  23   1.316 -12.433   2.176
  259   1HE   LYS  23          2HE       LYS  23   0.743 -11.440   5.031
  260   2HE   LYS  23          3HE       LYS  23   0.045 -12.900   4.325
  261   1HZ   LYS  23          3HZ       LYS  23   2.938 -12.458   4.713
  262   2HZ   LYS  23          1HZ       LYS  23   1.967 -13.350   5.696
  263   3HZ   LYS  23          2HZ       LYS  23   2.225 -13.829   4.145
  264    QB   LYS  23           QB       LYS  23   1.619  -9.275   1.446
  265    QG   LYS  23           QG       LYS  23   2.544 -10.401   3.335
  266    QD   LYS  23           QD       LYS  23   0.715 -11.828   2.406
  267    QE   LYS  23           QE       LYS  23   0.394 -12.169   4.678
  268    QZ   LYS  23           QZ       LYS  23   2.376 -13.212   4.851
  269    H    VAL  24           HN       VAL  24   3.563  -7.787  -0.368
  270    HA   VAL  24           HA       VAL  24   1.956  -7.932  -2.784
  271    HB   VAL  24           HB       VAL  24   3.914  -5.901  -1.624
  272   1HG1  VAL  24          3HG1      VAL  24   2.249  -5.612  -4.141
  273   2HG1  VAL  24          1HG1      VAL  24   3.167  -4.321  -3.345
  274   3HG1  VAL  24          2HG1      VAL  24   4.026  -5.664  -4.099
  275   1HG2  VAL  24          2HG2      VAL  24   0.910  -6.220  -1.884
  276   2HG2  VAL  24          3HG2      VAL  24   1.845  -5.890  -0.423
  277   3HG2  VAL  24          1HG2      VAL  24   1.650  -4.637  -1.647
  278    QG1  VAL  24           QG1      VAL  24   3.147  -5.199  -3.861
  279    QG2  VAL  24           QG2      VAL  24   1.468  -5.583  -1.318
  280    QQG  VAL  24           QQG      VAL  24   2.307  -5.391  -2.590
  281    H    GLY  25           HN       GLY  25   5.346  -8.523  -2.005
  282   1HA   GLY  25          1HA       GLY  25   6.841  -9.750  -3.333
  283   2HA   GLY  25          2HA       GLY  25   5.779  -9.600  -4.744
  284    QA   GLY  25           QA       GLY  25   6.309  -9.676  -4.039
  285    H    THR  26           HN       THR  26   6.970  -7.128  -2.464
  286    HA   THR  26           HA       THR  26   8.878  -6.047  -4.415
  287    HB   THR  26           HB       THR  26   6.763  -4.858  -4.912
  288    HG1  THR  26          1HG       THR  26   8.578  -3.671  -5.228
  289   1HG2  THR  26          2HG2      THR  26   5.839  -4.960  -2.504
  290   2HG2  THR  26          3HG2      THR  26   6.890  -3.575  -2.160
  291   3HG2  THR  26          1HG2      THR  26   5.631  -3.440  -3.399
  292    QG2  THR  26           QG2      THR  26   6.120  -3.991  -2.687
  293    H    THR  27           HN       THR  27   9.175  -3.681  -2.738
  294    HA   THR  27           HA       THR  27  10.329  -4.870  -0.233
  295    HB   THR  27           HB       THR  27  12.156  -3.107  -0.628
  296    HG1  THR  27          1HG       THR  27  12.398  -2.781  -2.991
  297   1HG2  THR  27          3HG2      THR  27  12.396  -5.626  -0.947
  298   2HG2  THR  27          1HG2      THR  27  12.006  -5.390  -2.662
  299   3HG2  THR  27          2HG2      THR  27  13.471  -4.655  -1.970
  300    QG2  THR  27           QG2      THR  27  12.625  -5.224  -1.860
  301    H    GLN  28           HN       GLN  28  10.363  -3.484   1.566
  302    HA   GLN  28           HA       GLN  28   8.181  -1.869   2.047
  303   1HB   GLN  28          2HB       GLN  28   9.461  -2.743   3.808
  304   2HB   GLN  28          3HB       GLN  28  10.934  -1.901   3.310
  305   1HG   GLN  28          2HG       GLN  28   8.545  -0.173   3.921
  306   2HG   GLN  28          3HG       GLN  28   9.276  -1.031   5.286
  307   1HE2  GLN  28          2HE2      GLN  28  12.265   0.863   5.307
  308   2HE2  GLN  28          1HE2      GLN  28  11.521  -0.643   5.832
  309    QB   GLN  28           QB       GLN  28  10.198  -2.322   3.559
  310    QG   GLN  28           QG       GLN  28   8.910  -0.602   4.604
  311    QE2  GLN  28           QE2      GLN  28  11.893   0.109   5.570
  312    H    GLN  29           HN       GLN  29  11.297  -0.844   0.655
  313    HA   GLN  29           HA       GLN  29  10.972   1.878   0.573
  314   1HB   GLN  29          2HB       GLN  29  12.556  -0.101  -0.822
  315   2HB   GLN  29          3HB       GLN  29  11.867   0.945  -2.045
  316   1HG   GLN  29          2HG       GLN  29  12.783   2.787  -0.117
  317   2HG   GLN  29          3HG       GLN  29  13.972   1.485  -0.053
  318   1HE2  GLN  29          2HE2      GLN  29  13.582   3.873  -3.389
  319   2HE2  GLN  29          1HE2      GLN  29  12.394   3.917  -2.091
  320    QB   GLN  29           QB       GLN  29  12.212   0.422  -1.434
  321    QG   GLN  29           QG       GLN  29  13.377   2.135  -0.085
  322    QE2  GLN  29           QE2      GLN  29  12.988   3.894  -2.740
  323    H    SER  30           HN       SER  30   9.376  -0.482  -1.598
  324    HA   SER  30           HA       SER  30   8.211   1.476  -3.370
  325   1HB   SER  30          2HB       SER  30   7.768  -1.448  -2.885
  326   2HB   SER  30          3HB       SER  30   6.577  -0.527  -3.770
  327    HG   SER  30           HG       SER  30   9.345  -0.680  -4.363
  328    QB   SER  30           QB       SER  30   7.173  -0.987  -3.327
  329    H    ILE  31           HN       ILE  31   7.198   0.044  -0.235
  330    HA   ILE  31           HA       ILE  31   4.578   1.233  -0.315
  331    HB   ILE  31           HB       ILE  31   6.279  -0.102   1.847
  332   1HG1  ILE  31          2HG1      ILE  31   4.541  -1.821   1.601
  333   2HG1  ILE  31          3HG1      ILE  31   3.850  -0.899   0.232
  334   1HG2  ILE  31          3HG2      ILE  31   3.416   0.875   1.972
  335   2HG2  ILE  31          1HG2      ILE  31   4.264  -0.141   3.176
  336   3HG2  ILE  31          2HG2      ILE  31   4.806   1.509   2.884
  337   1HD1  ILE  31          1HD1      ILE  31   6.595  -2.135   0.235
  338   2HD1  ILE  31          2HD1      ILE  31   5.122  -2.928  -0.369
  339   3HD1  ILE  31          3HD1      ILE  31   5.699  -1.486  -1.173
  340    QG1  ILE  31           QG1      ILE  31   4.195  -1.359   0.916
  341    QG2  ILE  31           QG2      ILE  31   4.162   0.748   2.678
  342    QD1  ILE  31           QD1      ILE  31   5.805  -2.184  -0.435
  343    H    GLU  32           HN       GLU  32   7.661   2.017   1.346
  344    HA   GLU  32           HA       GLU  32   6.947   4.380   2.651
  345   1HB   GLU  32          2HB       GLU  32   9.107   3.376   2.972
  346   2HB   GLU  32          3HB       GLU  32   9.538   3.601   1.272
  347   1HG   GLU  32          2HG       GLU  32   9.518   6.081   1.606
  348   2HG   GLU  32          3HG       GLU  32   9.115   5.821   3.313
  349    QB   GLU  32           QB       GLU  32   9.323   3.488   2.122
  350    QG   GLU  32           QG       GLU  32   9.317   5.951   2.460
  351    H    GLN  33           HN       GLN  33   8.305   4.123  -0.689
  352    HA   GLN  33           HA       GLN  33   8.068   6.841  -1.311
  353   1HB   GLN  33          2HB       GLN  33   8.354   6.267  -3.591
  354   2HB   GLN  33          3HB       GLN  33   9.308   5.148  -2.597
  355   1HG   GLN  33          2HG       GLN  33   7.648   3.470  -2.902
  356   2HG   GLN  33          3HG       GLN  33   6.605   4.525  -3.876
  357   1HE2  GLN  33          2HE2      GLN  33  10.120   3.177  -5.572
  358   2HE2  GLN  33          1HE2      GLN  33  10.047   3.423  -3.834
  359    QB   GLN  33           QB       GLN  33   8.831   5.708  -3.093
  360    QG   GLN  33           QG       GLN  33   7.126   3.997  -3.389
  361    QE2  GLN  33           QE2      GLN  33  10.084   3.300  -4.702
  362    H    LEU  34           HN       LEU  34   5.691   4.244  -1.666
  363    HA   LEU  34           HA       LEU  34   3.690   5.899  -2.839
  364   1HB   LEU  34          2HB       LEU  34   3.732   3.369  -2.845
  365   2HB   LEU  34          3HB       LEU  34   3.105   3.418  -1.192
  366    HG   LEU  34           HG       LEU  34   1.077   4.606  -1.997
  367   1HD1  LEU  34          2HD1      LEU  34   2.540   4.527  -4.667
  368   2HD1  LEU  34          3HD1      LEU  34   0.769   4.617  -4.595
  369   3HD1  LEU  34          1HD1      LEU  34   1.737   5.909  -3.885
  370   1HD2  LEU  34          1HD2      LEU  34   1.164   2.118  -1.990
  371   2HD2  LEU  34          2HD2      LEU  34   0.108   2.745  -3.271
  372   3HD2  LEU  34          3HD2      LEU  34   1.731   2.147  -3.676
  373    QB   LEU  34           QB       LEU  34   3.419   3.394  -2.018
  374    QD1  LEU  34           QD1      LEU  34   1.682   5.018  -4.382
  375    QD2  LEU  34           QD2      LEU  34   1.001   2.336  -2.979
  376    QQD  LEU  34           QQD      LEU  34   1.341   3.677  -3.680
  377    H    GLU  35           HN       GLU  35   4.297   5.055   0.579
  378    HA   GLU  35           HA       GLU  35   2.207   6.408   1.815
  379   1HB   GLU  35          2HB       GLU  35   4.982   5.602   2.639
  380   2HB   GLU  35          3HB       GLU  35   4.148   6.757   3.660
  381   1HG   GLU  35          2HG       GLU  35   2.422   5.238   4.191
  382   2HG   GLU  35          3HG       GLU  35   2.836   4.143   2.845
  383    QB   GLU  35           QB       GLU  35   4.565   6.180   3.149
  384    QG   GLU  35           QG       GLU  35   2.629   4.690   3.518
  385    H    ASN  36           HN       ASN  36   5.497   7.828   1.057
  386    HA   ASN  36           HA       ASN  36   4.315  10.491   1.700
  387   1HB   ASN  36          2HB       ASN  36   6.470  11.424   1.400
  388   2HB   ASN  36          3HB       ASN  36   6.568  10.023   2.480
  389   1HD2  ASN  36          2HD2      ASN  36   9.397   9.737   0.087
  390   2HD2  ASN  36          1HD2      ASN  36   8.910  10.955   1.258
  391    QB   ASN  36           QB       ASN  36   6.519  10.724   1.941
  392    QD2  ASN  36           QD2      ASN  36   9.153  10.346   0.673
  393    H    GLY  37           HN       GLY  37   3.580   8.700  -0.803
  394   1HA   GLY  37          1HA       GLY  37   2.684   9.187  -2.815
  395   2HA   GLY  37          2HA       GLY  37   2.628  10.865  -2.261
  396    QA   GLY  37           QA       GLY  37   2.655  10.026  -2.538
  397    H    LYS  38           HN       LYS  38   5.308   8.664  -3.204
  398    HA   LYS  38           HA       LYS  38   6.376  10.714  -5.089
  399   1HB   LYS  38          2HB       LYS  38   7.511   8.165  -3.943
  400   2HB   LYS  38          3HB       LYS  38   8.341   9.144  -5.154
  401   1HG   LYS  38          2HG       LYS  38   7.658  11.010  -3.156
  402   2HG   LYS  38          3HG       LYS  38   7.994   9.531  -2.268
  403   1HD   LYS  38          2HD       LYS  38  10.045  10.642  -2.344
  404   2HD   LYS  38          3HD       LYS  38  10.200   9.332  -3.528
  405   1HE   LYS  38          2HE       LYS  38   9.877  10.885  -5.391
  406   2HE   LYS  38          3HE       LYS  38   9.329  12.165  -4.297
  407   1HZ   LYS  38          1HZ       LYS  38  11.564  12.179  -3.342
  408   2HZ   LYS  38          2HZ       LYS  38  12.070  11.126  -4.505
  409   3HZ   LYS  38          3HZ       LYS  38  11.513  12.618  -4.924
  410    QB   LYS  38           QB       LYS  38   7.925   8.655  -4.549
  411    QG   LYS  38           QG       LYS  38   7.826  10.271  -2.711
  412    QD   LYS  38           QD       LYS  38  10.122   9.987  -2.936
  413    QE   LYS  38           QE       LYS  38   9.604  11.525  -4.844
  414    QZ   LYS  38           QZ       LYS  38  11.715  11.975  -4.256
  415    H    THR  39           HN       THR  39   4.190   8.154  -5.368
  416    HA   THR  39           HA       THR  39   4.901   7.826  -8.236
  417    HB   THR  39           HB       THR  39   4.330   5.548  -6.290
  418    HG1  THR  39          1HG       THR  39   6.478   5.018  -6.783
  419   1HG2  THR  39          2HG2      THR  39   4.698   5.623  -9.326
  420   2HG2  THR  39          3HG2      THR  39   4.819   4.150  -8.360
  421   3HG2  THR  39          1HG2      THR  39   3.285   5.034  -8.423
  422    QG2  THR  39           QG2      THR  39   4.268   4.936  -8.703
  423    H    LYS  40           HN       LYS  40   3.166   7.828  -9.560
  424    HA   LYS  40           HA       LYS  40   0.552   8.521  -8.411
  425   1HB   LYS  40          2HB       LYS  40   1.693   8.492 -11.232
  426   2HB   LYS  40          3HB       LYS  40  -0.038   8.724 -10.905
  427   1HG   LYS  40          2HG       LYS  40   0.436  10.594  -9.412
  428   2HG   LYS  40          3HG       LYS  40   2.165  10.454  -9.687
  429   1HD   LYS  40          2HD       LYS  40   0.110  11.071 -11.895
  430   2HD   LYS  40          3HD       LYS  40   0.883  12.282 -10.889
  431   1HE   LYS  40          2HE       LYS  40   2.314  12.407 -12.645
  432   2HE   LYS  40          3HE       LYS  40   3.161  11.214 -11.664
  433   1HZ   LYS  40          1HZ       LYS  40   1.497   9.755 -13.250
  434   2HZ   LYS  40          2HZ       LYS  40   1.996  10.973 -14.240
  435   3HZ   LYS  40          3HZ       LYS  40   3.104  10.009 -13.510
  436    QB   LYS  40           QB       LYS  40   0.827   8.608 -11.069
  437    QG   LYS  40           QG       LYS  40   1.301  10.524  -9.550
  438    QD   LYS  40           QD       LYS  40   0.496  11.676 -11.393
  439    QE   LYS  40           QE       LYS  40   2.738  11.810 -12.154
  440    QZ   LYS  40           QZ       LYS  40   2.199  10.246 -13.666
  441    NH1  ARG  41           NH2      ARG  41  -3.987   4.630 -13.623
  442    NH2  ARG  41           NH1      ARG  41  -5.564   2.942 -13.778
  443    H    ARG  41           HN       ARG  41   1.628   6.044 -10.822
  444    HA   ARG  41           HA       ARG  41  -0.439   4.185  -9.715
  445   1HB   ARG  41          2HB       ARG  41  -1.179   5.424 -11.818
  446   2HB   ARG  41          3HB       ARG  41   0.087   4.555 -12.664
  447   1HG   ARG  41          2HG       ARG  41  -1.677   3.161 -13.052
  448   2HG   ARG  41          3HG       ARG  41  -1.033   2.385 -11.613
  449   1HD   ARG  41          2HD       ARG  41  -2.840   2.991 -10.299
  450   2HD   ARG  41          3HD       ARG  41  -3.082   4.528 -11.104
  451    HE   ARG  41           HE       ARG  41  -4.406   2.065 -11.703
  452   1HH1  ARG  41          2HH2      ARG  41  -3.182   5.018 -13.154
  453   2HH1  ARG  41          1HH2      ARG  41  -4.354   5.102 -14.435
  454   1HH2  ARG  41          2HH1      ARG  41  -5.980   2.088 -13.433
  455   2HH2  ARG  41          1HH1      ARG  41  -5.959   3.361 -14.607
  456    QB   ARG  41           QB       ARG  41  -0.546   4.989 -12.241
  457    QG   ARG  41           QG       ARG  41  -1.355   2.773 -12.332
  458    QD   ARG  41           QD       ARG  41  -2.961   3.759 -10.701
  459    QH1  ARG  41           QH2      ARG  41  -3.768   5.060 -13.794
  460    QH2  ARG  41           QH1      ARG  41  -5.969   2.724 -14.020
  461    HA   PRO  42           HA       PRO  42   3.712   2.153 -10.063
  462   1HB   PRO  42          2HB       PRO  42   3.369   0.519  -7.830
  463   2HB   PRO  42          3HB       PRO  42   4.148   2.115  -7.805
  464   1HG   PRO  42          2HG       PRO  42   1.473   1.290  -6.866
  465   2HG   PRO  42          3HG       PRO  42   2.444   2.690  -6.353
  466   1HD   PRO  42          2HD       PRO  42   0.228   2.721  -8.183
  467   2HD   PRO  42          3HD       PRO  42   1.288   4.056  -7.830
  468    QB   PRO  42           QB       PRO  42   3.758   1.317  -7.817
  469    QG   PRO  42           QG       PRO  42   1.959   1.991  -6.609
  470    QD   PRO  42           QD       PRO  42   0.759   3.389  -8.007
  471    NH1  ARG  43           NH2      ARG  43   7.674  -4.840 -11.488
  472    NH2  ARG  43           NH1      ARG  43   8.506  -5.347  -9.387
  473    H    ARG  43           HN       ARG  43   4.228  -0.086 -10.568
  474    HA   ARG  43           HA       ARG  43   2.106  -1.522 -11.841
  475   1HB   ARG  43          2HB       ARG  43   3.719  -3.222 -12.321
  476   2HB   ARG  43          3HB       ARG  43   4.483  -1.649 -12.516
  477   1HG   ARG  43          2HG       ARG  43   6.154  -2.634 -11.380
  478   2HG   ARG  43          3HG       ARG  43   5.258  -2.120  -9.959
  479   1HD   ARG  43          2HD       ARG  43   4.238  -4.375  -9.736
  480   2HD   ARG  43          3HD       ARG  43   4.940  -4.901 -11.244
  481    HE   ARG  43           HE       ARG  43   6.128  -4.889  -8.655
  482   1HH1  ARG  43          2HH2      ARG  43   6.887  -4.573 -12.063
  483   2HH1  ARG  43          1HH2      ARG  43   8.559  -5.033 -11.932
  484   1HH2  ARG  43          2HH1      ARG  43   8.365  -5.486  -8.396
  485   2HH2  ARG  43          1HH1      ARG  43   9.421  -5.533  -9.771
  486    QB   ARG  43           QB       ARG  43   4.101  -2.436 -12.419
  487    QG   ARG  43           QG       ARG  43   5.705  -2.377 -10.670
  488    QD   ARG  43           QD       ARG  43   4.589  -4.638 -10.489
  489    QH1  ARG  43           QH2      ARG  43   7.724  -4.804 -11.998
  490    QH2  ARG  43           QH1      ARG  43   8.893  -5.509  -9.083
  491    H    PHE  44           HN       PHE  44   3.418  -1.627  -8.593
  492    HA   PHE  44           HA       PHE  44   1.946  -4.092  -7.951
  493   1HB   PHE  44          2HB       PHE  44   3.077  -4.002  -5.857
  494   2HB   PHE  44          3HB       PHE  44   4.251  -3.832  -7.142
  495    HD1  PHE  44          1HD       PHE  44   2.545  -2.135  -4.335
  496    HD2  PHE  44          2HD       PHE  44   5.543  -1.702  -7.396
  497    HE1  PHE  44          1HE       PHE  44   3.105   0.113  -3.460
  498    HE2  PHE  44          2HE       PHE  44   6.120   0.539  -6.494
  499    HZ   PHE  44           HZ       PHE  44   4.837   1.483  -4.591
  500    QB   PHE  44           QB       PHE  44   3.664  -3.917  -6.499
  501    QR   PHE  44           QR       PHE  44   4.329  -0.797  -5.421
  502    H    LEU  45           HN       LEU  45   0.768  -1.156  -8.455
  503    HA   LEU  45           HA       LEU  45  -0.530  -0.549  -6.007
  504   1HB   LEU  45          2HB       LEU  45  -0.289   0.723  -8.271
  505   2HB   LEU  45          3HB       LEU  45  -1.795  -0.031  -8.704
  506    HG   LEU  45           HG       LEU  45  -2.183   2.173  -7.942
  507   1HD1  LEU  45          2HD1      LEU  45  -3.705   0.315  -7.382
  508   2HD1  LEU  45          3HD1      LEU  45  -3.100   0.388  -5.714
  509   3HD1  LEU  45          1HD1      LEU  45  -3.918   1.802  -6.422
  510   1HD2  LEU  45          3HD2      LEU  45  -0.375   1.612  -5.645
  511   2HD2  LEU  45          1HD2      LEU  45  -0.844   3.161  -6.385
  512   3HD2  LEU  45          2HD2      LEU  45  -1.882   2.404  -5.210
  513    QB   LEU  45           QB       LEU  45  -1.042   0.346  -8.488
  514    QD1  LEU  45           QD1      LEU  45  -3.574   0.835  -6.506
  515    QD2  LEU  45           QD2      LEU  45  -1.034   2.392  -5.746
  516    QQD  LEU  45           QQD      LEU  45  -2.305   1.614  -6.127
  517    HA   PRO  46           HA       PRO  46  -4.159  -3.427  -7.317
  518   1HB   PRO  46          2HB       PRO  46  -3.633  -5.499  -9.055
  519   2HB   PRO  46          3HB       PRO  46  -4.364  -3.942  -9.510
  520   1HG   PRO  46          2HG       PRO  46  -1.599  -4.898 -10.014
  521   2HG   PRO  46          3HG       PRO  46  -2.553  -3.681 -10.899
  522   1HD   PRO  46          2HD       PRO  46  -0.539  -3.294  -8.955
  523   2HD   PRO  46          3HD       PRO  46  -1.532  -2.007  -9.691
  524    QB   PRO  46           QB       PRO  46  -3.998  -4.720  -9.283
  525    QG   PRO  46           QG       PRO  46  -2.075  -4.289 -10.456
  526    QD   PRO  46           QD       PRO  46  -1.036  -2.651  -9.323
  527    H    GLU  47           HN       GLU  47  -0.875  -4.857  -7.417
  528    HA   GLU  47           HA       GLU  47  -1.440  -7.178  -5.937
  529   1HB   GLU  47          2HB       GLU  47   1.114  -5.512  -6.055
  530   2HB   GLU  47          3HB       GLU  47   0.998  -7.203  -5.538
  531   1HG   GLU  47          2HG       GLU  47   0.232  -7.839  -7.796
  532   2HG   GLU  47          3HG       GLU  47   0.351  -6.167  -8.353
  533    QB   GLU  47           QB       GLU  47   1.056  -6.357  -5.796
  534    QG   GLU  47           QG       GLU  47   0.291  -7.003  -8.074
  535    H    LEU  48           HN       LEU  48  -0.399  -3.928  -4.823
  536    HA   LEU  48           HA       LEU  48  -0.521  -4.573  -2.035
  537   1HB   LEU  48          2HB       LEU  48   0.860  -2.817  -3.131
  538   2HB   LEU  48          3HB       LEU  48  -0.582  -1.819  -3.315
  539    HG   LEU  48           HG       LEU  48  -0.276  -2.766  -0.550
  540   1HD1  LEU  48          1HD1      LEU  48   2.114  -1.291  -1.755
  541   2HD1  LEU  48          2HD1      LEU  48   1.728  -1.309  -0.025
  542   3HD1  LEU  48          3HD1      LEU  48   2.160  -2.802  -0.827
  543   1HD2  LEU  48          2HD2      LEU  48  -0.220  -0.001  -1.820
  544   2HD2  LEU  48          3HD2      LEU  48  -1.582  -0.829  -1.017
  545   3HD2  LEU  48          1HD2      LEU  48  -0.211  -0.301  -0.069
  546    QB   LEU  48           QB       LEU  48   0.139  -2.318  -3.223
  547    QD1  LEU  48           QD1      LEU  48   2.001  -1.801  -0.869
  548    QD2  LEU  48           QD2      LEU  48  -0.671  -0.377  -0.969
  549    QQD  LEU  48           QQD      LEU  48   0.665  -1.089  -0.919
  550    H    ALA  49           HN       ALA  49  -2.875  -2.954  -4.205
  551    HA   ALA  49           HA       ALA  49  -4.908  -2.434  -2.318
  552   1HB   ALA  49          1HB       ALA  49  -4.937  -3.207  -5.246
  553   2HB   ALA  49          2HB       ALA  49  -6.448  -3.036  -4.364
  554   3HB   ALA  49          3HB       ALA  49  -5.383  -1.656  -4.519
  555    QB   ALA  49           QB       ALA  49  -5.589  -2.633  -4.710
  556    H    SER  50           HN       SER  50  -4.387  -5.422  -4.235
  557    HA   SER  50           HA       SER  50  -6.572  -6.762  -2.997
  558   1HB   SER  50          2HB       SER  50  -5.227  -7.223  -5.254
  559   2HB   SER  50          3HB       SER  50  -4.321  -8.344  -4.224
  560    HG   SER  50           HG       SER  50  -6.447  -9.220  -3.661
  561    QB   SER  50           QB       SER  50  -4.774  -7.784  -4.739
  562    H    ALA  51           HN       ALA  51  -3.020  -6.873  -2.388
  563    HA   ALA  51           HA       ALA  51  -3.011  -8.829  -0.373
  564   1HB   ALA  51          3HB       ALA  51  -0.976  -7.960  -1.440
  565   2HB   ALA  51          1HB       ALA  51  -1.226  -6.380  -0.660
  566   3HB   ALA  51          2HB       ALA  51  -0.869  -7.814   0.322
  567    QB   ALA  51           QB       ALA  51  -1.024  -7.384  -0.593
  568    H    LEU  52           HN       LEU  52  -3.501  -5.278  -0.073
  569    HA   LEU  52           HA       LEU  52  -3.898  -5.438   2.818
  570   1HB   LEU  52          2HB       LEU  52  -4.138  -3.294   0.696
  571   2HB   LEU  52          3HB       LEU  52  -4.922  -3.053   2.241
  572    HG   LEU  52           HG       LEU  52  -1.958  -3.586   1.928
  573   1HD1  LEU  52          2HD1      LEU  52  -3.573  -1.039   2.352
  574   2HD1  LEU  52          3HD1      LEU  52  -1.823  -1.156   2.628
  575   3HD1  LEU  52          1HD1      LEU  52  -2.491  -1.439   1.012
  576   1HD2  LEU  52          3HD2      LEU  52  -3.719  -2.975   4.343
  577   2HD2  LEU  52          1HD2      LEU  52  -2.606  -4.330   4.153
  578   3HD2  LEU  52          2HD2      LEU  52  -1.970  -2.697   4.351
  579    QB   LEU  52           QB       LEU  52  -4.531  -3.173   1.468
  580    QD1  LEU  52           QD1      LEU  52  -2.629  -1.211   1.997
  581    QD2  LEU  52           QD2      LEU  52  -2.765  -3.334   4.283
  582    QQD  LEU  52           QQD      LEU  52  -2.697  -2.272   3.140
  583    H    GLY  53           HN       GLY  53  -5.967  -5.691  -0.009
  584   1HA   GLY  53          1HA       GLY  53  -8.147  -6.520  -0.080
  585   2HA   GLY  53          2HA       GLY  53  -8.267  -6.433   1.687
  586    QA   GLY  53           QA       GLY  53  -8.207  -6.476   0.803
  587    H    VAL  54           HN       VAL  54  -7.641  -4.199  -1.061
  588    HA   VAL  54           HA       VAL  54 -10.063  -2.646  -0.499
  589    HB   VAL  54           HB       VAL  54  -8.813  -0.469  -0.587
  590   1HG1  VAL  54          3HG1      VAL  54  -9.569  -1.452   1.571
  591   2HG1  VAL  54          1HG1      VAL  54  -7.899  -2.064   1.810
  592   3HG1  VAL  54          2HG1      VAL  54  -8.210  -0.325   1.702
  593   1HG2  VAL  54          1HG2      VAL  54  -6.339  -2.246  -0.337
  594   2HG2  VAL  54          2HG2      VAL  54  -6.716  -1.037  -1.591
  595   3HG2  VAL  54          3HG2      VAL  54  -6.336  -0.533   0.062
  596    QG1  VAL  54           QG1      VAL  54  -8.559  -1.280   1.695
  597    QG2  VAL  54           QG2      VAL  54  -6.464  -1.271  -0.622
  598    QQG  VAL  54           QQG      VAL  54  -7.512  -1.276   0.536
  599    H    SER  55           HN       SER  55  -9.862  -0.740  -2.337
  600    HA   SER  55           HA       SER  55  -9.455  -2.203  -4.897
  601   1HB   SER  55          2HB       SER  55 -10.969  -0.525  -5.816
  602   2HB   SER  55          3HB       SER  55 -11.709  -1.330  -4.426
  603    HG   SER  55           HG       SER  55 -11.123   0.484  -3.148
  604    QB   SER  55           QB       SER  55 -11.339  -0.927  -5.121
  605    H    VAL  56           HN       VAL  56  -8.497  -1.088  -6.696
  606    HA   VAL  56           HA       VAL  56  -6.049   0.255  -6.040
  607    HB   VAL  56           HB       VAL  56  -7.517  -0.487  -8.600
  608   1HG1  VAL  56          1HG1      VAL  56  -5.202   1.443  -8.442
  609   2HG1  VAL  56          2HG1      VAL  56  -5.295   0.269  -9.767
  610   3HG1  VAL  56          3HG1      VAL  56  -6.614   1.412  -9.491
  611   1HG2  VAL  56          3HG2      VAL  56  -4.996  -1.382  -7.179
  612   2HG2  VAL  56          1HG2      VAL  56  -6.443  -2.316  -7.559
  613   3HG2  VAL  56          2HG2      VAL  56  -5.348  -1.822  -8.864
  614    QG1  VAL  56           QG1      VAL  56  -5.704   1.042  -9.233
  615    QG2  VAL  56           QG2      VAL  56  -5.596  -1.840  -7.867
  616    QQG  VAL  56           QQG      VAL  56  -5.650  -0.399  -8.551
  617    H    ASP  57           HN       ASP  57  -9.098   1.383  -7.526
  618    HA   ASP  57           HA       ASP  57  -8.388   4.100  -7.914
  619   1HB   ASP  57          2HB       ASP  57 -10.914   4.378  -7.693
  620   2HB   ASP  57          3HB       ASP  57 -10.361   3.227  -8.921
  621    QB   ASP  57           QB       ASP  57 -10.638   3.802  -8.307
  622    CH2  TRP  58           CH2      TRP  58  -7.069   2.543   2.238
  623    H    TRP  58           HN       TRP  58  -9.549   2.265  -5.007
  624    HA   TRP  58           HA       TRP  58  -9.666   4.655  -3.505
  625   1HB   TRP  58          2HB       TRP  58 -10.948   2.763  -2.728
  626   2HB   TRP  58          3HB       TRP  58  -9.470   1.797  -2.534
  627    HD1  TRP  58           HD1      TRP  58 -11.510   4.510  -0.705
  628    HE1  TRP  58           HE1      TRP  58 -10.614   4.890   1.537
  629    HE3  TRP  58           HE3      TRP  58  -7.264   1.616  -1.042
  630    HZ2  TRP  58           HZ2      TRP  58  -8.470   3.839   3.245
  631    HZ3  TRP  58           HZ3      TRP  58  -5.702   1.578   0.904
  632    HH2  TRP  58           HH2      TRP  58  -6.328   2.583   3.026
  633    QB   TRP  58           QB       TRP  58 -10.209   2.280  -2.631
  634    H    LEU  59           HN       LEU  59  -7.150   2.155  -3.775
  635    HA   LEU  59           HA       LEU  59  -5.315   3.294  -1.977
  636   1HB   LEU  59          2HB       LEU  59  -5.238   1.360  -4.206
  637   2HB   LEU  59          3HB       LEU  59  -3.755   2.298  -4.101
  638    HG   LEU  59           HG       LEU  59  -5.005   0.725  -1.844
  639   1HD1  LEU  59          3HD1      LEU  59  -3.829  -0.446  -3.817
  640   2HD1  LEU  59          1HD1      LEU  59  -2.333   0.295  -3.254
  641   3HD1  LEU  59          2HD1      LEU  59  -3.264  -0.815  -2.201
  642   1HD2  LEU  59          1HD2      LEU  59  -3.003   2.911  -1.836
  643   2HD2  LEU  59          2HD2      LEU  59  -3.762   2.074  -0.462
  644   3HD2  LEU  59          3HD2      LEU  59  -2.319   1.410  -1.245
  645    QB   LEU  59           QB       LEU  59  -4.496   1.830  -4.154
  646    QD1  LEU  59           QD1      LEU  59  -3.142  -0.322  -3.091
  647    QD2  LEU  59           QD2      LEU  59  -3.028   2.132  -1.181
  648    QQD  LEU  59           QQD      LEU  59  -3.085   0.905  -2.135
  649    H    LEU  60           HN       LEU  60  -5.996   4.169  -5.370
  650    HA   LEU  60           HA       LEU  60  -3.945   6.247  -5.365
  651   1HB   LEU  60          2HB       LEU  60  -6.388   5.709  -7.089
  652   2HB   LEU  60          3HB       LEU  60  -5.445   7.181  -7.214
  653    HG   LEU  60           HG       LEU  60  -4.870   4.509  -8.278
  654   1HD1  LEU  60          1HD1      LEU  60  -3.833   7.352  -8.704
  655   2HD1  LEU  60          2HD1      LEU  60  -3.155   5.996  -9.573
  656   3HD1  LEU  60          3HD1      LEU  60  -4.880   6.382  -9.769
  657   1HD2  LEU  60          1HD2      LEU  60  -3.283   4.228  -6.454
  658   2HD2  LEU  60          2HD2      LEU  60  -2.497   4.412  -8.023
  659   3HD2  LEU  60          3HD2      LEU  60  -2.488   5.767  -6.896
  660    QB   LEU  60           QB       LEU  60  -5.916   6.445  -7.151
  661    QD1  LEU  60           QD1      LEU  60  -3.956   6.576  -9.349
  662    QD2  LEU  60           QD2      LEU  60  -2.757   4.802  -7.124
  663    QQD  LEU  60           QQD      LEU  60  -3.356   5.689  -8.237
  664    H    ASN  61           HN       ASN  61  -7.524   6.441  -4.773
  665    HA   ASN  61           HA       ASN  61  -7.041   8.842  -3.085
  666   1HB   ASN  61          2HB       ASN  61  -8.423  10.228  -4.825
  667   2HB   ASN  61          3HB       ASN  61  -6.700  10.001  -4.974
  668   1HD2  ASN  61          2HD2      ASN  61  -8.885   7.830  -7.707
  669   2HD2  ASN  61          1HD2      ASN  61  -9.463   7.830  -6.053
  670    QB   ASN  61           QB       ASN  61  -7.561  10.115  -4.899
  671    QD2  ASN  61           QD2      ASN  61  -9.173   7.829  -6.880
  672    H    GLY  62           HN       GLY  62  -8.456   6.441  -2.358
  673   1HA   GLY  62          1HA       GLY  62 -11.301   7.052  -2.897
  674   2HA   GLY  62          2HA       GLY  62 -10.646   5.683  -2.121
  675    QA   GLY  62           QA       GLY  62 -10.974   6.368  -2.509
  676    H    THR  63           HN       THR  63  -9.186   6.863  -0.171
  677    HA   THR  63           HA       THR  63  -9.189   7.648   1.937
  678    HB   THR  63           HB       THR  63  -9.776   9.766   2.245
  679    HG1  THR  63          1HG       THR  63 -12.043   9.544   1.453
  680   1HG2  THR  63          1HG2      THR  63  -8.181   9.237   0.313
  681   2HG2  THR  63          2HG2      THR  63  -9.531   9.545  -0.807
  682   3HG2  THR  63          3HG2      THR  63  -8.934  10.857   0.203
  683    QG2  THR  63           QG2      THR  63  -8.882   9.880  -0.097
  684    H    SER  64           HN       SER  64  -9.990   5.984   3.139
  685    HA   SER  64           HA       SER  64 -12.852   5.542   3.417
  686   1HB   SER  64          2HB       SER  64 -10.454   4.353   4.893
  687   2HB   SER  64          3HB       SER  64 -12.136   3.837   5.084
  688    HG   SER  64           HG       SER  64 -11.290   2.524   3.537
  689    QB   SER  64           QB       SER  64 -11.294   4.095   4.989
  690    H    ASP  65           HN       ASP  65 -14.146   6.037   5.159
  691    HA   ASP  65           HA       ASP  65 -13.547   7.961   7.099
  692   1HB   ASP  65          2HB       ASP  65 -15.537   5.658   7.128
  693   2HB   ASP  65          3HB       ASP  65 -15.608   7.105   8.147
  694    QB   ASP  65           QB       ASP  65 -15.572   6.381   7.638
  695    H    SER  66           HN       SER  66 -11.710   7.633   8.313
  696    HA   SER  66           HA       SER  66 -11.846   5.631  10.460
  697   1HB   SER  66          2HB       SER  66  -9.463   5.701   8.541
  698   2HB   SER  66          3HB       SER  66  -9.557   4.795  10.064
  699    HG   SER  66           HG       SER  66 -11.683   4.154   8.620
  700    QB   SER  66           QB       SER  66  -9.511   5.248   9.302
  701    H    ASN  67           HN       ASN  67 -11.893   7.264  11.959
  702    HA   ASN  67           HA       ASN  67  -9.474   8.500  12.670
  703   1HB   ASN  67          2HB       ASN  67 -10.461  10.031  10.621
  704   2HB   ASN  67          3HB       ASN  67 -11.331  10.759  11.963
  705   1HD2  ASN  67          2HD2      ASN  67  -8.065  11.607  13.594
  706   2HD2  ASN  67          1HD2      ASN  67  -9.462  10.650  14.080
  707    QB   ASN  67           QB       ASN  67 -10.896  10.395  11.292
  708    QD2  ASN  67           QD2      ASN  67  -8.764  11.129  13.837
  709    H    VAL  68           HN       VAL  68 -13.003   8.610  12.789
  710    HA   VAL  68           HA       VAL  68 -12.949   8.821  15.759
  711    HB   VAL  68           HB       VAL  68 -14.770  10.284  13.801
  712   1HG1  VAL  68          1HG1      VAL  68 -15.403   9.366  16.435
  713   2HG1  VAL  68          2HG1      VAL  68 -15.126  11.10