*HEADER    METAL BINDING PROTEIN                   25-APR-13   2M7K              
*TITLE     NMR SOLUTION STRUCTURE OF N-TERMINAL DOMAIN OF (Y81F)-EHCABP1         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CALCIUM-BINDING PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CABP;                                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA;                          
*SOURCE   3 ORGANISM_TAXID: 5759;                                                
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR: PET30A                                     
*KEYWDS    METAL BINDING PROTEIN                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    K.V.CHARY, A.K.ROUT, S.PATEL, A.BHATTACHARYA                          
*REVDAT   1   10-JUL-13 2M7K    0                                                


#N-ter (Y81F)-EhCaBP1 Sequence
MET 1
ALA 2
GLU 3
ALA 4
LEU 5
PHE 6
LYS 7
GLU 8
ILE 9
ASP 10
VAL 11
ASN 12
GLY 13
ASP 14
GLY 15
ALA 16
VAL 17
SER 18
TYR 19
GLU 20
GLU 21
VAL 22
LYS 23
ALA 24
PHE 25
VAL 26
SER 27
LYS 28
LYS 29
ARG 30
ALA 31
ILE 32
LYS 33
ASN 34
GLU 35
GLN 36
LEU 37
LEU 38
GLN 39
LEU 40
ILE 41
PHE 42
LYS 43
SER 44
ILE 45
ASP 46
ALA 47
ASP 48
GLY 49
ASN 50
GLY 51
GLU 52
ILE 53
ASP 54
GLN 55
ASN 56
GLU 57
PHE 58
ALA 59
LYS 60
PHE 61
TYR 62
GLY 63
SER 64
ILE 65
GLN 66
PL 200
LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5
LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5
ORI 250
LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5
LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5 LL5
ORI 300
#
#
#N-ter (Y81F)-EhCaBP1 Dihedrals
   5 LEU   PHI     -77.2   -57.2
   5 LEU   PSI     -47.8   -27.8
   6 PHE   PHI     -70.8   -50.8
   6 PHE   PSI     -51.8   -31.8
   7 LYS   PHI     -74.6   -54.6
   7 LYS   PSI     -47.1   -27.1
   8 GLU   PHI     -85.6   -51.1
   8 GLU   PSI     -49.7   -29.0
   9 ILE   PHI     -95.9   -69.5
   9 ILE   PSI     -41.6   -11.0
  10 ASP   PHI    -129.6   -69.2
  10 ASP   PSI      75.6   106.1
  11 VAL   PHI     -74.0   -52.9
  11 VAL   PSI     -42.5   -11.4
  12 ASN   PHI    -107.7   -83.2
  12 ASN   PSI       0.1    20.1
  13 GLY   PHI      43.2    83.8
  13 GLY   PSI       8.4    46.6
  16 ALA   PHI    -133.3  -109.1
  16 ALA   PSI     119.7   139.7
  17 VAL   PHI    -122.8  -102.8
  17 VAL   PSI     114.7   134.7
  18 SER   PHI    -111.2   -72.5
  18 SER   PSI     108.5   175.0
  19 TYR   PHI     -69.0   -49.0
  19 TYR   PSI     -47.5   -25.3
  20 GLU   PHI     -74.0   -54.0
  20 GLU   PSI     -50.5   -30.5
  21 GLU   PHI     -75.2   -55.2
  21 GLU   PSI     -49.1   -29.1
  22 VAL   PHI     -74.0   -54.0
  22 VAL   PSI     -54.6   -34.6
  23 LYS   PHI     -72.6   -52.6
  23 LYS   PSI     -53.5   -33.5
  24 ALA   PHI     -80.5   -60.5
  24 ALA   PSI     -48.5   -28.5
  25 PHE   PHI     -85.9   -51.6
  25 PHE   PSI     -51.5   -29.6
  26 VAL   PHI     -69.4   -49.4
  26 VAL   PSI     -52.2   -32.2
  27 SER   PHI     -74.7   -54.7
  27 SER   PSI     -48.7   -28.7
  28 LYS   PHI     -99.0   -79.0
  28 LYS   PSI     -31.1    -6.3
  31 ALA   PHI    -114.6   -82.7
  31 ALA   PSI     104.8   138.4
  32 ILE   PHI    -127.1   -81.5
  32 ILE   PSI     104.9   133.1
  33 LYS   PHI    -112.3   -77.5
  33 LYS   PSI     111.6   141.5
  34 ASN   PHI    -117.8   -76.7
  34 ASN   PSI     105.0   160.7
  35 GLU   PHI     -71.5   -51.5
  35 GLU   PSI     -38.2   -17.4
  36 GLN   PHI     -70.4   -50.4
  36 GLN   PSI     -51.4   -31.4
  37 LEU   PHI     -76.7   -56.7
  37 LEU   PSI     -49.8   -29.8
  38 LEU   PHI     -74.0   -54.0
  38 LEU   PSI     -50.5   -30.5
  39 GLN   PHI     -76.5   -56.5
  39 GLN   PSI     -50.6   -30.6
  40 LEU   PHI     -73.9   -53.9
  40 LEU   PSI     -50.9   -30.9
  41 ILE   PHI     -72.6   -52.6
  41 ILE   PSI     -53.3   -33.3
  42 PHE   PHI     -70.4   -50.4
  42 PHE   PSI     -53.6   -33.6
  43 LYS   PHI     -71.8   -51.8
  43 LYS   PSI     -49.1   -29.1
  44 SER   PHI     -72.2   -52.2
  44 SER   PSI     -50.5   -30.5
  45 ILE   PHI     -97.1   -66.5
  45 ILE   PSI     -40.6    -7.5
  46 ASP   PHI    -129.4   -68.0
  46 ASP   PSI      83.2   116.9
  47 ALA   PHI     -69.0   -48.5
  47 ALA   PSI     -43.6   -22.8
  48 ASP   PHI    -107.2   -83.0
  48 ASP   PSI       1.0    21.0
  49 GLY   PHI      72.6    92.6
  49 GLY   PSI      -3.5    27.2
  50 ASN   PHI    -105.0   -74.7
  50 ASN   PSI     107.2   147.5
  51 GLY   PHI      62.4   101.9
  51 GLY   PSI     -23.5    29.0
  52 GLU   PHI    -147.2  -110.3
  52 GLU   PSI     126.1   157.4
  53 ILE   PHI    -118.4   -92.0
  53 ILE   PSI     109.3   132.0
  54 ASP   PHI    -101.7   -76.9
  54 ASP   PSI     161.6   181.6
  55 GLN   PHI     -69.4   -49.4
  55 GLN   PSI     -50.3   -29.6
  56 ASN   PHI     -78.6   -58.6
  56 ASN   PSI     -50.1   -30.1
  57 GLU   PHI     -74.5   -54.5
  57 GLU   PSI     -50.0   -30.0
  58 PHE   PHI     -74.9   -54.9
  58 PHE   PSI     -50.3   -30.3
  59 ALA   PHI     -76.2   -56.2
  59 ALA   PSI     -51.2   -31.2
  60 LYS   PHI     -73.4   -53.4
  60 LYS   PSI     -48.3   -25.2
  61 PHE   PHI    -101.4   -76.1
  61 PHE   PSI     -35.4     7.9
  62 TYR   PHI     -67.4   -47.4
  62 TYR   PSI     118.3   138.3
  63 GLY   PHI      80.0   101.0
  63 GLY   PSI     -18.4     3.0
  65 ILE   PHI    -108.5   -88.5
  65 ILE   PSI      -7.4    15.9
  66 GLN   PHI     -71.1   -51.1
  66 GLN   PSI     120.5   140.5
#
#  
#N-ter (Y81F)-EhCaBP1 distance constraints
3 GLU HA 3 GLU H 3.0 #peak 1
3 GLU H 4 ALA H 3.0 #peak 2
3 GLU HA 6 PHE H 3.2 #peak 3
#resid 4
4 ALA H 4 ALA HA 2.9 #peak 4
4 ALA H 4 ALA HB 3.0 #peak 5
4 ALA HA 5 LEU H 3.1 #peak 6
4 ALA HB 5 LEU H 3.6 #peak 7
4 ALA HA 7 LYS HB 3.8 #peak 8
4 ALA HA 7 LYS H 3.0 #peak 9
#resid 5
5 LEU H 5 LEU HA 2.8 #peak 10
5 LEU H 5 LEU HB2 3.0 #peak 11
5 LEU H 5 LEU HG 3.5 #peak 12
5 LEU H 5 LEU HD1 4.0 #peak 13
5 LEU HA 6 PHE H 3.5 #peak 14
5 LEU HG 6 PHE H 3.7 #peak 15
5 LEU H 6 PHE H 2.8 #peak 16
5 LEU HA 8 GLU H 3.6 #peak 17
5 LEU HA 8 GLU HB2 3.6 #peak 18
#resid 6
6 PHE H 6 PHE HA 2.8 #peak 19
6 PHE H 6 PHE HB2 3.0 #peak 20
6 PHE HA 7 LYS H 3.5 #peak 21
6 PHE HE 7 LYS H 4.5 #peak 22
6 PHE H 7 LYS H 2.9 #peak 23
6 PHE HA 9 ILE H 3.8 #peak 24 
6 PHE HA 9 ILE HB 3.6 #peak 25
6 PHE HA 25 PHE HB 5.8 #peak 26
6  PHE HB3 55  GLN HA  4.3 #peak 27
6  PHE HB  25  PHE HE  4.5 #peak 28
6  PHE HE  17  VAL HA  4.9 #peak 29
6  PHE HE  53  ILE HD1 4.5 #peak 30
#resid 7
7 LYS H 7 LYS HA 2.8 #peak 31
7 LYS H 7 LYS HB2 3.2 #peak 32
7 LYS H 7 LYS HG2 3.6 #peak 33
7 LYS H 7 LYS HD2 4.3 #peak 34
7 LYS HA 8 GLU H 3.5 #peak 35
7 LYS H 8 GLU H 2.8 #peak 36
7 LYS HA 8 GLU H 3.5 #peak 37
7 LYS HA 15 GLY H 4.6 #peak 38
#resid 8
8 GLU H 8 GLU HA 2.8 #peak 39
8 GLU H 8 GLU HB2 3.0 #peak 40
8 GLU H 8 GLU HB3 3.6 #peak 41
8 GLU HA 9 ILE H 3.5 #peak 42
8 GLU HB2 9 ILE H 3.8 #peak 43
8 GLU H 9 ILE H 2.9 #peak 44
8 GLU HG 11 VAL H 6.5 #peak 45
#resid 9
9 ILE H 9 ILE HA 2.8 #peak 46
9 ILE H 9 ILE HB 3.0 #peak 47
9 ILE H 9 ILE HG2 3.7 #peak 48
9 ILE HA 10 ASP H 3.4 #peak 49
9 ILE HB 10 ASP H 3.2 #peak 50
9 ILE HG2 10 ASP H 3.7 #peak 51
9 ILE H 10 ASP H 2.8 #peak 52
#resid 10
10 ASP H 10 ASP HA 2.9 #peak 53
10 ASP H 10 ASP HB2 3.2 #peak 54
10 ASP H 10 ASP HB3 3.6 #peak 55
10 ASP HA 11 VAL H 2.8 #peak 56
10 ASP HB2 11 VAL H 4.6 #peak 57
10 ASP H 11 VAL H 3.9 #peak 58
10 ASP HA 12 ASN H 4.0 #peak 59
#resid 11
11 VAL H 11 VAL HA 2.8 #peak 60
11 VAL H 11 VAL HB 3.0 #peak 61
11 VAL H 11 VAL HG1 3.7 #peak 62
11 VAL HA 12 ASN H 3.4 #peak 63
11 VAL HB 12 ASN H 3.4 #peak 64
11 VAL HG1 12 ASN H 4.0 #peak 65
11 VAL H 12 ASN H 2.8 #peak 66
#resid 12
12 ASN H 12 ASN HA 2.8 #peak 67
12 ASN H 12 ASN HB2 3.5 #peak 68
12 ASN H 12 ASN HB3 3.5 #peak 69
12 ASN HA 13 GLY H 3.3 #peak 70
12 ASN HB2 13 GLY H 4.1 #peak 71
12 ASN HB3 13 GLY H 4.5 #peak 72
12 ASN H 13 GLY H 2.8 #peak 73
#resid 13
13 GLY H 13 GLY HA2 2.8 #peak 74
13 GLY HA2 14 ASP H 2.8 #peak 75
13 GLY HA2 15 GLY H 3.8 #peak 76
13 GLY H 14 ASP H 2.9 #peak 77
13 GLY H 15 GLY H 4.4 #peak 78
#resid 14
14 ASP H 14 ASP HA 3.0 #peak 79
14 ASP H 14 ASP HB2 3.7 #peak 80
14 ASP H 14 ASP HB3 3.1 #peak 81
14 ASP HA 15 GLY H 3.4 #peak 82
14 ASP HB2 15 GLY H 4.0 #peak 83
14 ASP HB3 15 GLY H 4.2 #peak 84
14 ASP H 15 GLY H 2.8 #peak 85
#resid 15
15 GLY H 15 GLY HA2 2.8 #peak 86
15 GLY H 15 GLY HA3 2.8 #peak 87
15 GLY HA2 16 ALA H 3.2 #peak 88
15 GLY HA3 16 ALA H 3.3 #peak 89
15  GLY H  16  ALA H  4.0 #peak 90
15  GLY H  16  ALA HA  5.2 #peak 91
15  GLY H  16  ALA HB  5.0 #peak 92
#resid 16
16  ALA  H  16  ALA  HA  2.9 #peak 93
16  ALA  H  16  ALA  HB  3.0 #peak 94
16  ALA  HA  17  VAL  H  2.8 #peak 95
16  ALA  HB  17  VAL  H  3.5 #peak 96
16  ALA  HA  54  ASP  HA  2.3 #peak 97
16  ALA  HB  53  ILE  H  4.9 #peak 98
16  ALA  HB  54  ASP  HA  4.0 #peak 99
16  ALA  HB  54  ASP  HB  4.0 #peak 100
16  ALA   HA  54  ASP   HB3 4.5 #peak 101
16  ALA   HA  55  GLN   H   3.6 #peak 102
#resid 17
17  VAL  H  17  VAL  HA  2.9 #peak 103
17  VAL  H  17  VAL  HB  3.8 #peak 104
17  VAL  H  17  VAL  HG1 4.0 #peak 105
17  VAL  H  17  VAL  HG2 4.0 #peak 106
17  VAL  HA  18  SER  H  2.7 #peak 107
17  VAL  HB  18  SER  H  4.4 #peak 108
17  VAL  HG1 18  SER  H  4.0 #peak 109
17  VAL  HG2 18  SER  H  4.1 #peak 110
17  VAL  H  53  ILE  H  3.9 #peak 111
17  VAL  H  54  ASP  HA  4.0 #peak 112
#resid 18
18  SER  H  18  SER  HA  2.9 #peak 113
18  SER  H  18  SER  HB2 3.5 #peak 114 
18  SER  H  18  SER  HG  4.1 #peak 115 
18  SER  HA  19  TYR  H  2.8 #peak 116
18  SER  HB2 19  TYR  H  3.5 #peak 117
18  SER  HB3 19  TYR  H  3.5 #peak 118
18  SER  HA  20  GLU  H  4.6 #peak 119
18  SER  HB2 20  GLU  H  4.5 #peak 120
18  SER  HB3 20  GLU  H  4.5 #peak 121 
18  SER  H  21  GLU  H  4.5 #peak 122
18  SER  HA  21  GLU  H  4.6 #peak 123
18  SER  HA  52  GLU  HA  3.1 #peak 124
18  SER  HA  53  ILE  H  3.5 #peak 125
18  SER   HA    52  GLU   HB3  3.5 #peak 126
18  SER   HA    52  GLU   HG3  4.1 #peak 127
18  SER   HB3   52  GLU   HB3  3.5 #peak 128
18  SER   HB3   52  GLU   HG3  3.6 #peak 129
18  SER  HA    52  GLU  H   4.0 #peak 130
18  SER  HB3   52  GLU  H   4.2 #peak 131
#resid 19
19  TYR  H    19  TYR  HA   2.8 #peak 132
19  TYR  H    19  TYR  HB2  3.5 #peak 133
19  TYR  H    19  TYR  HB3  3.6 #peak 134
19  TYR  HA    20  GLU  H   3.5 #peak 135
19  TYR  HB2   20  GLU  H   4.1 #peak 136
19  TYR  HB3   20  GLU  H   3.8 #peak 137
19  TYR  H    20  GLU  H   2.9 #peak 138
19  TYR  HA    22  VAL  H   3.8 #peak 139
19  TYR  H    52  GLU  HA   3.7 #peak 140
#resid 20
20  GLU  H  20  GLU  HA    2.8 #peak 141
20  GLU  H  20  GLU  HB2   3.5 #peak 142
20  GLU  H  20  GLU  HG2   4.0 #peak 143
20  GLU  HA  21  GLU  H    3.5 #peak 144
20  GLU  HB2 21  GLU  H    3.5 #peak 145
20  GLU  H  21  GLU  H    2.8 #peak 146
20  GLU  H  22  VAL  H    4.3 #peak 147
20  GLU  HA  23  LYS  H    3.6 #peak 148
20  GLU  HA  23  LYS  HB2   2.9 #peak 149
20  GLU  HA  24  ALA  H    4.1 #peak 150
#resid 21
21  GLU  H  21  GLU  HA    2.8 #peak 151
21  GLU  H  21  GLU  HB2   3.5 #peak 152
21  GLU  H  21  GLU  HG2   4.0 #peak 153
21  GLU  HA  22  VAL  H    3.5 #peak 154
21  GLU  HB2 22  VAL  H    3.5 #peak 155
21  GLU  HG2 22  VAL  H    4.8 #peak 156
21  GLU  H  22  VAL  H    2.8 #peak 157
21  GLU  HA  24  ALA  HB    3.0 #peak 158
#resid 22
22  VAL  H  22  VAL  HA    2.8 #peak 159
22  VAL  H  22  VAL  HB    3.0 #peak 160
22  VAL  H  22  VAL  HG1   4.0 #peak 161
22  VAL  H  22  VAL  HG2   4.0 #peak 162
22  VAL  HA  23  LYS  H    3.6 #peak 163
22  VAL  HB  23  LYS  H    3.9 #peak 164
22  VAL  HG1 23  LYS  H    3.5 #peak 165
22  VAL  HG2 23  LYS  H    3.8 #peak 166
22  VAL  H  23  LYS  H    2.8 #peak 167
22  VAL  HG1 24  ALA  H    4.7 #peak 168
22  VAL  HG2 24  ALA  H    5.2 #peak 169
22  VAL  HA  25  PHE  HB2   3.2 #peak 170
22  VAL  HA  38  LEU  HD2   5.0 #peak 171
22  VAL  HA  53  ILE  HD1   5.5 #peak 172
22  VAL  HB  38  LEU  HD1   5.0 #peak 173
22  VAL  HG2 42  PHE  HA    5.0 #peak 174
22  VAL  HG2 61  PHE  HE2   5.9 #peak 175
#resid 23
23  LYS  H  23  LYS  HA    2.8 #peak 176
23  LYS  H  23  LYS  HB2   3.0 #peak 177
23  LYS  H  23  LYS  HG2   4.0 #peak 178
23  LYS  H  23  LYS  HD2   4.9 #peak 179
23  LYS  H  23  LYS  HE2   5.1 #peak 180
23  LYS  HA  24  ALA  H    3.6 #peak 181
23  LYS  HB2 24  ALA  H    3.5 #peak 182
23  LYS  HG2 24  ALA  H    4.9 #peak 183
23  LYS  H  24  ALA  H    2.8 #peak 184
23  LYS  HA  26  VAL  HB    3.9 #peak 185
23  LYS  HA  27  SER  H    4.9 #peak 186
23  LYS  HA  34  ASN  HB2   6.0 #peak 187
23  LYS  HA  38  LEU  HB2   4.7 #peak 188
#resid 24
24  ALA  H  24  ALA  HA    2.8 #peak 189
24  ALA  H  24  ALA  HB    3.5 #peak 190
24  ALA  HA  25  PHE  H    3.5 #peak 191
24  ALA  HB  25  PHE  H    3.5 #peak 192
24  ALA  H  25  PHE  H    2.8 #peak 193
24  ALA  HA  27  SER  HB    4.0 #peak 194
#resid 25
25  PHE  H  25  PHE  HA    2.8 #peak 195
25  PHE  H  25  PHE  HB2   3.5 #peak 196
25  PHE  H  25  PHE  HB3   3.5 #peak 197
25  PHE  HA  26  VAL  H    3.5 #peak 198
25  PHE  HB2 26  VAL  H    3.7 #peak 199
25  PHE  HB3 26  VAL  H    3.5 #peak 200
25  PHE  H  26  VAL  H    2.9 #peak 201
25  PHE  HA  28  LYS  H    3.8 #peak 202
25  PHE  HA  28  LYS  HB2   3.5 #peak 203
#resid 26
26  VAL  H  26  VAL  HA    2.8 #peak 204
26  VAL  H  26  VAL  HB    3.5 #peak 205
26  VAL  H  26  VAL  HG1   4.0 #peak 206
26  VAL  H  26  VAL  HG2   4.0 #peak 207
26  VAL  HA  27  SER  H    3.4 #peak 208
26  VAL  HB  27  SER  H    3.7 #peak 209
26  VAL  HG1 27  SER  H    4.0 #peak 210
26  VAL  HG2 27  SER  H    4.2 #peak 211
26  VAL  H  27  SER  H    2.8 #peak 212
26  VAL  HA  29  LYS  HB2   4.2 #peak 213
26  VAL  HG2 30  ARG  H    4.8 #peak 214
#resid 27
27  SER  H  27  SER  HA    2.8 #peak 215
27  SER  H  27  SER  HB2   3.5 #peak 216
27  SER  H  27  SER  HB3   3.5 #peak 217
27  SER  HA  28  LYS  H    3.4 #peak 218
27  SER  HB2 28  LYS  H    3.5 #peak 219
27  SER  H  28  LYS  H    2.8 #peak 220
27  SER  HA  29  LYS  H    3.5 #peak 221
27  SER  HA  30  ARG  H    3.2 #peak 222
#resid 28
28  LYS  H  28  LYS  HA    2.8 #peak 224
28  LYS  H  28  LYS  HB2   3.5 #peak 225
28  LYS  H  28  LYS  HG2   4.0 #peak 226
28  LYS  H  28  LYS  HD2   4.0 #peak 227
28  LYS  HA  29  LYS  H    3.3 #peak 228
28  LYS  HB2 29  LYS  H    3.5 #peak 229
28  LYS  H  29  LYS  H    2.8 #peak 230
#resid 29
29  LYS  H  29  LYS  HA    2.9 #peak 231
29  LYS  H  29  LYS  HB2   3.1 #peak 232
29  LYS  H  29  LYS  HG2   4.0 #peak 233
29  LYS  HA  30  ARG  H    3.5 #peak 234
29  LYS  HB2  30  ARG  H   3.5 #peak 235
29  LYS  HG2  30  ARG  H   4.6 #peak 236
29  LYS  HD2  30  ARG  H   4.7 #peak 237
29  LYS  H   30  ARG  H   2.8 #peak 238
#resid 30
30  ARG  H  30  ARG  HA    2.8 #peak 239
30  ARG  H  30  ARG  HB2   4.0 #peak 240
30  ARG  H  30  ARG  HB3   3.6 #peak 241
30  ARG  H  30  ARG  HG2   4.0 #peak 242
30  ARG  H  30  ARG  HG3   4.0 #peak 243
30  ARG  H  30  ARG  HD2   4.0 #peak 244
30  ARG  HA  31  ALA  H    3.0 #peak 245
30  ARG  HB2 31  ALA  H    3.0 #peak 246
30  ARG  HB3 31  ALA  H    3.4 #peak 247
30  ARG  HG2 31  ALA  H    4.0 #peak 248
30  ARG  H  31  ALA  H    4.3 #peak 249
30  ARG  H  32  ILE  H    5.1 #peak 250
#resid 31
31  ALA  H  31  ALA  HA    2.9 #peak 251
31  ALA  H  31  ALA  HB    3.0 #peak 252
31  ALA  H  32  ILE  H    3.9 #peak 253
31  ALA  HA  32  ILE  H    2.4 #peak 254
31  ALA  H  33  LYS  H    6.5 #peak 255
#resid 32
32  ILE  H  32  ILE  HA    2.9 #peak 256
32  ILE  H  32  ILE  HG2   4.0 #peak 257
32  ILE  H  32  ILE  HG1   4.0 #peak 258
32  ILE  H  32  ILE  HD1   4.6 #peak 259
32  ILE  HA  33  LYS  H    2.8 #peak 260
32  ILE  HG2 33  LYS  H    4.2 #peak 261
32  ILE  H  33  LYS  H    4.0 #peak 262
32  ILE  H  34  ASN  H    5.7 #peak 263
#resid 33
33  LYS  H  33  LYS  HA    2.8 #peak 264
33  LYS  H  33  LYS  HB2   3.6 #peak 265
33  LYS  H  33  LYS  HG2   4.0 #peak 266
33  LYS  H  33  LYS  HG3   4.0 #peak 267
33  LYS  H  33  LYS  HD2   4.5 #peak 268
33  LYS  H  33  LYS  HE2   5.0 #peak 269
33  LYS  HA  34  ASN  H    3.0 #peak 270
33  LYS  HB2 34  ASN  H    4.1 #peak 271
33  LYS  H  34  ASN  H    4.3 #peak 272
#resid 34
34  ASN  H  34  ASN  HA    2.9 #peak 273
34  ASN  H  34  ASN  HB2   3.5 #peak 274
34  ASN  H  34  ASN  HB3   3.7 #peak 275
34  ASN  HA  35  GLU  H    3.0 #peak 276
34  ASN  HB2 35  GLU  H    4.6 #peak 277
34  ASN  HA  37  LEU  H    4.0 #peak 278
#resid 35
35  GLU  H  35  GLU  HA    2.9 #peak 279
35  GLU  H  35  GLU  HB2   3.6 #peak 280
35  GLU  H  35  GLU  HB3   3.6 #peak 281
35  GLU  H  35  GLU  HG2   4.0 #peak 282
35  GLU  HA  36  GLN  H    3.5 #peak 283
35  GLU  HB2 36  GLN  H    3.5 #peak 284
35  GLU  H  36  GLN  H    3.5 #peak 285
#resid 36
36  GLN  H  36  GLN  HA    2.8 #peak 286
36  GLN  H  36  GLN  HB2   3.0 #peak 287
36  GLN  H  36  GLN  HB3   3.0 #peak 288
36  GLN  H  36  GLN  HG2   4.3 #peak 289
36  GLN  H  36  GLN  HG3   4.3 #peak 290
36  GLN  HB2 37  LEU  H    4.0 #peak 291
36  GLN  HB3 37  LEU  H    4.0 #peak 292
36  GLN  H  37  LEU  H    2.8 #peak 293
36  GLN  HB3 38  LEU  H    5.0 #peak 294
36  GLN  HA  39  GLN  HB2   3.5 #peak 295
#resid 37
37  LEU  H  37  LEU  HA    2.8 #peak 296
37  LEU  H  37  LEU  HB2   3.0 #peak 297
37  LEU  H  37  LEU  HB3   3.6 #peak 298
37  LEU  H  37  LEU  HG    4.5 #peak 299
37  LEU  HA  38  LEU  H    3.7 #peak 300
37  LEU  HB2 38  LEU  H    4.0 #peak 301
37  LEU  HB3 38  LEU  H    3.8 #peak 302
37  LEU  HG  38  LEU  H    4.4 #peak 303
37  LEU  H  38  LEU  H    2.8 #peak 304
37  LEU  HA  40  LEU  HB2   3.5 #peak 305
#resid 38
38  LEU  H  38  LEU  HA    2.8 #peak 306
38  LEU  H  38  LEU  HB2   3.0 #peak 307
38  LEU  H  38  LEU  HB3   3.0 #peak 308
38  LEU  H  38  LEU  HD1   4.5 #peak 309
38  LEU  H  38  LEU  HD2   4.5 #peak 310
38  LEU  HA  39  GLN  H    3.5 #peak 311
38  LEU  HB2 39  GLN  H    3.9 #peak 312
38  LEU  HB3 39  GLN  H    3.5 #peak 313
38  LEU  HD1 39  GLN  H    4.5 #peak 314
38  LEU  HD2 39  GLN  H    4.7 #peak 315
38  LEU  H  39  GLN  H    2.8 #peak 316
38  LEU  HA  41  ILE  H    3.9 #peak 317
38  LEU  HA  41  ILE  HB    3.5 #peak 318
#resid 39
39  GLN  H  39  GLN  HA    2.8 #peak 319
39  GLN  H  39  GLN  HB2   3.5 #peak 320
39  GLN  H  39  GLN  HB3   3.5 #peak 321
39  GLN  H  39  GLN  HG2   4.0 #peak 322
39  GLN  HA  40  LEU  H    3.5 #peak 323
39  GLN  HB2 40  LEU  H    3.5 #peak 324
39  GLN  HB3 40  LEU  H    3.5 #peak 325
39  GLN  H  40  LEU  H    2.8 #peak 326
39  GLN  HA  42  PHE  H    3.7 #peak 327
39  GLN  HA  42  PHE  HB2   3.5 #peak 328
#resid 40
40  LEU  H  40  LEU  HA    2.8 #peak 329
40  LEU  H  40  LEU  HB2   3.0 #peak 330
40  LEU  H  40  LEU  HB3   3.0 #peak 331
40  LEU  H  40  LEU  HG    4.0 #peak 332
40  LEU  H  40  LEU  HD1   4.5 #peak 333
40  LEU  H  40  LEU  HD2   4.5 #peak 334
40  LEU  HA  41  ILE  H    3.6 #peak 335
40  LEU  HB2 41  ILE  H    3.5 #peak 336
40  LEU  HB3 41  ILE  H    3.5 #peak 337
40  LEU  H  41  ILE  H    2.8 #peak 338
40  LEU  HA  43  LYS  HB2   3.8 #peak 339
#resid 41
41  ILE  H  41  ILE  HA    2.8 #peak 340
41  ILE  H  41  ILE  HB    2.7 #peak 341
41  ILE  H  41  ILE  HG2   4.0 #peak 342
41  ILE  H  41  ILE  HG1   4.0 #peak 343
41  ILE  H  41  ILE  HD1   4.5 #peak 344
41  ILE  HB  42  PHE  H    3.6 #peak 345
41  ILE  HG2 42  PHE  H    4.0 #peak 346
41  ILE  HD1 42  PHE  H    4.7 #peak 347
41  ILE  H  42  PHE  H    2.8 #peak 348
41  ILE  HA  44  SER  HB2   3.5 #peak 349
#resid 42
42  PHE  H  42  PHE  HA    2.8 #peak 350
42  PHE  H  42  PHE  HB2   3.0 #peak 351
42  PHE  H  42  PHE  HB3   3.1 #peak 352
42  PHE  HB2 43  LYS  H    4.0 #peak 353
42  PHE  HB3 43  LYS  H    3.0 #peak 354
42  PHE  H  43  LYS  H    3.5 #peak 355
42  PHE  HA  45  ILE  HB    3.7 #peak 356
#resid 43
43  LYS  H  43  LYS  HA    2.8 #peak 357
43  LYS  H  43  LYS  HB2   3.0 #peak 358
43  LYS  H  43  LYS  HB3   3.1 #peak 356
43  LYS  HB3 44  SER  H    3.0 #peak 357
43  LYS  H  44  SER  H    2.8 #peak 358
43  LYS  HA  46  ASP  H    3.7 #peak 359
#resid 44
44  SER  H  44  SER  HA    2.8 #peak 360
44  SER  H  44  SER  HB2   3.5 #peak 361
44  SER  HA  45  ILE  H    3.5 #peak 362
44  SER  HB2 45  ILE  H    3.5 #peak 363
44  SER  H  45  ILE  H    2.8 #peak 364
#resid 45
45  ILE  H  45  ILE  HA    2.9 #peak 365
45  ILE  H  45  ILE  HB    3.0 #peak 366
45  ILE  H  45  ILE  HG2   4.0 #peak 367
45  ILE  HA  46  ASP  H    3.5 #peak 368
45  ILE  HB  46  ASP  H    3.8 #peak 369
45  ILE  HG2 46  ASP  H    4.1 #peak 370
45  ILE  H  46  ASP  H    2.8 #peak 371
#resid 46
46  ASP  H  46  ASP  HA    2.9 #peak 372
46  ASP  H  46  ASP  HB2   3.0 #peak 373
46  ASP  HA  47  ALA  H    2.3 #peak 374
46  ASP  HB2 47  ALA  H    4.5 #peak 375
46  ASP  H  47  ALA  H    4.4 #peak 376
46  ASP  HA  48  ASP  H    4.0 #peak 377
#resid 47
47  ALA  H  47  ALA  HA    2.8 #peak 378
47  ALA  H  47  ALA  HB    3.0 #peak 379
47  ALA  HA  48  ASP  H    3.5 #peak 380
47  ALA  HB  48  ASP  H    3.0 #peak 381
47  ALA  H  48  ASP  H    2.8 #peak 382
#resid 48
48  ASP  H  48  ASP  HA    2.9 #peak 383
48  ASP  H  48  ASP  HB2   3.7 #peak 384
48  ASP  H  48  ASP  HB3   3.5 #peak 385
48  ASP  HA  49  GLY  H    3.5 #peak 386
#resid 49
49  GLY  H  49  GLY  HA2   2.8 #peak 387
49  GLY  HA2 50  ASN  H    3.0 #peak 388
49  GLY  HA2 51  GLY  H    4.4 #peak 389
49  GLY  H  51  GLY  H    5.9 #peak 390
#resid 50
50  ASN  H  50  ASN  HA    2.9 #peak 391
50  ASN  H  50  ASN  HB2   3.6 #peak 392
50  ASN  H  50  ASN  HB3   3.0 #peak 393
50  ASN  HB2 51  GLY  H    4.3 #peak 394 
50  ASN  HB3 51  GLY  H    4.6 #peak 395
50  ASN  H  51  GLY  H    3.9 #peak 396
#resid 51
51  GLY  H  51  GLY  HA2   2.8 #peak 397
51  GLY  H  51  GLY  HA3   2.8 #peak 398
51  GLY  HA2 52  GLU  H    3.5 #peak 399
51  GLY  HA3 52  GLU  H    3.5 #peak 400
51  GLY  H  52  GLU  H    3.4 #peak 401
#resid 52
52  GLU  H  52  GLU  HA    2.9 #peak 402
52  GLU  H  52  GLU  HB2   3.9 #peak 403
52  GLU  H  52  GLU  HB3   3.5 #peak 404
52  GLU  H  52  GLU  HG2   4.4 #peak 405
52  GLU  HA  53  ILE  H    3.0 #peak 406
52  GLU  HB3 53  ILE  H    4.4 #peak 407
#resid 53
53  ILE  H  53  ILE  HA    3.0 #peak 408
53  ILE  H  53  ILE  HB    3.0 #peak 409
53  ILE  H  53  ILE  HG2   4.0 #peak 410
53  ILE  H  53  ILE  HG1   4.5 #peak 411
53  ILE  H  53  ILE  HD1   4.5 #peak 412
53  ILE  HA  54  ASP  H    2.8 #peak 413
53  ILE  HG2 54  ASP  H    3.1 #peak 414
53  ILE  HG1 54  ASP  H    4.5 #peak 415
#resid 54
54  ASP  H  54  ASP  HA    2.9 #peak 416
54  ASP  H  54  ASP  HB2   3.0 #peak 417
54  ASP  H  54  ASP  HB3   3.5 #peak 418
54  ASP  HA  55  GLN  H    2.8 #peak 419
54  ASP  HB2 55  GLN  H    3.8 #peak 420
54  ASP  HB3 55  GLN  H    3.5 #peak 421
#resid 55
55  GLN  H  55  GLN  HA    2.8 #peak 422
55  GLN  H  55  GLN  HB2   3.6 #peak 423
55  GLN  H  55  GLN  HB3   3.2 #peak 424
55  GLN  H  55  GLN  HG2   3.5 #peak 425
55  GLN  H  56  ASN  H    2.8 #peak 426 
55  GLN  H  57  GLU  H    4.5 #peak 427
55  GLN  HA  58  PHE  HB2   3.5 #peak 428
55  GLN  HB2 58  PHE  H    5.4 #peak 429
#resid 56
56  ASN  H  56  ASN  HA    2.8 #peak 430
56  ASN  H  56  ASN  HB2   3.0 #peak 431
56  ASN  H  56  ASN  HB3   3.2 #peak 432
56  ASN  HA  57  GLU  H    3.5 #peak 433
56  ASN  HB2 57  GLU  H    3.5 #peak 434
56  ASN  HB3 57  GLU  H    3.5 #peak 435
56  ASN  H  57  GLU  H    2.8 #peak 436
56  ASN  HA  59  ALA  HB    3.5 #peak 437
#resid 57
57  GLU  H  57  GLU  HA    2.8 #peak 438
57  GLU  H  57  GLU  HB2   3.2 #peak 439
57  GLU  H  57  GLU  HG2   4.0 #peak 440
57  GLU  HA  58  PHE  H    3.5 #peak 441
57  GLU  HB2 58  PHE  H    3.5 #peak 442
57  GLU  H  58  PHE  H    2.8 #peak 443
57  GLU  HA  60  LYS  HB2   3.7 #peak 444
#resid 58
58  PHE  H  58  PHE  HA    2.8 #peak 445
58  PHE  H  58  PHE  HB3   3.0 #peak 446
58  PHE  HA  59  ALA  H    3.5 #peak 447
58  PHE  HB2 59  ALA  H    3.8 #peak 448
58  PHE  H  59  ALA  H    2.8 #peak 449
58  PHE  HA  61  PHE  HB2   3.7 #peak 450
#resid 59
59  ALA  H  59  ALA  HA    2.8 #peak 451
59  ALA  H  59  ALA  HB    3.0 #peak 452
59  ALA  HB  60  LYS  H    3.5 #peak 453
59  ALA  H  60  LYS  H    2.8 #peak 454
59  ALA  HA  62  TYR  H    3.4 #peak 455
59  ALA  HA  62  TYR  HB    3.5 #peak 456
59  ALA  HB  62  TYR  H    4.5 #peak 457
#resid 60
60  LYS  H  60  LYS  HA    2.8 #peak 458
60  LYS  H  60  LYS  HB2   3.0 #peak 459
60  LYS  H  60  LYS  HG2   4.1 #peak 460
60  LYS  H  60  LYS  HD2   4.1 #peak 461
60  LYS  HA  61  PHE  H    3.4 #peak 462
60  LYS  HB2 61  PHE  H    3.5 #peak 463
60  LYS  H  61  PHE  H    2.8 #peak 464
#resid 61
61  PHE  H  61  PHE  HA    2.9 #peak 465
61  PHE  H  61  PHE  HB2   3.0 #peak 466
61  PHE  H  61  PHE  HB2   3.3 #peak 467
61  PHE  H  62  TYR  H    2.8 #peak 468
#resid 62
62  TYR  H  62  TYR  HA    2.8 #peak 469
62  TYR  H  62  TYR  HB2   3.0 #peak 470
62  TYR  H  62  TYR  HB2   3.0 #peak 471
#resid 63
63  GLY  H  63  GLY  HA2   2.8 #peak 472
63  GLY  H  63  GLY  HA3   3.0 #peak 473
63  GLY  H  64  SER  H    2.8 #peak 474
63  GLY  HA2 64  SER  H    3.2 #peak 475
63  GLY  HA3 65  ILE  H    4.2 #peak 476
#resid 64
64  SER  H  64  SER  HA    2.9 #peak 477
64  SER  H  64  SER  HB2   3.3 #peak 478
64  SER  H  64  SER  HB3   3.4 #peak 479
64  SER  HA  65  ILE  H    3.0 #peak 480
#resid 65
65  ILE  H  65  ILE  HA    2.9 #peak 481
65  ILE  H  65  ILE  HB    3.0 #peak 482
65  ILE  H  65  ILE  HG2   4.0 #peak 483
65  ILE  H  66  GLN  H    2.8 #peak 484
65  ILE  HA  66  GLN  H    3.0 #peak 485
#resid 66
66  GLN  H  66  GLN  HA    2.8 #peak 486
66  GLN  H  66  GLN  HB2   3.5 #peak 487
66  GLN  H  66  GLN  HG2   3.5 #peak 488
#
#
#N-ter (Y81F)-EhCaBP1 H-bond constraints
#resid 4
4 ALA O 8 GLU N 3.0 #peak 1001
4 ALA O 8 GLU H 2.0 #peak 1002
#resid 5
5 LEU O 9 ILE N 3.0 #peak 1003
5 LEU O 9 ILE H 2.0 #peak 1004
#resid 17 
17  VAL  N  53  ILE  O  3.0 #peak 1005
17  VAL  H  53  ILE  O  2.0 #peak 1006
17  VAL  O  53  ILE  N  3.0 #peak 1007
17  VAL  O  53  ILE  H  2.0 #peak 1008 
#resid 19
19  TYR  O  23  LYS  N  3.0 #peak 1009
19  TYR  O  23  LYS  H  2.1 #peak 1010
#resid 20
20  GLU  O  24  ALA  N  3.0 #peak 1011
20  GLU  O  24  ALA  H  2.0 #peak 1012
#resid 21
21  GLU  O  25  PHE  N  3.0 #peak 1013
21  GLU  O  25  PHE  H  2.0 #peak 1014
#resid 22
22  VAL  O  26  VAL  N  3.3 #peak 1015
22  VAL  O  26  VAL  H  2.3 #peak 1016
#resid 23
23  LYS  O  27  SER  N  3.0 #peak 1017
23  LYS  O  27  SER  H  2.2 #peak 1018
#resid 34
34  ASN  O  38  LEU  N  3.0 #peak 1019
34  ASN  O  38  LEU  H  2.2 #peak 1020
#resid 35
35  GLU  O  39  GLN  N  3.1 #peak 1021
35  GLU  O  39  GLN  H  2.2 #peak 1022
#resid 36
36  GLN  O  40  LEU  N  3.0 #peak 1023
36  GLN  O  40  LEU  H  2.0 #peak 1024
#resid 37 
37  LEU  O  41  ILE  N  3.0 #peak 1025
37  LEU  O  41  ILE  H  2.0 #peak 1026
#resid 38
38  LEU  O  42  PHE  N  3.0 #peak 1027
38  LEU  O  42  PHE  H  2.0 #peak 1028
#resid 39
39  GLN  O  43  LYS  N  3.1 #peak 1029
39  GLN  O  43  LYS  H  2.2 #peak 1030
#resid 40
40  LEU  O  44  SER  N  3.0 #peak 1031
40  LEU  O  44  SER  H  2.0 #peak 1032
#resid 41
41  ILE  O  45  ILE  N  3.0 #peak 1033
41  ILE  O  45  ILE  H  2.0 #peak 1034
#resid 55
55  GLN  O  59  ALA  N  3.0 #peak 1035
55  GLN  O  59  ALA  H  2.0 #peak 1036
#resid 56
56  ASN  O  60  LYS  N  3.0 #peak 1037
56  ASN  O  60  LYS  H  2.0 #peak 1038
#resid 57
57  GLU  O  61  PHE  N  3.0 #peak 1039
57  GLU  O  61  PHE  H  2.1 #peak 1040
#resid 58 
58  PHE  O  62  TYR  N  3.0 #peak 1041
58  PHE  O  62  TYR  H  2.0 #peak 1042
#
#
#N-ter (Y81F)-EhCaBP1 Ca2+ co-ordination constraints
#ORI 250 EF-I: 10 - 12 - 14 - 16 - - - - 21
250 ORI  A0    10 ASP  CG     3.0 #peak 2001
250 ORI  A0    10 ASP  OD1    2.8 #peak 2502 
250 ORI  A0    10 ASP  OD2    2.8 #peak 2503
250 ORI  A0    12 ASN  CG     3.0 #peak 2004
250 ORI  A0    12 ASN  OD1    2.8 #peak 2505 
250 ORI  A0    14 ASP  CG     3.0 #peak 2007
250 ORI  A0    14 ASP  OD1    2.8 #peak 2508 
250 ORI  A0    14 ASP  OD2    2.8 #peak 2509
250 ORI  A0    16 ALA  O      2.8 #peak 2510
250 ORI  A0    21 GLU  OE1    2.8 #peak 2511
250 ORI  A0    21 GLU  OE2    2.8 #peak 2512
250 ORI  A0    21 GLU  CD     3.0 #peak 2513
#ORI 300 EF-II: 46 - 48 - 50 - 52 - - - - 57
300 ORI  A0    46 ASP  CG     3.6 #peak 2014
300 ORI  A0    46 ASP  OD1    3.4 #peak 2515 
300 ORI  A0    46 ASP  OD2    3.4 #peak 2516
300 ORI  A0    48 ASP  CG     3.4 #peak 2017
300 ORI  A0    48 ASP  OD1    3.4 #peak 2018 
300 ORI  A0    48 ASP  OD2    3.3 #peak 2019
300 ORI  A0    50 ASN  CG     3.0 #peak 2020
300 ORI  A0    50 ASN  OD1    2.8 #peak 2021 
300 ORI  A0    52 GLU  OE1    3.2 #peak 2022
300 ORI  A0    52 GLU  OE2    3.3 #peak 2023
300 ORI  A0    52 GLU  CD     3.5 #peak 2024
300 ORI  A0    57 GLU  OE1    3.2 #peak 2025
300 ORI  A0    57 GLU  OE2    3.2 #peak 2026
300 ORI  A0    57 GLU  CD     3.3 #peak 2027

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H        MET   1  -0.723 -14.103  -4.341
    2    HA   MET   1           HA       MET   1   0.590 -14.324  -6.194
    3    HB2  MET   1           1HB      MET   1  -2.010 -14.991  -7.584
    4    HB3  MET   1           2HB      MET   1  -0.416 -15.131  -8.314
    5    HG2  MET   1           1HG      MET   1   0.210 -16.814  -6.688
    6    HG3  MET   1           2HG      MET   1  -1.348 -16.641  -5.884
    7    HE1  MET   1           3HE      MET   1  -0.812 -20.102  -7.952
    8    HE2  MET   1           1HE      MET   1   0.056 -19.146  -6.751
    9    HE3  MET   1           2HE      MET   1  -1.594 -19.678  -6.428
   10    H    ALA   2           H        ALA   2  -2.325 -12.415  -6.364
   11    HA   ALA   2           HA       ALA   2  -0.869 -10.430  -7.983
   12    HB1  ALA   2           3HB      ALA   2  -3.666 -11.431  -8.270
   13    HB2  ALA   2           1HB      ALA   2  -3.278  -9.774  -8.735
   14    HB3  ALA   2           2HB      ALA   2  -2.448 -11.126  -9.508
   15    H    GLU   3           H        GLU   3  -4.000 -10.434  -6.291
   16    HA   GLU   3           HA       GLU   3  -3.202  -7.952  -4.956
   17    HB2  GLU   3           1HB      GLU   3  -5.564  -7.601  -4.528
   18    HB3  GLU   3           2HB      GLU   3  -5.313  -7.944  -6.233
   19    HG2  GLU   3           1HG      GLU   3  -5.807 -10.384  -4.821
   20    HG3  GLU   3           2HG      GLU   3  -7.072  -9.212  -4.459
   21    H    ALA   4           H        ALA   4  -3.805 -11.278  -4.356
   22    HA   ALA   4           HA       ALA   4  -4.631 -11.319  -1.716
   23    HB1  ALA   4           3HB      ALA   4  -3.783 -13.538  -1.593
   24    HB2  ALA   4           1HB      ALA   4  -4.356 -13.290  -3.243
   25    HB3  ALA   4           2HB      ALA   4  -2.628 -13.236  -2.891
   26    H    LEU   5           H        LEU   5  -1.555 -10.434  -3.038
   27    HA   LEU   5           HA       LEU   5   0.068 -10.825  -0.776
   28    HB2  LEU   5           1HB      LEU   5   0.502  -8.555  -2.671
   29    HB3  LEU   5           2HB      LEU   5   1.690  -9.585  -1.876
   30    HG   LEU   5           HG       LEU   5  -0.049 -10.282  -4.238
   31   HD11  LEU   5          1HD1      LEU   5   2.924 -10.465  -4.150
   32   HD12  LEU   5          2HD1      LEU   5   2.163  -8.890  -4.371
   33   HD13  LEU   5          3HD1      LEU   5   1.849 -10.190  -5.521
   34   HD21  LEU   5          3HD2      LEU   5   1.458 -12.408  -4.106
   35   HD22  LEU   5          1HD2      LEU   5  -0.011 -12.303  -3.136
   36   HD23  LEU   5          2HD2      LEU   5   1.560 -11.994  -2.394
   37    H    PHE   6           H        PHE   6  -1.978  -8.135  -1.777
   38    HA   PHE   6           HA       PHE   6  -1.130  -6.283   0.168
   39    HB2  PHE   6           1HB      PHE   6  -2.355  -5.344  -1.585
   40    HB3  PHE   6           2HB      PHE   6  -3.610  -6.575  -1.497
   41    HD1  PHE   6           HD1      PHE   6  -5.240  -6.525   0.393
   42    HD2  PHE   6           HD2      PHE   6  -2.518  -3.341  -0.363
   43    HE1  PHE   6           HE1      PHE   6  -6.620  -5.023   1.769
   44    HE2  PHE   6           HE2      PHE   6  -3.893  -1.834   1.013
   45    HZ   PHE   6           HZ       PHE   6  -5.947  -2.675   2.081
   46    H    LYS   7           H        LYS   7  -3.820  -8.600   0.147
   47    HA   LYS   7           HA       LYS   7  -4.695  -7.922   2.782
   48    HB2  LYS   7           1HB      LYS   7  -5.406  -9.957   0.737
   49    HB3  LYS   7           2HB      LYS   7  -5.818 -10.327   2.406
   50    HG2  LYS   7           1HG      LYS   7  -6.633  -7.804   0.981
   51    HG3  LYS   7           2HG      LYS   7  -7.644  -9.244   1.125
   52    HD2  LYS   7           1HD      LYS   7  -6.536  -7.657   3.440
   53    HD3  LYS   7           2HD      LYS   7  -8.183  -7.533   2.818
   54    HE2  LYS   7           1HE      LYS   7  -7.954 -10.214   3.207
   55    HE3  LYS   7           2HE      LYS   7  -6.944  -9.590   4.511
   56    HZ1  LYS   7           3HZ      LYS   7  -9.771  -9.631   4.307
   57    HZ2  LYS   7           1HZ      LYS   7  -9.226  -8.043   4.516
   58    HZ3  LYS   7           2HZ      LYS   7  -8.803  -9.237   5.637
   59    H    GLU   8           H        GLU   8  -2.377 -10.130   1.446
   60    HA   GLU   8           HA       GLU   8  -2.184 -11.881   3.673
   61    HB2  GLU   8           1HB      GLU   8  -1.365 -12.378   1.353
   62    HB3  GLU   8           2HB      GLU   8  -0.040 -11.259   1.639
   63    HG2  GLU   8           1HG      GLU   8   0.659 -12.661   3.561
   64    HG3  GLU   8           2HG      GLU   8  -0.594 -13.819   3.117
   65    H    ILE   9           H        ILE   9  -0.438  -8.957   2.715
   66    HA   ILE   9           HA       ILE   9   1.445  -9.030   4.833
   67    HB   ILE   9           HB       ILE   9   0.484  -6.731   3.131
   68   HG12  ILE   9          1HG1      ILE   9   1.706  -8.587   1.988
   69   HG13  ILE   9          2HG1      ILE   9   2.544  -7.041   1.911
   70   HG21  ILE   9          1HG2      ILE   9   1.298  -5.739   5.116
   71   HG22  ILE   9          2HG2      ILE   9   2.660  -6.855   5.202
   72   HG23  ILE   9          3HG2      ILE   9   2.607  -5.625   3.940
   73   HD11  ILE   9          3HD1      ILE   9   3.302  -8.696   4.195
   74   HD12  ILE   9          1HD1      ILE   9   3.673  -9.405   2.624
   75   HD13  ILE   9          2HD1      ILE   9   4.304  -7.812   3.044
   76    H    ASP  10           H        ASP  10  -1.843  -8.001   4.617
   77    HA   ASP  10           HA       ASP  10  -1.769  -6.314   6.949
   78    HB2  ASP  10           1HB      ASP  10  -3.906  -7.311   5.106
   79    HB3  ASP  10           2HB      ASP  10  -4.366  -6.647   6.671
   80    H    VAL  11           H        VAL  11  -0.729  -7.955   8.326
   81    HA   VAL  11           HA       VAL  11  -1.989 -10.357   9.068
   82    HB   VAL  11           HB       VAL  11  -0.195  -8.691  10.832
   83   HG11  VAL  11          1HG1      VAL  11  -1.209 -11.473  10.881
   84   HG12  VAL  11          2HG1      VAL  11   0.468 -11.217  11.366
   85   HG13  VAL  11          3HG1      VAL  11  -0.833 -10.378  12.212
   86   HG21  VAL  11          3HG2      VAL  11   1.239  -8.867   9.092
   87   HG22  VAL  11          1HG2      VAL  11   1.473 -10.492   9.738
   88   HG23  VAL  11          2HG2      VAL  11   0.378 -10.232   8.380
   89    H    ASN  12           H        ASN  12  -2.764  -7.119   9.777
   90    HA   ASN  12           HA       ASN  12  -4.105  -7.663  12.278
   91    HB2  ASN  12           1HB      ASN  12  -4.960  -5.258  11.883
   92    HB3  ASN  12           2HB      ASN  12  -3.238  -5.486  12.177
   93   HD21  ASN  12          2HD2      ASN  12  -2.887  -3.467  11.156
   94   HD22  ASN  12          1HD2      ASN  12  -2.892  -3.336   9.433
   95    H    GLY  13           H        GLY  13  -4.821  -8.410   9.177
   96    HA2  GLY  13           1HA      GLY  13  -6.751  -8.895   8.027
   97    HA3  GLY  13           2HA      GLY  13  -7.408  -9.259   9.616
   98    H    ASP  14           H        ASP  14  -6.386  -6.178   8.167
   99    HA   ASP  14           HA       ASP  14  -9.062  -5.121   8.784
  100    HB2  ASP  14           1HB      ASP  14  -7.952  -2.879   8.691
  101    HB3  ASP  14           2HB      ASP  14  -7.341  -3.926   9.969
  102    H    GLY  15           H        GLY  15  -6.942  -5.938   6.245
  103    HA2  GLY  15           1HA      GLY  15  -7.180  -5.820   3.963
  104    HA3  GLY  15           2HA      GLY  15  -8.851  -5.350   4.243
  105    H    ALA  16           H        ALA  16  -6.424  -3.414   5.714
  106    HA   ALA  16           HA       ALA  16  -6.562  -1.457   3.526
  107    HB1  ALA  16           3HB      ALA  16  -7.620  -1.172   6.237
  108    HB2  ALA  16           1HB      ALA  16  -6.567   0.151   5.734
  109    HB3  ALA  16           2HB      ALA  16  -7.987  -0.261   4.772
  110    H    VAL  17           H        VAL  17  -4.691  -0.422   3.099
  111    HA   VAL  17           HA       VAL  17  -2.463  -0.786   4.994
  112    HB   VAL  17           HB       VAL  17  -2.392  -0.977   1.983
  113   HG11  VAL  17          1HG1      VAL  17   0.123  -1.526   3.264
  114   HG12  VAL  17          2HG1      VAL  17  -0.247  -0.394   1.962
  115   HG13  VAL  17          3HG1      VAL  17  -0.418   0.109   3.644
  116   HG21  VAL  17          3HG2      VAL  17  -1.213  -3.009   3.798
  117   HG22  VAL  17          1HG2      VAL  17  -2.970  -2.941   3.669
  118   HG23  VAL  17          2HG2      VAL  17  -1.990  -3.208   2.228
  119    H    SER  18           H        SER  18  -1.973   1.132   5.825
  120    HA   SER  18           HA       SER  18  -2.500   3.577   4.374
  121    HB2  SER  18           1HB      SER  18  -1.086   4.231   6.693
  122    HB3  SER  18           2HB      SER  18  -2.838   4.256   6.488
  123    HG   SER  18           HG       SER  18  -2.733   2.831   8.048
  124    H    TYR  19           H        TYR  19  -0.681   5.327   4.655
  125    HA   TYR  19           HA       TYR  19   1.341   4.795   2.878
  126    HB2  TYR  19           1HB      TYR  19   2.479   6.799   3.782
  127    HB3  TYR  19           2HB      TYR  19   0.758   7.064   3.529
  128    HD1  TYR  19           HD2      TYR  19  -0.782   7.081   5.500
  129    HD2  TYR  19           HD1      TYR  19   3.449   6.999   5.938
  130    HE1  TYR  19           HE2      TYR  19  -1.015   7.825   7.832
  131    HE2  TYR  19           HE1      TYR  19   3.228   7.740   8.273
  132    HH   TYR  19           HH       TYR  19   1.801   8.605   9.803
  133    H    GLU  20           H        GLU  20   1.492   4.609   6.421
  134    HA   GLU  20           HA       GLU  20   4.203   3.932   6.633
  135    HB2  GLU  20           1HB      GLU  20   1.867   3.953   8.372
  136    HB3  GLU  20           2HB      GLU  20   2.959   2.627   8.745
  137    HG2  GLU  20           1HG      GLU  20   4.681   4.730   8.468
  138    HG3  GLU  20           2HG      GLU  20   3.264   5.492   9.188
  139    H    GLU  21           H        GLU  21   1.325   1.845   6.499
  140    HA   GLU  21           HA       GLU  21   2.615  -0.613   6.710
  141    HB2  GLU  21           1HB      GLU  21   0.023   0.293   5.540
  142    HB3  GLU  21           2HB      GLU  21   0.566  -1.345   5.202
  143    HG2  GLU  21           1HG      GLU  21   0.914  -1.048   7.939
  144    HG3  GLU  21           2HG      GLU  21  -0.617  -0.248   7.593
  145    H    VAL  22           H        VAL  22   2.067   1.442   3.905
  146    HA   VAL  22           HA       VAL  22   2.876  -0.397   1.926
  147    HB   VAL  22           HB       VAL  22   2.890   2.620   1.948
  148   HG11  VAL  22          1HG1      VAL  22   4.394   2.345   0.271
  149   HG12  VAL  22          2HG1      VAL  22   3.874   0.695  -0.076
  150   HG13  VAL  22          3HG1      VAL  22   2.923   2.061  -0.659
  151   HG21  VAL  22          3HG2      VAL  22   0.885   2.460   0.678
  152   HG22  VAL  22          1HG2      VAL  22   1.082   0.720   0.469
  153   HG23  VAL  22          2HG2      VAL  22   0.704   1.380   2.060
  154    H    LYS  23           H        LYS  23   4.680   2.283   3.439
  155    HA   LYS  23           HA       LYS  23   7.133   1.824   2.219
  156    HB2  LYS  23           1HB      LYS  23   6.138   3.363   4.458
  157    HB3  LYS  23           2HB      LYS  23   7.727   2.699   4.816
  158    HG2  LYS  23           1HG      LYS  23   7.084   4.271   2.332
  159    HG3  LYS  23           2HG      LYS  23   7.753   4.974   3.807
  160    HD2  LYS  23           1HD      LYS  23   9.037   2.772   2.191
  161    HD3  LYS  23           2HD      LYS  23   9.485   4.478   2.120
  162    HE2  LYS  23           1HE      LYS  23   9.692   2.637   4.499
  163    HE3  LYS  23           2HE      LYS  23  11.023   3.316   3.563
  164    HZ1  LYS  23           3HZ      LYS  23   9.527   4.482   5.708
  165    HZ2  LYS  23           1HZ      LYS  23   9.600   5.496   4.356
  166    HZ3  LYS  23           2HZ      LYS  23  11.027   4.934   5.069
  167    H    ALA  24           H        ALA  24   5.707   0.326   5.066
  168    HA   ALA  24           HA       ALA  24   8.034  -1.066   5.901
  169    HB1  ALA  24           3HB      ALA  24   5.512  -0.652   6.934
  170    HB2  ALA  24           1HB      ALA  24   5.535  -2.381   6.585
  171    HB3  ALA  24           2HB      ALA  24   6.768  -1.675   7.632
  172    H    PHE  25           H        PHE  25   5.293  -1.932   3.837
  173    HA   PHE  25           HA       PHE  25   5.769  -4.628   3.483
  174    HB2  PHE  25           1HB      PHE  25   3.811  -3.351   2.591
  175    HB3  PHE  25           2HB      PHE  25   4.856  -2.722   1.321
  176    HD1  PHE  25           HD1      PHE  25   5.773  -6.022   2.163
  177    HD2  PHE  25           HD2      PHE  25   2.928  -3.771  -0.063
  178    HE1  PHE  25           HE1      PHE  25   5.288  -8.003   0.786
  179    HE2  PHE  25           HE2      PHE  25   2.437  -5.748  -1.442
  180    HZ   PHE  25           HZ       PHE  25   3.617  -7.868  -1.018
  181    H    VAL  26           H        VAL  26   7.056  -1.942   1.531
  182    HA   VAL  26           HA       VAL  26   8.702  -3.604  -0.084
  183    HB   VAL  26           HB       VAL  26   7.865  -1.088  -0.386
  184   HG11  VAL  26          1HG1      VAL  26   9.553   0.534   0.010
  185   HG12  VAL  26          2HG1      VAL  26   9.340  -0.356   1.519
  186   HG13  VAL  26          3HG1      VAL  26  10.722  -0.700   0.478
  187   HG21  VAL  26          3HG2      VAL  26  10.526  -1.570  -1.583
  188   HG22  VAL  26          1HG2      VAL  26   9.298  -2.805  -1.857
  189   HG23  VAL  26          2HG2      VAL  26   8.998  -1.139  -2.350
  190    H    SER  27           H        SER  27   9.135  -1.991   2.976
  191    HA   SER  27           HA       SER  27  11.949  -2.026   3.087
  192    HB2  SER  27           1HB      SER  27   9.758  -1.443   4.887
  193    HB3  SER  27           2HB      SER  27  11.029  -2.339   5.719
  194    HG   SER  27           HG       SER  27  12.271  -0.647   5.607
  195    H    LYS  28           H        LYS  28   9.591  -4.508   3.450
  196    HA   LYS  28           HA       LYS  28  11.178  -6.317   4.985
  197    HB2  LYS  28           1HB      LYS  28   8.699  -6.636   3.306
  198    HB3  LYS  28           2HB      LYS  28   9.484  -8.014   4.065
  199    HG2  LYS  28           1HG      LYS  28   8.478  -5.595   5.548
  200    HG3  LYS  28           2HG      LYS  28   7.585  -7.107   5.363
  201    HD2  LYS  28           1HD      LYS  28  10.288  -6.816   6.675
  202    HD3  LYS  28           2HD      LYS  28   8.749  -6.980   7.524
  203    HE2  LYS  28           1HE      LYS  28   8.786  -9.102   5.732
  204    HE3  LYS  28           2HE      LYS  28  10.440  -9.011   6.334
  205    HZ1  LYS  28           3HZ      LYS  28   9.794  -9.496   8.453
  206    HZ2  LYS  28           1HZ      LYS  28   8.624 -10.370   7.600
  207    HZ3  LYS  28           2HZ      LYS  28   8.237  -8.863   8.263
  208    H    LYS  29           H        LYS  29  11.455  -5.221   1.853
  209    HA   LYS  29           HA       LYS  29  12.737  -7.705   0.932
  210    HB2  LYS  29           1HB      LYS  29  12.060  -5.351  -0.817
  211    HB3  LYS  29           2HB      LYS  29  12.365  -7.016  -1.295
  212    HG2  LYS  29           1HG      LYS  29   9.945  -5.955   0.146
  213    HG3  LYS  29           2HG      LYS  29  10.026  -6.565  -1.509
  214    HD2  LYS  29           1HD      LYS  29  10.536  -8.178   0.991
  215    HD3  LYS  29           2HD      LYS  29   9.063  -8.221   0.020
  216    HE2  LYS  29           1HE      LYS  29  10.440  -8.952  -1.919
  217    HE3  LYS  29           2HE      LYS  29  11.834  -9.041  -0.843
  218    HZ1  LYS  29           3HZ      LYS  29  10.347 -10.585   0.536
  219    HZ2  LYS  29           1HZ      LYS  29  11.036 -11.197  -0.883
  220    HZ3  LYS  29           2HZ      LYS  29   9.412 -10.724  -0.867
  221    H    ARG  30           H        ARG  30  13.296  -4.438   1.849
  222    HA   ARG  30           HA       ARG  30  16.088  -4.745   1.939
  223    HB2  ARG  30           1HB      ARG  30  16.694  -3.074   0.172
  224    HB3  ARG  30           2HB      ARG  30  16.088  -4.603  -0.451
  225    HG2  ARG  30           1HG      ARG  30  13.818  -3.048  -0.223
  226    HG3  ARG  30           2HG      ARG  30  15.053  -1.918  -0.782
  227    HD2  ARG  30           1HD      ARG  30  14.142  -4.476  -2.075
  228    HD3  ARG  30           2HD      ARG  30  14.063  -2.839  -2.724
  229    HE   ARG  30           HE       ARG  30  16.714  -3.234  -2.375
  230   HH11  ARG  30          1HH1      ARG  30  14.216  -5.057  -3.972
  231   HH12  ARG  30          2HH1      ARG  30  15.284  -5.731  -5.158
  232   HH21  ARG  30          1HH2      ARG  30  18.131  -4.114  -3.931
  233   HH22  ARG  30          2HH2      ARG  30  17.511  -5.194  -5.133
  234    H    ALA  31           H        ALA  31  17.068  -2.268   1.877
  235    HA   ALA  31           HA       ALA  31  15.333  -0.767   3.729
  236    HB1  ALA  31           3HB      ALA  31  18.064   0.015   3.987
  237    HB2  ALA  31           1HB      ALA  31  17.006  -0.734   5.183
  238    HB3  ALA  31           2HB      ALA  31  17.956  -1.742   4.090
  239    H    ILE  32           H        ILE  32  14.366   0.612   2.279
  240    HA   ILE  32           HA       ILE  32  16.156   2.585   1.036
  241    HB   ILE  32           HB       ILE  32  14.467   2.735  -0.855
  242   HG12  ILE  32          1HG1      ILE  32  13.735  -0.083  -0.523
  243   HG13  ILE  32          2HG1      ILE  32  13.033   0.970   0.700
  244   HG21  ILE  32          1HG2      ILE  32  16.158   1.755  -1.905
  245   HG22  ILE  32          2HG2      ILE  32  16.650   0.937  -0.423
  246   HG23  ILE  32          3HG2      ILE  32  15.466   0.186  -1.492
  247   HD11  ILE  32          3HD1      ILE  32  12.845   1.745  -2.167
  248   HD12  ILE  32          1HD1      ILE  32  11.774   0.497  -1.529
  249   HD13  ILE  32          2HD1      ILE  32  11.763   2.114  -0.825
  250    H    LYS  33           H        LYS  33  15.775   4.279   2.352
  251    HA   LYS  33           HA       LYS  33  13.106   4.902   3.274
  252    HB2  LYS  33           1HB      LYS  33  15.447   6.743   3.600
  253    HB3  LYS  33           2HB      LYS  33  14.093   6.465   4.687
  254    HG2  LYS  33           1HG      LYS  33  15.073   4.111   4.979
  255    HG3  LYS  33           2HG      LYS  33  16.537   4.789   4.262
  256    HD2  LYS  33           1HD      LYS  33  15.815   6.656   6.169
  257    HD3  LYS  33           2HD      LYS  33  15.449   5.111   6.940
  258    HE2  LYS  33           1HE      LYS  33  17.742   4.347   6.343
  259    HE3  LYS  33           2HE      LYS  33  18.082   5.971   5.746
  260    HZ1  LYS  33           3HZ      LYS  33  17.936   6.862   7.880
  261    HZ2  LYS  33           1HZ      LYS  33  18.785   5.416   8.108
  262    HZ3  LYS  33           2HZ      LYS  33  17.145   5.506   8.510
  263    H    ASN  34           H        ASN  34  11.765   5.700   1.769
  264    HA   ASN  34           HA       ASN  34  12.712   7.996   0.186
  265    HB2  ASN  34           1HB      ASN  34  10.729   5.878  -0.676
  266    HB3  ASN  34           2HB      ASN  34  11.197   7.289  -1.621
  267   HD21  ASN  34          2HD2      ASN  34  11.674   4.093  -1.298
  268   HD22  ASN  34          1HD2      ASN  34  13.262   3.952  -1.965
  269    H    GLU  35           H        GLU  35  11.874   9.674   1.300
  270    HA   GLU  35           HA       GLU  35   9.293   9.590   2.532
  271    HB2  GLU  35           1HB      GLU  35  11.551  11.175   2.790
  272    HB3  GLU  35           2HB      GLU  35  10.372  12.259   2.064
  273    HG2  GLU  35           1HG      GLU  35   9.543  10.616   4.397
  274    HG3  GLU  35           2HG      GLU  35  10.586  12.011   4.667
  275    H    GLN  36           H        GLN  36  10.623  11.048  -0.404
  276    HA   GLN  36           HA       GLN  36   8.205  12.353  -1.156
  277    HB2  GLN  36           1HB      GLN  36  10.195  13.256  -2.055
  278    HB3  GLN  36           2HB      GLN  36  10.747  11.687  -2.623
  279    HG2  GLN  36           1HG      GLN  36   9.682  11.894  -4.562
  280    HG3  GLN  36           2HG      GLN  36   8.204  12.463  -3.788
  281   HE21  GLN  36          2HE2      GLN  36   8.067  13.878  -5.646
  282   HE22  GLN  36          1HE2      GLN  36   8.940  15.368  -5.643
  283    H    LEU  37           H        LEU  37   9.814   9.383  -2.276
  284    HA   LEU  37           HA       LEU  37   7.871   8.640  -4.156
  285    HB2  LEU  37           1HB      LEU  37   9.556   6.734  -2.551
  286    HB3  LEU  37           2HB      LEU  37   8.890   6.491  -4.165
  287    HG   LEU  37           HG       LEU  37  11.133   8.356  -3.398
  288   HD11  LEU  37          1HD1      LEU  37  11.641   6.394  -5.460
  289   HD12  LEU  37          2HD1      LEU  37  11.157   5.637  -3.943
  290   HD13  LEU  37          3HD1      LEU  37  12.536   6.735  -3.979
  291   HD21  LEU  37          3HD2      LEU  37  11.159   8.326  -6.081
  292   HD22  LEU  37          1HD2      LEU  37  10.319   9.553  -5.133
  293   HD23  LEU  37          2HD2      LEU  37   9.423   8.187  -5.799
  294    H    LEU  38           H        LEU  38   8.143   8.007  -0.701
  295    HA   LEU  38           HA       LEU  38   6.082   6.110  -0.485
  296    HB2  LEU  38           1HB      LEU  38   7.642   6.427   1.307
  297    HB3  LEU  38           2HB      LEU  38   7.155   8.111   1.494
  298    HG   LEU  38           HG       LEU  38   6.338   6.341   3.202
  299   HD11  LEU  38          1HD1      LEU  38   4.659   7.769   3.792
  300   HD12  LEU  38          2HD1      LEU  38   4.087   7.963   2.135
  301   HD13  LEU  38          3HD1      LEU  38   5.546   8.799   2.668
  302   HD21  LEU  38          3HD2      LEU  38   5.430   5.030   1.052
  303   HD22  LEU  38          1HD2      LEU  38   4.000   5.992   1.427
  304   HD23  LEU  38          2HD2      LEU  38   4.677   4.908   2.643
  305    H    GLN  39           H        GLN  39   6.036   9.643  -0.101
  306    HA   GLN  39           HA       GLN  39   3.302   9.865   0.517
  307    HB2  GLN  39           1HB      GLN  39   5.393  11.603   0.428
  308    HB3  GLN  39           2HB      GLN  39   4.496  12.091  -1.004
  309    HG2  GLN  39           1HG      GLN  39   3.337  11.878   1.765
  310    HG3  GLN  39           2HG      GLN  39   3.891  13.371   1.008
  311   HE21  GLN  39          2HE2      GLN  39   1.283  11.359   1.529
  312   HE22  GLN  39          1HE2      GLN  39   0.203  12.011   0.349
  313    H    LEU  40           H        LEU  40   5.001  10.310  -2.583
  314    HA   LEU  40           HA       LEU  40   2.715  10.788  -4.134
  315    HB2  LEU  40           1HB      LEU  40   5.381  10.827  -4.590
  316    HB3  LEU  40           2HB      LEU  40   4.929   9.347  -5.435
  317    HG   LEU  40           HG       LEU  40   3.883  12.125  -5.971
  318   HD11  LEU  40          1HD1      LEU  40   6.009  11.979  -6.924
  319   HD12  LEU  40          2HD1      LEU  40   4.916  11.565  -8.244
  320   HD13  LEU  40          3HD1      LEU  40   5.787  10.292  -7.388
  321   HD21  LEU  40          3HD2      LEU  40   2.790  10.952  -7.937
  322   HD22  LEU  40          1HD2      LEU  40   2.058  10.686  -6.354
  323   HD23  LEU  40          2HD2      LEU  40   3.084   9.443  -7.071
  324    H    ILE  41           H        ILE  41   4.553   7.774  -3.657
  325    HA   ILE  41           HA       ILE  41   2.882   6.128  -5.194
  326    HB   ILE  41           HB       ILE  41   4.697   5.476  -2.878
  327   HG12  ILE  41          1HG1      ILE  41   5.749   6.306  -4.966
  328   HG13  ILE  41          2HG1      ILE  41   6.192   4.642  -4.603
  329   HG21  ILE  41          1HG2      ILE  41   3.058   3.751  -2.892
  330   HG22  ILE  41          2HG2      ILE  41   3.118   3.626  -4.650
  331   HG23  ILE  41          3HG2      ILE  41   4.498   3.108  -3.682
  332   HD11  ILE  41          3HD1      ILE  41   4.153   5.547  -6.622
  333   HD12  ILE  41          1HD1      ILE  41   5.761   4.905  -6.960
  334   HD13  ILE  41          2HD1      ILE  41   4.531   3.868  -6.235
  335    H    PHE  42           H        PHE  42   2.672   7.206  -1.869
  336    HA   PHE  42           HA       PHE  42   0.781   5.373  -0.917
  337    HB2  PHE  42           1HB      PHE  42   1.899   6.758   0.665
  338    HB3  PHE  42           2HB      PHE  42   1.377   8.229  -0.150
  339    HD1  PHE  42           HD1      PHE  42  -0.260   5.185   1.269
  340    HD2  PHE  42           HD2      PHE  42  -0.203   9.431   0.980
  341    HE1  PHE  42           HE1      PHE  42  -2.215   5.309   2.758
  342    HE2  PHE  42           HE2      PHE  42  -2.157   9.562   2.470
  343    HZ   PHE  42           HZ       PHE  42  -3.165   7.500   3.361
  344    H    LYS  43           H        LYS  43   0.304   8.603  -2.334
  345    HA   LYS  43           HA       LYS  43  -2.543   8.413  -2.308
  346    HB2  LYS  43           1HB      LYS  43  -0.757  10.464  -2.603
  347    HB3  LYS  43           2HB      LYS  43  -1.335  10.262  -4.252
  348    HG2  LYS  43           1HG      LYS  43  -3.505  10.834  -3.702
  349    HG3  LYS  43           2HG      LYS  43  -3.282  10.449  -1.994
  350    HD2  LYS  43           1HD      LYS  43  -2.882  12.602  -1.609
  351    HD3  LYS  43           2HD      LYS  43  -1.425  12.473  -2.597
  352    HE2  LYS  43           1HE      LYS  43  -2.462  13.325  -4.472
  353    HE3  LYS  43           2HE      LYS  43  -4.069  12.847  -3.929
  354    HZ1  LYS  43           3HZ      LYS  43  -3.843  14.581  -2.169
  355    HZ2  LYS  43           1HZ      LYS  43  -3.922  15.188  -3.746
  356    HZ3  LYS  43           2HZ      LYS  43  -2.436  15.115  -2.941
  357    H    SER  44           H        SER  44  -0.036   7.567  -4.577
  358    HA   SER  44           HA       SER  44  -1.703   7.329  -6.868
  359    HB2  SER  44           1HB      SER  44   1.063   6.431  -6.152
  360    HB3  SER  44           2HB      SER  44   0.290   5.765  -7.590
  361    HG   SER  44           HG       SER  44   0.164   7.785  -8.460
  362    H    ILE  45           H        ILE  45  -0.395   4.944  -4.576
  363    HA   ILE  45           HA       ILE  45  -1.664   2.706  -5.743
  364    HB   ILE  45           HB       ILE  45  -0.625   3.141  -2.944
  365   HG12  ILE  45          1HG1      ILE  45   0.492   1.652  -5.330
  366   HG13  ILE  45          2HG1      ILE  45   1.083   3.185  -4.697
  367   HG21  ILE  45          1HG2      ILE  45  -1.634   0.616  -4.242
  368   HG22  ILE  45          2HG2      ILE  45  -0.731   0.674  -2.729
  369   HG23  ILE  45          3HG2      ILE  45  -2.318   1.436  -2.839
  370   HD11  ILE  45          3HD1      ILE  45   1.186   0.500  -3.348
  371   HD12  ILE  45          1HD1      ILE  45   2.540   1.439  -3.976
  372   HD13  ILE  45          2HD1      ILE  45   1.637   2.021  -2.577
  373    H    ASP  46           H        ASP  46  -2.670   5.037  -3.326
  374    HA   ASP  46           HA       ASP  46  -5.060   3.560  -2.641
  375    HB2  ASP  46           1HB      ASP  46  -3.618   5.255  -1.190
  376    HB3  ASP  46           2HB      ASP  46  -4.720   6.430  -1.903
  377    H    ALA  47           H        ALA  47  -6.866   3.603  -3.789
  378    HA   ALA  47           HA       ALA  47  -7.220   5.245  -6.059
  379    HB1  ALA  47           3HB      ALA  47  -8.250   2.952  -5.552
  380    HB2  ALA  47           1HB      ALA  47  -9.474   3.851  -4.656
  381    HB3  ALA  47           2HB      ALA  47  -9.252   4.142  -6.381
  382    H    ASP  48           H        ASP  48  -8.491   5.414  -2.765
  383    HA   ASP  48           HA       ASP  48  -9.709   8.013  -3.417
  384    HB2  ASP  48           1HB      ASP  48 -11.052   7.687  -1.352
  385    HB3  ASP  48           2HB      ASP  48 -11.323   6.425  -2.551
  386    H    GLY  49           H        GLY  49  -7.153   6.516  -1.755
  387    HA2  GLY  49           1HA      GLY  49  -5.506   7.329  -0.379
  388    HA3  GLY  49           2HA      GLY  49  -5.955   8.922  -0.972
  389    H    ASN  50           H        ASN  50  -8.126   6.784   0.772
  390    HA   ASN  50           HA       ASN  50  -8.541   8.846   2.763
  391    HB2  ASN  50           1HB      ASN  50 -10.338   7.355   3.587
  392    HB3  ASN  50           2HB      ASN  50 -10.490   7.696   1.866
  393   HD21  ASN  50          2HD2      ASN  50 -11.770   5.564   3.003
  394   HD22  ASN  50          1HD2      ASN  50 -11.061   4.092   2.440
  395    H    GLY  51           H        GLY  51  -6.400   8.720   3.711
  396    HA2  GLY  51           1HA      GLY  51  -5.059   8.147   5.489
  397    HA3  GLY  51           2HA      GLY  51  -6.364   7.112   6.052
  398    H    GLU  52           H        GLU  52  -6.585   5.319   3.970
  399    HA   GLU  52           HA       GLU  52  -3.964   4.207   3.428
  400    HB2  GLU  52           1HB      GLU  52  -4.747   1.960   4.405
  401    HB3  GLU  52           2HB      GLU  52  -4.180   3.192   5.524
  402    HG2  GLU  52           1HG      GLU  52  -6.241   1.973   6.233
  403    HG3  GLU  52           2HG      GLU  52  -6.384   3.729   6.195
  404    H    ILE  53           H        ILE  53  -4.130   2.200   2.095
  405    HA   ILE  53           HA       ILE  53  -6.279   2.534   0.157
  406    HB   ILE  53           HB       ILE  53  -3.993   0.598  -0.099
  407   HG12  ILE  53          1HG1      ILE  53  -3.323   2.879  -1.559
  408   HG13  ILE  53          2HG1      ILE  53  -3.877   3.501  -0.008
  409   HG21  ILE  53          1HG2      ILE  53  -4.379   1.350  -2.555
  410   HG22  ILE  53          2HG2      ILE  53  -5.493   0.204  -1.810
  411   HG23  ILE  53          3HG2      ILE  53  -5.941   1.904  -1.951
  412   HD11  ILE  53          3HD1      ILE  53  -1.911   3.020   0.867
  413   HD12  ILE  53          1HD1      ILE  53  -2.176   1.311   0.520
  414   HD13  ILE  53          2HD1      ILE  53  -1.378   2.339  -0.670
  415    H    ASP  54           H        ASP  54  -8.049   1.337   0.267
  416    HA   ASP  54           HA       ASP  54  -8.217  -0.969   1.961
  417    HB2  ASP  54           1HB      ASP  54 -10.240   0.084  -0.027
  418    HB3  ASP  54           2HB      ASP  54 -10.552  -1.064   1.272
  419    H    GLN  55           H        GLN  55  -8.978  -3.080   1.236
  420    HA   GLN  55           HA       GLN  55  -7.344  -4.253  -0.658
  421    HB2  GLN  55           1HB      GLN  55  -8.966  -6.164  -0.599
  422    HB3  GLN  55           2HB      GLN  55  -8.420  -5.619   0.981
  423    HG2  GLN  55           1HG      GLN  55 -10.528  -4.277   1.143
  424    HG3  GLN  55           2HG      GLN  55 -11.072  -5.085  -0.326
  425   HE21  GLN  55          2HE2      GLN  55 -10.515  -5.372   3.060
  426   HE22  GLN  55          1HE2      GLN  55 -11.204  -6.943   3.261
  427    H    ASN  56           H        ASN  56 -10.694  -3.141  -1.026
  428    HA   ASN  56           HA       ASN  56 -11.106  -3.991  -3.651
  429    HB2  ASN  56           1HB      ASN  56 -12.619  -2.697  -1.788
  430    HB3  ASN  56           2HB      ASN  56 -12.331  -1.404  -2.948
  431   HD21  ASN  56          2HD2      ASN  56 -13.738  -1.253  -4.528
  432   HD22  ASN  56          1HD2      ASN  56 -14.734  -2.528  -5.134
  433    H    GLU  57           H        GLU  57  -9.949  -0.842  -2.460
  434    HA   GLU  57           HA       GLU  57  -9.586   0.346  -4.975
  435    HB2  GLU  57           1HB      GLU  57  -8.045   0.892  -2.432
  436    HB3  GLU  57           2HB      GLU  57  -8.168   1.965  -3.820
  437    HG2  GLU  57           1HG      GLU  57 -10.281   2.623  -3.306
  438    HG3  GLU  57           2HG      GLU  57 -10.689   1.094  -2.530
  439    H    PHE  58           H        PHE  58  -7.386  -1.541  -2.946
  440    HA   PHE  58           HA       PHE  58  -5.091  -1.219  -4.553
  441    HB2  PHE  58           1HB      PHE  58  -5.269  -2.112  -2.143
  442    HB3  PHE  58           2HB      PHE  58  -5.640  -3.665  -2.885
  443    HD1  PHE  58           HD1      PHE  58  -3.957  -4.797  -4.289
  444    HD2  PHE  58           HD2      PHE  58  -3.061  -1.246  -2.119
  445    HE1  PHE  58           HE1      PHE  58  -1.552  -5.246  -4.553
  446    HE2  PHE  58           HE2      PHE  58  -0.655  -1.690  -2.381
  447    HZ   PHE  58           HZ       PHE  58   0.102  -3.691  -3.599
  448    H    ALA  59           H        ALA  59  -7.632  -3.682  -4.504
  449    HA   ALA  59           HA       ALA  59  -6.520  -5.429  -6.392
  450    HB1  ALA  59           3HB      ALA  59  -9.198  -5.729  -6.783
  451    HB2  ALA  59           1HB      ALA  59  -8.271  -6.503  -5.498
  452    HB3  ALA  59           2HB      ALA  59  -9.149  -5.008  -5.174
  453    H    LYS  60           H        LYS  60  -8.898  -2.814  -6.849
  454    HA   LYS  60           HA       LYS  60  -9.027  -3.067  -9.662
  455    HB2  LYS  60           1HB      LYS  60  -9.996  -1.171  -7.627
  456    HB3  LYS  60           2HB      LYS  60  -9.730  -0.469  -9.217
  457    HG2  LYS  60           1HG      LYS  60 -12.035  -1.230  -8.910
  458    HG3  LYS  60           2HG      LYS  60 -11.221  -2.088 -10.220
  459    HD2  LYS  60           1HD      LYS  60 -11.445  -4.063  -9.194
  460    HD3  LYS  60           2HD      LYS  60 -10.907  -3.409  -7.645
  461    HE2  LYS  60           1HE      LYS  60 -13.017  -3.026  -6.926
  462    HE3  LYS  60           2HE      LYS  60 -13.597  -2.584  -8.531
  463    HZ1  LYS  60           3HZ      LYS  60 -14.639  -4.608  -7.904
  464    HZ2  LYS  60           1HZ      LYS  60 -13.168  -5.321  -7.471
  465    HZ3  LYS  60           2HZ      LYS  60 -13.500  -4.989  -9.096
  466    H    PHE  61           H        PHE  61  -6.795  -1.501  -7.537
  467    HA   PHE  61           HA       PHE  61  -5.688   0.241  -9.547
  468    HB2  PHE  61           1HB      PHE  61  -5.419   1.144  -7.425
  469    HB3  PHE  61           2HB      PHE  61  -5.032  -0.413  -6.700
  470    HD1  PHE  61           HD1      PHE  61  -3.611   1.673  -9.454
  471    HD2  PHE  61           HD2      PHE  61  -2.904  -0.520  -5.875
  472    HE1  PHE  61           HE1      PHE  61  -1.213   2.205  -9.605
  473    HE2  PHE  61           HE2      PHE  61  -0.506   0.009  -6.021
  474    HZ   PHE  61           HZ       PHE  61   0.343   1.374  -7.887
  475    H    TYR  62           H        TYR  62  -4.987  -2.917  -8.208
  476    HA   TYR  62           HA       TYR  62  -2.380  -3.227  -9.221
  477    HB2  TYR  62           1HB      TYR  62  -3.155  -4.736  -7.531
  478    HB3  TYR  62           2HB      TYR  62  -4.514  -5.248  -8.526
  479    HD1  TYR  62           HD2      TYR  62  -0.884  -5.522  -8.023
  480    HD2  TYR  62           HD1      TYR  62  -4.229  -6.882 -10.274
  481    HE1  TYR  62           HE2      TYR  62   0.471  -7.374  -8.907
  482    HE2  TYR  62           HE1      TYR  62  -2.883  -8.739 -11.163
  483    HH   TYR  62           HH       TYR  62   0.556  -8.949 -10.602
  484    H    GLY  63           H        GLY  63  -1.735  -3.264 -11.264
  485    HA2  GLY  63           1HA      GLY  63  -1.634  -4.013 -13.465
  486    HA3  GLY  63           2HA      GLY  63  -3.173  -4.827 -13.231
  487    H    SER  64           H        SER  64  -3.512  -1.727 -12.130
  488    HA   SER  64           HA       SER  64  -4.909  -0.953 -14.574
  489    HB2  SER  64           1HB      SER  64  -6.132  -0.806 -12.444
  490    HB3  SER  64           2HB      SER  64  -4.924   0.319 -11.825
  491    HG   SER  64           HG       SER  64  -6.774   1.391 -12.660
  492    H    ILE  65           H        ILE  65  -1.952  -0.871 -14.282
  493    HA   ILE  65           HA       ILE  65  -1.377   1.988 -14.339
  494    HB   ILE  65           HB       ILE  65   0.640  -0.181 -14.841
  495   HG12  ILE  65          1HG1      ILE  65   0.968   0.371 -12.201
  496   HG13  ILE  65          2HG1      ILE  65  -0.785   0.467 -12.334
  497   HG21  ILE  65          1HG2      ILE  65   1.644   1.853 -15.233
  498   HG22  ILE  65          2HG2      ILE  65   0.687   2.683 -14.007
  499   HG23  ILE  65          3HG2      ILE  65   2.003   1.614 -13.523
  500   HD11  ILE  65          3HD1      ILE  65   0.971  -1.847 -12.370
  501   HD12  ILE  65          1HD1      ILE  65  -0.753  -1.732 -12.016
  502   HD13  ILE  65          2HD1      ILE  65  -0.201  -1.842 -13.688
  503    H    GLN  66           H        GLN  66  -2.850   0.302 -16.465
  504    HA   GLN  66           HA       GLN  66  -1.314   0.156 -18.789
  505    HB2  GLN  66           1HB      GLN  66  -4.210   0.280 -18.168
  506    HB3  GLN  66           2HB      GLN  66  -3.745   0.679 -19.816
  507    HG2  GLN  66           1HG      GLN  66  -2.317  -1.602 -19.354
  508    HG3  GLN  66           2HG      GLN  66  -3.802  -1.897 -18.451
  509   HE21  GLN  66          2HE2      GLN  66  -2.335  -2.098 -21.423
  510   HE22  GLN  66          1HE2      GLN  66  -3.740  -2.299 -22.408
  Start of MODEL    2
    1    H1   MET   1           H        MET   1  -2.468 -13.473  -4.770
    2    HA   MET   1           HA       MET   1  -0.257 -14.374  -6.073
    3    HB2  MET   1           1HB      MET   1  -2.683 -14.930  -7.786
    4    HB3  MET   1           2HB      MET   1  -1.001 -15.134  -8.260
    5    HG2  MET   1           1HG      MET   1  -1.595 -16.607  -5.853
    6    HG3  MET   1           2HG      MET   1  -2.683 -17.050  -7.166
    7    HE1  MET   1           3HE      MET   1   0.546 -19.423  -6.414
    8    HE2  MET   1           1HE      MET   1   1.128 -17.851  -5.863
    9    HE3  MET   1           2HE      MET   1  -0.481 -18.408  -5.400
   10    H    ALA   2           H        ALA   2  -3.336 -12.818  -6.955
   11    HA   ALA   2           HA       ALA   2  -1.849 -10.644  -8.232
   12    HB1  ALA   2           3HB      ALA   2  -4.809 -11.223  -8.225
   13    HB2  ALA   2           1HB      ALA   2  -4.006  -9.949  -9.142
   14    HB3  ALA   2           2HB      ALA   2  -3.674 -11.641  -9.509
   15    H    GLU   3           H        GLU   3  -4.816 -10.746  -6.253
   16    HA   GLU   3           HA       GLU   3  -3.957  -8.253  -4.972
   17    HB2  GLU   3           1HB      GLU   3  -6.304  -8.046  -4.250
   18    HB3  GLU   3           2HB      GLU   3  -6.158  -8.182  -5.996
   19    HG2  GLU   3           1HG      GLU   3  -6.615 -10.661  -4.429
   20    HG3  GLU   3           2HG      GLU   3  -7.960  -9.542  -4.646
   21    H    ALA   4           H        ALA   4  -4.488 -11.603  -4.366
   22    HA   ALA   4           HA       ALA   4  -5.009 -11.657  -1.643
   23    HB1  ALA   4           3HB      ALA   4  -4.981 -13.828  -2.095
   24    HB2  ALA   4           1HB      ALA   4  -4.191 -13.517  -3.641
   25    HB3  ALA   4           2HB      ALA   4  -3.221 -13.775  -2.191
   26    H    LEU   5           H        LEU   5  -2.119 -10.772  -3.309
   27    HA   LEU   5           HA       LEU   5  -0.236 -11.250  -1.263
   28    HB2  LEU   5           1HB      LEU   5   0.029  -8.966  -3.172
   29    HB3  LEU   5           2HB      LEU   5   1.272 -10.045  -2.544
   30    HG   LEU   5           HG       LEU   5  -0.765 -10.651  -4.682
   31   HD11  LEU   5          1HD1      LEU   5   2.219 -10.295  -4.655
   32   HD12  LEU   5          2HD1      LEU   5   1.017  -9.418  -5.602
   33   HD13  LEU   5          3HD1      LEU   5   1.369 -11.106  -5.970
   34   HD21  LEU   5          3HD2      LEU   5   0.861 -12.787  -4.693
   35   HD22  LEU   5          1HD2      LEU   5  -0.665 -12.732  -3.810
   36   HD23  LEU   5          2HD2      LEU   5   0.854 -12.427  -2.966
   37    H    PHE   6           H        PHE   6  -2.367  -8.539  -1.960
   38    HA   PHE   6           HA       PHE   6  -1.237  -6.713  -0.126
   39    HB2  PHE   6           1HB      PHE   6  -2.644  -5.733  -1.715
   40    HB3  PHE   6           2HB      PHE   6  -3.908  -6.937  -1.479
   41    HD1  PHE   6           HD1      PHE   6  -5.310  -6.855   0.574
   42    HD2  PHE   6           HD2      PHE   6  -2.588  -3.747  -0.447
   43    HE1  PHE   6           HE1      PHE   6  -6.474  -5.333   2.117
   44    HE2  PHE   6           HE2      PHE   6  -3.746  -2.221   1.096
   45    HZ   PHE   6           HZ       PHE   6  -5.692  -3.014   2.381
   46    H    LYS   7           H        LYS   7  -3.998  -8.934   0.152
   47    HA   LYS   7           HA       LYS   7  -4.500  -8.285   2.889
   48    HB2  LYS   7           1HB      LYS   7  -5.428 -10.588   1.166
   49    HB3  LYS   7           2HB      LYS   7  -5.990 -10.302   2.807
   50    HG2  LYS   7           1HG      LYS   7  -6.805  -8.068   2.063
   51    HG3  LYS   7           2HG      LYS   7  -6.384  -8.524   0.411
   52    HD2  LYS   7           1HD      LYS   7  -7.848 -10.650   1.032
   53    HD3  LYS   7           2HD      LYS   7  -8.576  -9.507   2.162
   54    HE2  LYS   7           1HE      LYS   7  -9.840  -8.791   0.477
   55    HE3  LYS   7           2HE      LYS   7  -8.379  -8.105  -0.233
   56    HZ1  LYS   7           3HZ      LYS   7  -8.108 -10.533  -1.123
   57    HZ2  LYS   7           1HZ      LYS   7  -9.100  -9.425  -1.928
   58    HZ3  LYS   7           2HZ      LYS   7  -9.785 -10.587  -0.908
   59    H    GLU   8           H        GLU   8  -2.466 -10.554   1.228
   60    HA   GLU   8           HA       GLU   8  -2.072 -12.375   3.365
   61    HB2  GLU   8           1HB      GLU   8  -1.535 -12.981   1.068
   62    HB3  GLU   8           2HB      GLU   8  -0.313 -11.720   0.996
   63    HG2  GLU   8           1HG      GLU   8   1.167 -13.237   1.623
   64    HG3  GLU   8           2HG      GLU   8   0.390 -13.248   3.206
   65    H    ILE   9           H        ILE   9  -0.186  -9.589   2.214
   66    HA   ILE   9           HA       ILE   9   1.808  -9.784   4.223
   67    HB   ILE   9           HB       ILE   9   0.991  -7.415   2.540
   68   HG12  ILE   9          1HG1      ILE   9   1.792  -9.396   1.275
   69   HG13  ILE   9          2HG1      ILE   9   2.874  -8.015   1.130
   70   HG21  ILE   9          1HG2      ILE   9   3.447  -7.848   4.235
   71   HG22  ILE   9          2HG2      ILE   9   3.210  -6.510   3.112
   72   HG23  ILE   9          3HG2      ILE   9   2.164  -6.672   4.522
   73   HD11  ILE   9          3HD1      ILE   9   3.553 -10.607   1.829
   74   HD12  ILE   9          1HD1      ILE   9   4.572  -9.172   1.953
   75   HD13  ILE   9          2HD1      ILE   9   3.623  -9.704   3.342
   76    H    ASP  10           H        ASP  10  -1.368  -8.437   4.151
   77    HA   ASP  10           HA       ASP  10  -0.993  -6.667   6.386
   78    HB2  ASP  10           1HB      ASP  10  -3.151  -7.350   4.533
   79    HB3  ASP  10           2HB      ASP  10  -3.714  -7.088   6.182
   80    H    VAL  11           H        VAL  11  -0.041  -8.223   7.857
   81    HA   VAL  11           HA       VAL  11  -1.345 -10.531   8.773
   82    HB   VAL  11           HB       VAL  11   0.494  -8.778  10.402
   83   HG11  VAL  11          1HG1      VAL  11   1.084 -11.301  11.103
   84   HG12  VAL  11          2HG1      VAL  11  -0.132 -10.325  11.930
   85   HG13  VAL  11          3HG1      VAL  11  -0.624 -11.494  10.704
   86   HG21  VAL  11          3HG2      VAL  11   1.614  -9.186   8.341
   87   HG22  VAL  11          1HG2      VAL  11   2.289 -10.303   9.528
   88   HG23  VAL  11          2HG2      VAL  11   1.123 -10.879   8.337
   89    H    ASN  12           H        ASN  12  -2.044  -7.233   9.288
   90    HA   ASN  12           HA       ASN  12  -3.393  -7.599  11.815
   91    HB2  ASN  12           1HB      ASN  12  -4.188  -5.203  11.291
   92    HB3  ASN  12           2HB      ASN  12  -2.469  -5.453  11.577
   93   HD21  ASN  12          2HD2      ASN  12  -1.867  -3.645  10.424
   94   HD22  ASN  12          1HD2      ASN  12  -1.974  -3.559   8.702
   95    H    GLY  13           H        GLY  13  -4.132  -8.437   8.719
   96    HA2  GLY  13           1HA      GLY  13  -6.089  -8.811   7.553
   97    HA3  GLY  13           2HA      GLY  13  -6.665  -9.340   9.127
   98    H    ASP  14           H        ASP  14  -5.764  -6.057   8.189
   99    HA   ASP  14           HA       ASP  14  -8.422  -5.158   8.996
  100    HB2  ASP  14           1HB      ASP  14  -7.372  -2.866   8.796
  101    HB3  ASP  14           2HB      ASP  14  -6.654  -3.920  10.011
  102    H    GLY  15           H        GLY  15  -6.615  -5.784   6.170
  103    HA2  GLY  15           1HA      GLY  15  -7.205  -5.637   3.951
  104    HA3  GLY  15           2HA      GLY  15  -8.805  -5.134   4.474
  105    H    ALA  16           H        ALA  16  -6.477  -3.169   5.856
  106    HA   ALA  16           HA       ALA  16  -6.512  -1.260   3.628
  107    HB1  ALA  16           3HB      ALA  16  -7.849  -0.962   6.206
  108    HB2  ALA  16           1HB      ALA  16  -6.795   0.390   5.791
  109    HB3  ALA  16           2HB      ALA  16  -8.091  -0.089   4.694
  110    H    VAL  17           H        VAL  17  -4.617  -0.257   3.310
  111    HA   VAL  17           HA       VAL  17  -2.597  -0.402   5.452
  112    HB   VAL  17           HB       VAL  17  -0.858  -0.674   3.760
  113   HG11  VAL  17          1HG1      VAL  17  -2.047  -2.643   4.790
  114   HG12  VAL  17          2HG1      VAL  17  -2.978  -2.759   3.296
  115   HG13  VAL  17          3HG1      VAL  17  -1.226  -2.962   3.263
  116   HG21  VAL  17          3HG2      VAL  17  -1.933  -1.440   1.430
  117   HG22  VAL  17          1HG2      VAL  17  -3.140  -0.254   1.928
  118   HG23  VAL  17          2HG2      VAL  17  -1.451   0.224   1.764
  119    H    SER  18           H        SER  18  -1.975   1.532   6.123
  120    HA   SER  18           HA       SER  18  -2.574   3.891   4.553
  121    HB2  SER  18           1HB      SER  18  -1.182   4.739   6.796
  122    HB3  SER  18           2HB      SER  18  -2.936   4.631   6.647
  123    HG   SER  18           HG       SER  18  -2.909   3.043   8.013
  124    H    TYR  19           H        TYR  19  -0.752   5.683   4.796
  125    HA   TYR  19           HA       TYR  19   1.229   5.162   2.990
  126    HB2  TYR  19           1HB      TYR  19   2.421   7.132   3.918
  127    HB3  TYR  19           2HB      TYR  19   0.702   7.424   3.678
  128    HD1  TYR  19           HD2      TYR  19  -0.828   7.428   5.658
  129    HD2  TYR  19           HD1      TYR  19   3.404   7.291   6.071
  130    HE1  TYR  19           HE2      TYR  19  -1.039   8.141   8.003
  131    HE2  TYR  19           HE1      TYR  19   3.205   8.001   8.418
  132    HH   TYR  19           HH       TYR  19   0.083   8.886   9.809
  133    H    GLU  20           H        GLU  20   1.484   4.932   6.526
  134    HA   GLU  20           HA       GLU  20   4.191   4.187   6.619
  135    HB2  GLU  20           1HB      GLU  20   2.011   4.449   8.465
  136    HB3  GLU  20           2HB      GLU  20   2.856   2.941   8.779
  137    HG2  GLU  20           1HG      GLU  20   4.891   4.778   8.438
  138    HG3  GLU  20           2HG      GLU  20   3.656   5.666   9.329
  139    H    GLU  21           H        GLU  21   1.230   2.253   6.438
  140    HA   GLU  21           HA       GLU  21   2.387  -0.276   6.725
  141    HB2  GLU  21           1HB      GLU  21  -0.098   0.664   5.306
  142    HB3  GLU  21           2HB      GLU  21   0.354  -1.034   5.363
  143    HG2  GLU  21           1HG      GLU  21   0.528  -0.364   7.982
  144    HG3  GLU  21           2HG      GLU  21  -0.778   0.690   7.443
  145    H    VAL  22           H        VAL  22   1.818   1.680   3.826
  146    HA   VAL  22           HA       VAL  22   2.635  -0.190   1.914
  147    HB   VAL  22           HB       VAL  22   2.772   2.824   1.874
  148   HG11  VAL  22          1HG1      VAL  22   3.852   0.866   0.007
  149   HG12  VAL  22          2HG1      VAL  22   2.728   1.997  -0.747
  150   HG13  VAL  22          3HG1      VAL  22   4.139   2.602   0.121
  151   HG21  VAL  22          3HG2      VAL  22   0.928   1.411   0.094
  152   HG22  VAL  22          1HG2      VAL  22   0.600   1.167   1.810
  153   HG23  VAL  22          2HG2      VAL  22   0.650   2.800   1.145
  154    H    LYS  23           H        LYS  23   4.524   2.428   3.426
  155    HA   LYS  23           HA       LYS  23   6.973   1.815   2.224
  156    HB2  LYS  23           1HB      LYS  23   6.024   3.518   4.373
  157    HB3  LYS  23           2HB      LYS  23   7.597   2.830   4.751
  158    HG2  LYS  23           1HG      LYS  23   6.963   4.292   2.198
  159    HG3  LYS  23           2HG      LYS  23   7.693   5.037   3.623
  160    HD2  LYS  23           1HD      LYS  23   8.853   2.714   2.086
  161    HD3  LYS  23           2HD      LYS  23   9.366   4.396   1.928
  162    HE2  LYS  23           1HE      LYS  23   9.550   2.663   4.389
  163    HE3  LYS  23           2HE      LYS  23  10.887   3.232   3.390
  164    HZ1  LYS  23           3HZ      LYS  23  10.922   4.735   5.094
  165    HZ2  LYS  23           1HZ      LYS  23   9.245   4.718   5.316
  166    HZ3  LYS  23           2HZ      LYS  23   9.916   5.550   4.005
  167    H    ALA  24           H        ALA  24   5.424   0.527   5.100
  168    HA   ALA  24           HA       ALA  24   7.692  -0.903   6.058
  169    HB1  ALA  24           3HB      ALA  24   4.995  -1.909   6.722
  170    HB2  ALA  24           1HB      ALA  24   6.365  -1.547   7.773
  171    HB3  ALA  24           2HB      ALA  24   5.347  -0.239   7.168
  172    H    PHE  25           H        PHE  25   4.892  -1.790   4.074
  173    HA   PHE  25           HA       PHE  25   5.257  -4.513   3.881
  174    HB2  PHE  25           1HB      PHE  25   4.118  -2.451   2.047
  175    HB3  PHE  25           2HB      PHE  25   4.360  -4.080   1.426
  176    HD1  PHE  25           HD1      PHE  25   3.499  -3.372   4.924
  177    HD2  PHE  25           HD2      PHE  25   2.046  -4.566   1.106
  178    HE1  PHE  25           HE1      PHE  25   1.379  -4.076   5.955
  179    HE2  PHE  25           HE2      PHE  25  -0.078  -5.271   2.131
  180    HZ   PHE  25           HZ       PHE  25  -0.413  -5.025   4.558
  181    H    VAL  26           H        VAL  26   6.671  -2.007   1.785
  182    HA   VAL  26           HA       VAL  26   8.227  -3.837   0.262
  183    HB   VAL  26           HB       VAL  26   7.512  -1.310  -0.189
  184   HG11  VAL  26          1HG1      VAL  26   9.264   0.258   0.127
  185   HG12  VAL  26          2HG1      VAL  26   9.009  -0.537   1.682
  186   HG13  VAL  26          3HG1      VAL  26  10.378  -0.995   0.670
  187   HG21  VAL  26          3HG2      VAL  26   8.293  -2.407  -2.034
  188   HG22  VAL  26          1HG2      VAL  26   9.634  -1.293  -1.768
  189   HG23  VAL  26          2HG2      VAL  26   9.754  -2.966  -1.221
  190    H    SER  27           H        SER  27   8.743  -2.079   3.227
  191    HA   SER  27           HA       SER  27  11.539  -2.186   3.364
  192    HB2  SER  27           1HB      SER  27   9.354  -1.552   5.146
  193    HB3  SER  27           2HB      SER  27  10.595  -2.472   5.996
  194    HG   SER  27           HG       SER  27  10.679   0.039   5.586
  195    H    LYS  28           H        LYS  28   9.156  -4.641   3.740
  196    HA   LYS  28           HA       LYS  28  10.708  -6.453   5.302
  197    HB2  LYS  28           1HB      LYS  28   8.139  -6.519   3.842
  198    HB3  LYS  28           2HB      LYS  28   8.954  -8.069   4.009
  199    HG2  LYS  28           1HG      LYS  28   7.326  -7.624   5.804
  200    HG3  LYS  28           2HG      LYS  28   8.969  -7.865   6.403
  201    HD2  LYS  28           1HD      LYS  28   9.254  -5.430   6.561
  202    HD3  LYS  28           2HD      LYS  28   7.596  -5.207   5.993
  203    HE2  LYS  28           1HE      LYS  28   7.932  -7.004   8.305
  204    HE3  LYS  28           2HE      LYS  28   8.306  -5.307   8.598
  205    HZ1  LYS  28           3HZ      LYS  28   6.147  -4.925   8.760
  206    HZ2  LYS  28           1HZ      LYS  28   5.786  -6.536   8.392
  207    HZ3  LYS  28           2HZ      LYS  28   5.931  -5.397   7.149
  208    H    LYS  29           H        LYS  29  11.010  -5.393   2.150
  209    HA   LYS  29           HA       LYS  29  12.203  -7.901   1.206
  210    HB2  LYS  29           1HB      LYS  29  11.911  -5.436  -0.478
  211    HB3  LYS  29           2HB      LYS  29  11.948  -7.121  -0.979
  212    HG2  LYS  29           1HG      LYS  29   9.729  -7.445   0.046
  213    HG3  LYS  29           2HG      LYS  29   9.693  -5.726   0.448
  214    HD2  LYS  29           1HD      LYS  29  10.003  -5.259  -2.008
  215    HD3  LYS  29           2HD      LYS  29   9.741  -6.980  -2.291
  216    HE2  LYS  29           1HE      LYS  29   7.691  -5.913  -0.576
  217    HE3  LYS  29           2HE      LYS  29   7.804  -4.969  -2.061
  218    HZ1  LYS  29           3HZ      LYS  29   7.362  -7.894  -1.829
  219    HZ2  LYS  29           1HZ      LYS  29   7.680  -7.107  -3.292
  220    HZ3  LYS  29           2HZ      LYS  29   6.279  -6.739  -2.421
  221    H    ARG  30           H        ARG  30  12.947  -4.452   1.589
  222    HA   ARG  30           HA       ARG  30  15.703  -5.061   2.146
  223    HB2  ARG  30           1HB      ARG  30  16.646  -3.699   0.340
  224    HB3  ARG  30           2HB      ARG  30  15.749  -5.070  -0.299
  225    HG2  ARG  30           1HG      ARG  30  14.839  -3.545  -1.658
  226    HG3  ARG  30           2HG      ARG  30  13.821  -3.170  -0.266
  227    HD2  ARG  30           1HD      ARG  30  14.684  -1.128  -0.116
  228    HD3  ARG  30           2HD      ARG  30  16.323  -1.778  -0.064
  229    HE   ARG  30           HE       ARG  30  14.967  -0.658  -2.344
  230   HH11  ARG  30          1HH1      ARG  30  17.532  -2.746  -1.260
  231   HH12  ARG  30          2HH1      ARG  30  18.456  -2.585  -2.717
  232   HH21  ARG  30          1HH2      ARG  30  16.174  -0.438  -4.268
  233   HH22  ARG  30          2HH2      ARG  30  17.682  -1.270  -4.427
  234    H    ALA  31           H        ALA  31  16.811  -2.559   1.790
  235    HA   ALA  31           HA       ALA  31  15.198  -0.928   3.639
  236    HB1  ALA  31           3HB      ALA  31  17.647  -1.912   4.132
  237    HB2  ALA  31           1HB      ALA  31  18.085  -0.374   3.389
  238    HB3  ALA  31           2HB      ALA  31  17.051  -0.400   4.817
  239    H    ILE  32           H        ILE  32  14.088   0.386   2.256
  240    HA   ILE  32           HA       ILE  32  15.718   2.223   0.641
  241    HB   ILE  32           HB       ILE  32  14.748   0.747  -0.967
  242   HG12  ILE  32          1HG1      ILE  32  13.067   3.260  -0.829
  243   HG13  ILE  32          2HG1      ILE  32  14.694   3.166  -1.495
  244   HG21  ILE  32          1HG2      ILE  32  12.613   0.608   0.902
  245   HG22  ILE  32          2HG2      ILE  32  11.958   1.117  -0.653
  246   HG23  ILE  32          3HG2      ILE  32  12.886  -0.377  -0.534
  247   HD11  ILE  32          3HD1      ILE  32  12.925   1.216  -2.691
  248   HD12  ILE  32          1HD1      ILE  32  12.324   2.863  -2.875
  249   HD13  ILE  32          2HD1      ILE  32  13.939   2.444  -3.450
  250    H    LYS  33           H        LYS  33  15.566   4.017   1.869
  251    HA   LYS  33           HA       LYS  33  13.015   4.797   3.028
  252    HB2  LYS  33           1HB      LYS  33  14.358   6.697   3.976
  253    HB3  LYS  33           2HB      LYS  33  14.903   5.097   4.460
  254    HG2  LYS  33           1HG      LYS  33  16.296   5.822   2.097
  255    HG3  LYS  33           2HG      LYS  33  16.382   7.173   3.228
  256    HD2  LYS  33           1HD      LYS  33  16.832   4.499   4.388
  257    HD3  LYS  33           2HD      LYS  33  18.071   5.066   3.265
  258    HE2  LYS  33           1HE      LYS  33  18.342   7.103   4.570
  259    HE3  LYS  33           2HE      LYS  33  17.060   6.590   5.666
  260    HZ1  LYS  33           3HZ      LYS  33  18.393   5.051   6.653
  261    HZ2  LYS  33           1HZ      LYS  33  19.577   6.179   6.219
  262    HZ3  LYS  33           2HZ      LYS  33  19.341   4.796   5.275
  263    H    ASN  34           H        ASN  34  11.644   5.604   1.542
  264    HA   ASN  34           HA       ASN  34  12.613   7.848  -0.101
  265    HB2  ASN  34           1HB      ASN  34  10.609   5.712  -0.859
  266    HB3  ASN  34           2HB      ASN  34  10.918   7.163  -1.809
  267   HD21  ASN  34          2HD2      ASN  34  11.456   5.660  -3.507
  268   HD22  ASN  34          1HD2      ASN  34  13.040   4.973  -3.565
  269    H    GLU  35           H        GLU  35  11.868   9.559   1.028
  270    HA   GLU  35           HA       GLU  35   9.325   9.570   2.342
  271    HB2  GLU  35           1HB      GLU  35  11.657  11.130   2.426
  272    HB3  GLU  35           2HB      GLU  35  10.388  12.214   1.873
  273    HG2  GLU  35           1HG      GLU  35  10.393  10.580   4.398
  274    HG3  GLU  35           2HG      GLU  35  10.556  12.329   4.263
  275    H    GLN  36           H        GLN  36  10.612  10.976  -0.640
  276    HA   GLN  36           HA       GLN  36   8.203  12.341  -1.324
  277    HB2  GLN  36           1HB      GLN  36  10.187  13.205  -2.272
  278    HB3  GLN  36           2HB      GLN  36  10.692  11.625  -2.857
  279    HG2  GLN  36           1HG      GLN  36   9.582  11.861  -4.768
  280    HG3  GLN  36           2HG      GLN  36   8.137  12.458  -3.955
  281   HE21  GLN  36          2HE2      GLN  36  10.509  13.235  -6.091
  282   HE22  GLN  36          1HE2      GLN  36  10.432  14.958  -5.995
  283    H    LEU  37           H        LEU  37   9.718   9.337  -2.480
  284    HA   LEU  37           HA       LEU  37   7.724   8.637  -4.320
  285    HB2  LEU  37           1HB      LEU  37  10.080   7.652  -3.935
  286    HB3  LEU  37           2HB      LEU  37   9.281   6.604  -2.766
  287    HG   LEU  37           HG       LEU  37   7.714   6.180  -4.913
  288   HD11  LEU  37          1HD1      LEU  37   8.627   6.689  -6.871
  289   HD12  LEU  37          2HD1      LEU  37  10.168   5.968  -6.412
  290   HD13  LEU  37          3HD1      LEU  37   9.819   7.644  -5.992
  291   HD21  LEU  37          3HD2      LEU  37   8.626   4.075  -4.953
  292   HD22  LEU  37          1HD2      LEU  37   9.190   4.648  -3.383
  293   HD23  LEU  37          2HD2      LEU  37  10.279   4.667  -4.771
  294    H    LEU  38           H        LEU  38   8.047   7.986  -0.870
  295    HA   LEU  38           HA       LEU  38   5.924   6.159  -0.627
  296    HB2  LEU  38           1HB      LEU  38   7.536   6.389   1.130
  297    HB3  LEU  38           2HB      LEU  38   7.126   8.090   1.347
  298    HG   LEU  38           HG       LEU  38   6.278   6.348   3.061
  299   HD11  LEU  38          1HD1      LEU  38   5.489   8.845   2.398
  300   HD12  LEU  38          2HD1      LEU  38   4.806   7.910   3.728
  301   HD13  LEU  38          3HD1      LEU  38   3.984   7.956   2.169
  302   HD21  LEU  38          3HD2      LEU  38   3.883   6.083   1.354
  303   HD22  LEU  38          1HD2      LEU  38   4.572   4.964   2.530
  304   HD23  LEU  38          2HD2      LEU  38   5.272   5.086   0.916
  305    H    GLN  39           H        GLN  39   6.026   9.687  -0.229
  306    HA   GLN  39           HA       GLN  39   3.329  10.021   0.486
  307    HB2  GLN  39           1HB      GLN  39   5.574  11.703  -0.153
  308    HB3  GLN  39           2HB      GLN  39   4.128  12.314  -0.947
  309    HG2  GLN  39           1HG      GLN  39   3.459  11.615   1.725
  310    HG3  GLN  39           2HG      GLN  39   4.915  12.608   1.748
  311   HE21  GLN  39          2HE2      GLN  39   2.076  12.617  -0.370
  312   HE22  GLN  39          1HE2      GLN  39   1.644  14.263  -0.073
  313    H    LEU  40           H        LEU  40   4.922  10.370  -2.681
  314    HA   LEU  40           HA       LEU  40   2.582  10.918  -4.138
  315    HB2  LEU  40           1HB      LEU  40   5.230  10.896  -4.702
  316    HB3  LEU  40           2HB      LEU  40   4.707   9.432  -5.531
  317    HG   LEU  40           HG       LEU  40   3.725  12.243  -6.017
  318   HD11  LEU  40          1HD1      LEU  40   5.994  11.141  -6.929
  319   HD12  LEU  40          2HD1      LEU  40   5.032  12.292  -7.857
  320   HD13  LEU  40          3HD1      LEU  40   4.867  10.562  -8.157
  321   HD21  LEU  40          3HD2      LEU  40   1.805  11.129  -6.495
  322   HD22  LEU  40          1HD2      LEU  40   2.632   9.597  -6.782
  323   HD23  LEU  40          2HD2      LEU  40   2.651  10.855  -8.019
  324    H    ILE  41           H        ILE  41   4.375   7.865  -3.737
  325    HA   ILE  41           HA       ILE  41   2.625   6.251  -5.209
  326    HB   ILE  41           HB       ILE  41   4.487   5.576  -2.937
  327   HG12  ILE  41          1HG1      ILE  41   5.487   6.355  -5.074
  328   HG13  ILE  41          2HG1      ILE  41   5.911   4.690  -4.691
  329   HG21  ILE  41          1HG2      ILE  41   2.790   3.751  -4.624
  330   HG22  ILE  41          2HG2      ILE  41   4.205   3.202  -3.728
  331   HG23  ILE  41          3HG2      ILE  41   2.825   3.884  -2.866
  332   HD11  ILE  41          3HD1      ILE  41   3.519   4.838  -6.305
  333   HD12  ILE  41          1HD1      ILE  41   4.891   5.634  -7.078
  334   HD13  ILE  41          2HD1      ILE  41   5.017   3.947  -6.576
  335    H    PHE  42           H        PHE  42   2.521   7.347  -1.884
  336    HA   PHE  42           HA       PHE  42   0.597   5.562  -0.894
  337    HB2  PHE  42           1HB      PHE  42   1.814   6.895   0.665
  338    HB3  PHE  42           2HB      PHE  42   1.306   8.390  -0.115
  339    HD1  PHE  42           HD2      PHE  42  -0.437   5.374   1.235
  340    HD2  PHE  42           HD1      PHE  42  -0.131   9.619   1.166
  341    HE1  PHE  42           HE2      PHE  42  -2.338   5.531   2.788
  342    HE2  PHE  42           HE1      PHE  42  -2.033   9.783   2.720
  343    HZ   PHE  42           HZ       PHE  42  -3.139   7.738   3.532
  344    H    LYS  43           H        LYS  43   0.176   8.862  -2.172
  345    HA   LYS  43           HA       LYS  43  -2.674   8.713  -2.127
  346    HB2  LYS  43           1HB      LYS  43  -0.802  10.737  -2.398
  347    HB3  LYS  43           2HB      LYS  43  -1.552  10.664  -3.986
  348    HG2  LYS  43           1HG      LYS  43  -3.352  11.717  -3.247
  349    HG3  LYS  43           2HG      LYS  43  -3.564  10.544  -1.945
  350    HD2  LYS  43           1HD      LYS  43  -2.299  11.795  -0.446
  351    HD3  LYS  43           2HD      LYS  43  -1.502  12.706  -1.730
  352    HE2  LYS  43           1HE      LYS  43  -4.324  13.129  -1.886
  353    HE3  LYS  43           2HE      LYS  43  -3.786  13.425  -0.233
  354    HZ1  LYS  43           3HZ      LYS  43  -3.258  15.435  -1.020
  355    HZ2  LYS  43           1HZ      LYS  43  -3.265  14.935  -2.636
  356    HZ3  LYS  43           2HZ      LYS  43  -1.896  14.677  -1.678
  357    H    SER  44           H        SER  44  -0.198   7.998  -4.482
  358    HA   SER  44           HA       SER  44  -1.875   7.917  -6.766
  359    HB2  SER  44           1HB      SER  44   0.849   6.820  -6.124
  360    HB3  SER  44           2HB      SER  44   0.049   6.393  -7.637
  361    HG   SER  44           HG       SER  44   0.569   8.281  -8.373
  362    H    ILE  45           H        ILE  45  -0.618   5.354  -4.640
  363    HA   ILE  45           HA       ILE  45  -1.975   3.237  -5.929
  364    HB   ILE  45           HB       ILE  45  -0.849   3.471  -3.141
  365   HG12  ILE  45          1HG1      ILE  45   0.101   2.065  -5.646
  366   HG13  ILE  45          2HG1      ILE  45   0.814   3.500  -4.918
  367   HG21  ILE  45          1HG2      ILE  45  -2.623   1.856  -3.037
  368   HG22  ILE  45          2HG2      ILE  45  -2.053   1.072  -4.510
  369   HG23  ILE  45          3HG2      ILE  45  -1.082   0.998  -3.041
  370   HD11  ILE  45          3HD1      ILE  45   1.324   2.135  -2.902
  371   HD12  ILE  45          1HD1      ILE  45   0.769   0.715  -3.790
  372   HD13  ILE  45          2HD1      ILE  45   2.168   1.625  -4.364
  373    H    ASP  46           H        ASP  46  -2.801   5.280  -3.165
  374    HA   ASP  46           HA       ASP  46  -5.212   3.887  -2.538
  375    HB2  ASP  46           1HB      ASP  46  -3.720   5.582  -1.128
  376    HB3  ASP  46           2HB      ASP  46  -4.866   6.749  -1.780
  377    H    ALA  47           H        ALA  47  -7.044   3.928  -3.642
  378    HA   ALA  47           HA       ALA  47  -7.478   5.604  -5.872
  379    HB1  ALA  47           3HB      ALA  47  -8.480   3.282  -5.307
  380    HB2  ALA  47           1HB      ALA  47  -9.717   4.212  -4.462
  381    HB3  ALA  47           2HB      ALA  47  -9.460   4.453  -6.191
  382    H    ASP  48           H        ASP  48  -8.660   5.704  -2.542
  383    HA   ASP  48           HA       ASP  48  -9.916   8.303  -3.115
  384    HB2  ASP  48           1HB      ASP  48 -11.201   7.930  -1.022
  385    HB3  ASP  48           2HB      ASP  48 -11.491   6.685  -2.234
  386    H    GLY  49           H        GLY  49  -7.307   6.796  -1.540
  387    HA2  GLY  49           1HA      GLY  49  -5.641   7.589  -0.177
  388    HA3  GLY  49           2HA      GLY  49  -6.089   9.185  -0.762
  389    H    ASN  50           H        ASN  50  -8.251   7.066   1.013
  390    HA   ASN  50           HA       ASN  50  -8.622   9.127   3.010
  391    HB2  ASN  50           1HB      ASN  50 -10.409   7.639   3.867
  392    HB3  ASN  50           2HB      ASN  50 -10.590   7.982   2.149
  393   HD21  ASN  50          2HD2      ASN  50 -11.865   5.857   3.281
  394   HD22  ASN  50          1HD2      ASN  50 -11.165   4.382   2.713
  395    H    GLY  51           H        GLY  51  -6.469   9.000   3.925
  396    HA2  GLY  51           1HA      GLY  51  -5.103   8.427   5.685
  397    HA3  GLY  51           2HA      GLY  51  -6.398   7.389   6.266
  398    H    GLU  52           H        GLU  52  -6.645   5.605   4.174
  399    HA   GLU  52           HA       GLU  52  -4.026   4.493   3.609
  400    HB2  GLU  52           1HB      GLU  52  -4.788   2.244   4.573
  401    HB3  GLU  52           2HB      GLU  52  -4.257   3.476   5.711
  402    HG2  GLU  52           1HG      GLU  52  -6.314   2.209   6.367
  403    HG3  GLU  52           2HG      GLU  52  -6.473   3.965   6.365
  404    H    ILE  53           H        ILE  53  -4.216   2.470   2.281
  405    HA   ILE  53           HA       ILE  53  -6.386   2.824   0.359
  406    HB   ILE  53           HB       ILE  53  -4.075   0.933   0.026
  407   HG12  ILE  53          1HG1      ILE  53  -3.458   3.270  -1.375
  408   HG13  ILE  53          2HG1      ILE  53  -3.982   3.828   0.209
  409   HG21  ILE  53          1HG2      ILE  53  -5.541   0.555  -1.699
  410   HG22  ILE  53          2HG2      ILE  53  -6.096   2.228  -1.739
  411   HG23  ILE  53          3HG2      ILE  53  -4.518   1.806  -2.405
  412   HD11  ILE  53          3HD1      ILE  53  -1.850   3.491   0.776
  413   HD12  ILE  53          1HD1      ILE  53  -2.322   1.796   0.887
  414   HD13  ILE  53          2HD1      ILE  53  -1.555   2.404  -0.581
  415    H    ASP  54           H        ASP  54  -8.080   1.513   0.291
  416    HA   ASP  54           HA       ASP  54  -8.258  -0.755   2.040
  417    HB2  ASP  54           1HB      ASP  54 -10.259  -0.099  -0.106
  418    HB3  ASP  54           2HB      ASP  54 -10.533  -0.846   1.466
  419    H    GLN  55           H        GLN  55  -8.908  -2.910   1.314
  420    HA   GLN  55           HA       GLN  55  -7.112  -4.047  -0.463
  421    HB2  GLN  55           1HB      GLN  55  -8.584  -6.047  -0.401
  422    HB3  GLN  55           2HB      GLN  55  -8.239  -5.390   1.194
  423    HG2  GLN  55           1HG      GLN  55 -10.448  -5.641   1.478
  424    HG3  GLN  55           2HG      GLN  55 -10.521  -4.088   0.648
  425   HE21  GLN  55          2HE2      GLN  55 -12.603  -4.545  -0.100
  426   HE22  GLN  55          1HE2      GLN  55 -12.881  -5.655  -1.396
  427    H    ASN  56           H        ASN  56 -10.466  -3.047  -1.014
  428    HA   ASN  56           HA       ASN  56 -10.755  -4.007  -3.617
  429    HB2  ASN  56           1HB      ASN  56 -12.410  -2.762  -1.910
  430    HB3  ASN  56           2HB      ASN  56 -12.024  -1.402  -2.960
  431   HD21  ASN  56          2HD2      ASN  56 -13.903  -1.180  -4.021
  432   HD22  ASN  56          1HD2      ASN  56 -14.611  -2.395  -5.025
  433    H    GLU  57           H        GLU  57  -9.698  -0.793  -2.510
  434    HA   GLU  57           HA       GLU  57  -9.256   0.315  -5.043
  435    HB2  GLU  57           1HB      GLU  57  -7.768   0.950  -2.489
  436    HB3  GLU  57           2HB      GLU  57  -7.902   1.985  -3.904
  437    HG2  GLU  57           1HG      GLU  57 -10.103   2.518  -3.478
  438    HG3  GLU  57           2HG      GLU  57 -10.368   1.081  -2.491
  439    H    PHE  58           H        PHE  58  -7.078  -1.456  -2.882
  440    HA   PHE  58           HA       PHE  58  -4.750  -1.180  -4.434
  441    HB2  PHE  58           1HB      PHE  58  -4.990  -2.011  -2.011
  442    HB3  PHE  58           2HB      PHE  58  -5.340  -3.584  -2.720
  443    HD1  PHE  58           HD1      PHE  58  -3.616  -4.714  -4.110
  444    HD2  PHE  58           HD2      PHE  58  -2.786  -1.180  -1.886
  445    HE1  PHE  58           HE1      PHE  58  -1.205  -5.168  -4.296
  446    HE2  PHE  58           HE2      PHE  58  -0.373  -1.628  -2.069
  447    HZ   PHE  58           HZ       PHE  58   0.420  -3.623  -3.276
  448    H    ALA  59           H        ALA  59  -7.260  -3.676  -4.389
  449    HA   ALA  59           HA       ALA  59  -6.086  -5.456  -6.199
  450    HB1  ALA  59           3HB      ALA  59  -7.866  -6.462  -5.236
  451    HB2  ALA  59           1HB      ALA  59  -8.811  -4.975  -5.170
  452    HB3  ALA  59           2HB      ALA  59  -8.690  -5.875  -6.681
  453    H    LYS  60           H        LYS  60  -8.446  -2.855  -6.799
  454    HA   LYS  60           HA       LYS  60  -8.533  -3.181  -9.597
  455    HB2  LYS  60           1HB      LYS  60  -9.066  -0.682  -7.977
  456    HB3  LYS  60           2HB      LYS  60  -9.577  -0.965  -9.637
  457    HG2  LYS  60           1HG      LYS  60 -10.426  -2.889  -7.532
  458    HG3  LYS  60           2HG      LYS  60 -11.223  -1.317  -7.630
  459    HD2  LYS  60           1HD      LYS  60 -10.884  -3.024 -10.072
  460    HD3  LYS  60           2HD      LYS  60 -12.217  -3.307  -8.949
  461    HE2  LYS  60           1HE      LYS  60 -11.660  -0.588 -10.095
  462    HE3  LYS  60           2HE      LYS  60 -12.646  -1.771 -10.953
  463    HZ1  LYS  60           3HZ      LYS  60 -13.961  -1.893  -8.785
  464    HZ2  LYS  60           1HZ      LYS  60 -14.170  -0.521  -9.754
  465    HZ3  LYS  60           2HZ      LYS  60 -13.195  -0.442  -8.375
  466    H    PHE  61           H        PHE  61  -6.282  -1.592  -7.499
  467    HA   PHE  61           HA       PHE  61  -5.094   0.049  -9.535
  468    HB2  PHE  61           1HB      PHE  61  -4.734   0.983  -7.457
  469    HB3  PHE  61           2HB      PHE  61  -4.503  -0.579  -6.678
  470    HD1  PHE  61           HD1      PHE  61  -2.852   1.364  -9.408
  471    HD2  PHE  61           HD2      PHE  61  -2.404  -0.928  -5.849
  472    HE1  PHE  61           HE1      PHE  61  -0.414   1.675  -9.519
  473    HE2  PHE  61           HE2      PHE  61   0.035  -0.620  -5.954
  474    HZ   PHE  61           HZ       PHE  61   1.033   0.684  -7.790
  475    H    TYR  62           H        TYR  62  -4.488  -3.112  -8.139
  476    HA   TYR  62           HA       TYR  62  -1.914  -3.531  -9.197
  477    HB2  TYR  62           1HB      TYR  62  -3.059  -4.901  -7.407
  478    HB3  TYR  62           2HB      TYR  62  -3.986  -5.671  -8.690
  479    HD1  TYR  62           HD1      TYR  62  -2.588  -6.767 -10.602
  480    HD2  TYR  62           HD2      TYR  62  -1.029  -5.818  -6.758
  481    HE1  TYR  62           HE1      TYR  62  -0.773  -8.390 -10.945
  482    HE2  TYR  62           HE2      TYR  62   0.791  -7.439  -7.090
  483    HH   TYR  62           HH       TYR  62   0.773  -9.739  -9.571
  484    H    GLY  63           H        GLY  63  -1.313  -3.651 -11.250
  485    HA2  GLY  63           1HA      GLY  63  -1.287  -4.483 -13.427
  486    HA3  GLY  63           2HA      GLY  63  -2.866  -5.200 -13.145
  487    H    SER  64           H        SER  64  -3.004  -2.055 -12.131
  488    HA   SER  64           HA       SER  64  -4.401  -1.272 -14.571
  489    HB2  SER  64           1HB      SER  64  -5.581  -0.989 -12.436
  490    HB3  SER  64           2HB      SER  64  -4.292   0.066 -11.856
  491    HG   SER  64           HG       SER  64  -4.949   1.634 -13.180
  492    H    ILE  65           H        ILE  65  -1.432  -1.349 -14.309
  493    HA   ILE  65           HA       ILE  65  -0.703   1.469 -14.479
  494    HB   ILE  65           HB       ILE  65   0.715  -0.267 -13.271
  495   HG12  ILE  65          1HG1      ILE  65   2.691   0.792 -15.051
  496   HG13  ILE  65          2HG1      ILE  65   1.418   1.991 -14.846
  497   HG21  ILE  65          1HG2      ILE  65   0.460  -1.763 -15.462
  498   HG22  ILE  65          2HG2      ILE  65   1.969  -0.944 -15.867
  499   HG23  ILE  65          3HG2      ILE  65   1.849  -1.889 -14.383
  500   HD11  ILE  65          3HD1      ILE  65   3.003   0.675 -12.654
  501   HD12  ILE  65          1HD1      ILE  65   3.166   2.336 -13.224
  502   HD13  ILE  65          2HD1      ILE  65   1.687   1.824 -12.412
  503    H    GLN  66           H        GLN  66  -2.288  -0.213 -16.528
  504    HA   GLN  66           HA       GLN  66  -0.844  -0.590 -18.856
  505    HB2  GLN  66           1HB      GLN  66  -3.685   0.421 -18.645
  506    HB3  GLN  66           2HB      GLN  66  -2.963  -0.352 -20.049
  507    HG2  GLN  66           1HG      GLN  66  -3.023  -2.437 -19.113
  508    HG3  GLN  66           2HG      GLN  66  -2.965  -1.817 -17.464
  509   HE21  GLN  66          2HE2      GLN  66  -4.730  -2.548 -16.504
  510   HE22  GLN  66          1HE2      GLN  66  -6.342  -2.401 -17.110
  Start of MODEL    3
    1    H1   MET   1           H        MET   1  -2.667 -15.141  -6.765
    2    HA   MET   1           HA       MET   1  -0.695 -14.487  -5.204
    3    HB2  MET   1           1HB      MET   1   0.762 -15.533  -7.633
    4    HB3  MET   1           2HB      MET   1   1.473 -14.880  -6.163
    5    HG2  MET   1           1HG      MET   1   0.345 -16.812  -4.953
    6    HG3  MET   1           2HG      MET   1   0.075 -17.501  -6.552
    7    HE1  MET   1           3HE      MET   1   2.091 -19.453  -4.588
    8    HE2  MET   1           1HE      MET   1   3.354 -18.391  -3.966
    9    HE3  MET   1           2HE      MET   1   1.657 -17.972  -3.734
   10    H    ALA   2           H        ALA   2  -1.925 -12.599  -5.678
   11    HA   ALA   2           HA       ALA   2  -0.625 -10.875  -7.586
   12    HB1  ALA   2           3HB      ALA   2  -3.394 -11.888  -8.049
   13    HB2  ALA   2           1HB      ALA   2  -2.975 -10.245  -8.536
   14    HB3  ALA   2           2HB      ALA   2  -2.087 -11.617  -9.202
   15    H    GLU   3           H        GLU   3  -3.857 -10.850  -6.084
   16    HA   GLU   3           HA       GLU   3  -3.213  -8.268  -4.875
   17    HB2  GLU   3           1HB      GLU   3  -5.633  -8.116  -4.424
   18    HB3  GLU   3           2HB      GLU   3  -5.290  -8.377  -6.128
   19    HG2  GLU   3           1HG      GLU   3  -6.021 -10.594  -6.058
   20    HG3  GLU   3           2HG      GLU   3  -5.943 -10.656  -4.297
   21    H    ALA   4           H        ALA   4  -3.665 -11.580  -4.052
   22    HA   ALA   4           HA       ALA   4  -4.503 -11.483  -1.421
   23    HB1  ALA   4           3HB      ALA   4  -2.864 -13.366  -3.016
   24    HB2  ALA   4           1HB      ALA   4  -2.819 -13.542  -1.261
   25    HB3  ALA   4           2HB      ALA   4  -4.358 -13.638  -2.119
   26    H    LEU   5           H        LEU   5  -1.452 -10.552  -2.782
   27    HA   LEU   5           HA       LEU   5   0.162 -10.696  -0.489
   28    HB2  LEU   5           1HB      LEU   5   0.499  -8.536  -2.526
   29    HB3  LEU   5           2HB      LEU   5   1.729  -9.454  -1.662
   30    HG   LEU   5           HG       LEU   5   0.047 -10.382  -3.984
   31   HD11  LEU   5          1HD1      LEU   5   2.758 -10.819  -4.436
   32   HD12  LEU   5          2HD1      LEU   5   2.669  -9.216  -3.709
   33   HD13  LEU   5          3HD1      LEU   5   1.743  -9.575  -5.166
   34   HD21  LEU   5          3HD2      LEU   5   1.540 -12.451  -3.750
   35   HD22  LEU   5          1HD2      LEU   5   0.176 -12.288  -2.642
   36   HD23  LEU   5          2HD2      LEU   5   1.808 -11.907  -2.094
   37    H    PHE   6           H        PHE   6  -2.011  -8.191  -1.679
   38    HA   PHE   6           HA       PHE   6  -1.285  -6.145   0.093
   39    HB2  PHE   6           1HB      PHE   6  -2.637  -5.489  -1.710
   40    HB3  PHE   6           2HB      PHE   6  -3.810  -6.767  -1.414
   41    HD1  PHE   6           HD2      PHE   6  -5.314  -6.596   0.586
   42    HD2  PHE   6           HD1      PHE   6  -2.874  -3.368  -0.736
   43    HE1  PHE   6           HE2      PHE   6  -6.703  -5.024   1.871
   44    HE2  PHE   6           HE1      PHE   6  -4.259  -1.791   0.547
   45    HZ   PHE   6           HZ       PHE   6  -6.177  -2.618   1.852
   46    H    LYS   7           H        LYS   7  -3.839  -8.606   0.352
   47    HA   LYS   7           HA       LYS   7  -4.613  -7.790   2.984
   48    HB2  LYS   7           1HB      LYS   7  -6.417  -8.927   2.314
   49    HB3  LYS   7           2HB      LYS   7  -5.527  -9.660   0.986
   50    HG2  LYS   7           1HG      LYS   7  -4.702 -11.395   2.505
   51    HG3  LYS   7           2HG      LYS   7  -5.620 -10.666   3.824
   52    HD2  LYS   7           1HD      LYS   7  -7.032 -11.417   1.304
   53    HD3  LYS   7           2HD      LYS   7  -6.605 -12.679   2.462
   54    HE2  LYS   7           1HE      LYS   7  -8.207 -10.200   3.089
   55    HE3  LYS   7           2HE      LYS   7  -8.882 -11.806   2.811
   56    HZ1  LYS   7           3HZ      LYS   7  -7.887 -10.733   5.198
   57    HZ2  LYS   7           1HZ      LYS   7  -6.888 -12.025   4.758
   58    HZ3  LYS   7           2HZ      LYS   7  -8.553 -12.265   4.936
   59    H    GLU   8           H        GLU   8  -2.289  -9.998   1.659
   60    HA   GLU   8           HA       GLU   8  -1.927 -11.656   3.914
   61    HB2  GLU   8           1HB      GLU   8  -1.097 -12.166   1.621
   62    HB3  GLU   8           2HB      GLU   8   0.120 -10.913   1.818
   63    HG2  GLU   8           1HG      GLU   8   1.153 -12.126   3.616
   64    HG3  GLU   8           2HG      GLU   8  -0.131 -13.333   3.588
   65    H    ILE   9           H        ILE   9  -0.355  -8.653   2.891
   66    HA   ILE   9           HA       ILE   9   1.520  -8.575   5.019
   67    HB   ILE   9           HB       ILE   9   0.457  -6.360   3.263
   68   HG12  ILE   9          1HG1      ILE   9   1.694  -8.085   2.050
   69   HG13  ILE   9          2HG1      ILE   9   2.630  -6.596   2.119
   70   HG21  ILE   9          1HG2      ILE   9   2.542  -5.157   4.026
   71   HG22  ILE   9          2HG2      ILE   9   1.255  -5.303   5.222
   72   HG23  ILE   9          3HG2      ILE   9   2.662  -6.362   5.309
   73   HD11  ILE   9          3HD1      ILE   9   4.325  -7.794   2.873
   74   HD12  ILE   9          1HD1      ILE   9   3.411  -8.057   4.358
   75   HD13  ILE   9          2HD1      ILE   9   3.308  -9.225   3.041
   76    H    ASP  10           H        ASP  10  -1.816  -7.747   4.768
   77    HA   ASP  10           HA       ASP  10  -1.828  -6.000   7.068
   78    HB2  ASP  10           1HB      ASP  10  -3.738  -6.846   5.018
   79    HB3  ASP  10           2HB      ASP  10  -4.455  -6.713   6.621
   80    H    VAL  11           H        VAL  11  -0.795  -7.547   8.522
   81    HA   VAL  11           HA       VAL  11  -1.979  -9.998   9.250
   82    HB   VAL  11           HB       VAL  11  -0.292  -8.240  11.033
   83   HG11  VAL  11          1HG1      VAL  11   0.435 -10.750  11.615
   84   HG12  VAL  11          2HG1      VAL  11  -0.886  -9.916  12.438
   85   HG13  VAL  11          3HG1      VAL  11  -1.234 -11.041  11.124
   86   HG21  VAL  11          3HG2      VAL  11   0.413  -9.892   8.668
   87   HG22  VAL  11          1HG2      VAL  11   1.137  -8.397   9.264
   88   HG23  VAL  11          2HG2      VAL  11   1.505  -9.931  10.053
   89    H    ASN  12           H        ASN  12  -2.910  -6.789   9.875
   90    HA   ASN  12           HA       ASN  12  -4.287  -7.340  12.355
   91    HB2  ASN  12           1HB      ASN  12  -5.231  -4.983  11.894
   92    HB3  ASN  12           2HB      ASN  12  -3.507  -5.129  12.225
   93   HD21  ASN  12          2HD2      ASN  12  -3.189  -3.134  11.170
   94   HD22  ASN  12          1HD2      ASN  12  -3.178  -3.031   9.446
   95    H    GLY  13           H        GLY  13  -4.891  -8.166   9.246
   96    HA2  GLY  13           1HA      GLY  13  -6.772  -8.737   8.052
   97    HA3  GLY  13           2HA      GLY  13  -7.438  -9.139   9.628
   98    H    ASP  14           H        ASP  14  -6.546  -5.996   8.231
   99    HA   ASP  14           HA       ASP  14  -9.274  -5.072   8.819
  100    HB2  ASP  14           1HB      ASP  14  -8.268  -2.779   8.664
  101    HB3  ASP  14           2HB      ASP  14  -7.609  -3.770   9.963
  102    H    GLY  15           H        GLY  15  -7.169  -5.862   6.270
  103    HA2  GLY  15           1HA      GLY  15  -7.515  -5.865   3.993
  104    HA3  GLY  15           2HA      GLY  15  -9.145  -5.283   4.299
  105    H    ALA  16           H        ALA  16  -6.776  -3.353   5.749
  106    HA   ALA  16           HA       ALA  16  -6.650  -1.547   3.436
  107    HB1  ALA  16           3HB      ALA  16  -6.882   0.285   5.353
  108    HB2  ALA  16           1HB      ALA  16  -8.278  -0.379   4.502
  109    HB3  ALA  16           2HB      ALA  16  -7.837  -0.999   6.094
  110    H    VAL  17           H        VAL  17  -4.725  -0.558   3.147
  111    HA   VAL  17           HA       VAL  17  -2.710  -0.847   5.280
  112    HB   VAL  17           HB       VAL  17  -0.989  -1.134   3.559
  113   HG11  VAL  17          1HG1      VAL  17  -2.406  -3.053   4.575
  114   HG12  VAL  17          2HG1      VAL  17  -3.081  -3.184   2.950
  115   HG13  VAL  17          3HG1      VAL  17  -1.349  -3.394   3.207
  116   HG21  VAL  17          3HG2      VAL  17  -3.257  -0.552   1.780
  117   HG22  VAL  17          1HG2      VAL  17  -1.533  -0.254   1.559
  118   HG23  VAL  17          2HG2      VAL  17  -2.199  -1.856   1.246
  119    H    SER  18           H        SER  18  -1.998   1.039   5.998
  120    HA   SER  18           HA       SER  18  -2.488   3.461   4.483
  121    HB2  SER  18           1HB      SER  18  -1.082   4.203   6.749
  122    HB3  SER  18           2HB      SER  18  -2.838   4.154   6.597
  123    HG   SER  18           HG       SER  18  -2.442   2.888   8.312
  124    H    TYR  19           H        TYR  19  -0.593   5.163   4.768
  125    HA   TYR  19           HA       TYR  19   1.382   4.579   2.969
  126    HB2  TYR  19           1HB      TYR  19   2.632   6.498   3.906
  127    HB3  TYR  19           2HB      TYR  19   0.922   6.855   3.692
  128    HD1  TYR  19           HD2      TYR  19  -0.580   6.911   5.685
  129    HD2  TYR  19           HD1      TYR  19   3.645   6.570   6.054
  130    HE1  TYR  19           HE2      TYR  19  -0.737   7.599   8.041
  131    HE2  TYR  19           HE1      TYR  19   3.500   7.256   8.412
  132    HH   TYR  19           HH       TYR  19   2.161   8.091  10.008
  133    H    GLU  20           H        GLU  20   1.550   4.250   6.496
  134    HA   GLU  20           HA       GLU  20   4.224   3.485   6.703
  135    HB2  GLU  20           1HB      GLU  20   1.838   3.361   8.392
  136    HB3  GLU  20           2HB      GLU  20   2.975   2.057   8.704
  137    HG2  GLU  20           1HG      GLU  20   4.708   4.050   8.701
  138    HG3  GLU  20           2HG      GLU  20   3.269   4.977   9.124
  139    H    GLU  21           H        GLU  21   1.319   1.468   6.337
  140    HA   GLU  21           HA       GLU  21   2.531  -1.028   6.420
  141    HB2  GLU  21           1HB      GLU  21   0.114  -0.099   4.865
  142    HB3  GLU  21           2HB      GLU  21   0.583  -1.787   5.020
  143    HG2  GLU  21           1HG      GLU  21   0.544  -1.086   7.609
  144    HG3  GLU  21           2HG      GLU  21  -0.672   0.022   6.976
  145    H    VAL  22           H        VAL  22   2.109   1.183   3.696
  146    HA   VAL  22           HA       VAL  22   3.028  -0.521   1.664
  147    HB   VAL  22           HB       VAL  22   3.102   2.488   1.882
  148   HG11  VAL  22          1HG1      VAL  22   4.759   2.122   0.311
  149   HG12  VAL  22          2HG1      VAL  22   3.986   0.665  -0.318
  150   HG13  VAL  22          3HG1      VAL  22   3.316   2.252  -0.693
  151   HG21  VAL  22          3HG2      VAL  22   1.375   1.225  -0.105
  152   HG22  VAL  22          1HG2      VAL  22   0.977   0.786   1.557
  153   HG23  VAL  22          2HG2      VAL  22   1.013   2.483   1.078
  154    H    LYS  23           H        LYS  23   4.792   2.019   3.445
  155    HA   LYS  23           HA       LYS  23   7.299   1.603   2.333
  156    HB2  LYS  23           1HB      LYS  23   6.405   2.625   5.013
  157    HB3  LYS  23           2HB      LYS  23   8.116   2.466   4.639
  158    HG2  LYS  23           1HG      LYS  23   6.419   3.912   2.687
  159    HG3  LYS  23           2HG      LYS  23   6.774   4.710   4.221
  160    HD2  LYS  23           1HD      LYS  23   8.485   5.399   2.764
  161    HD3  LYS  23           2HD      LYS  23   9.217   4.141   3.762
  162    HE2  LYS  23           1HE      LYS  23   9.041   2.539   2.019
  163    HE3  LYS  23           2HE      LYS  23   8.005   3.596   1.061
  164    HZ1  LYS  23           3HZ      LYS  23  10.039   5.163   1.135
  165    HZ2  LYS  23           1HZ      LYS  23  10.043   3.856   0.060
  166    HZ3  LYS  23           2HZ      LYS  23  10.908   3.760   1.511
  167    H    ALA  24           H        ALA  24   5.684  -0.107   4.944
  168    HA   ALA  24           HA       ALA  24   7.930  -1.588   5.828
  169    HB1  ALA  24           3HB      ALA  24   5.077  -1.518   6.371
  170    HB2  ALA  24           1HB      ALA  24   5.740  -3.151   6.423
  171    HB3  ALA  24           2HB      ALA  24   6.425  -1.887   7.446
  172    H    PHE  25           H        PHE  25   5.343  -2.286   3.508
  173    HA   PHE  25           HA       PHE  25   5.880  -4.929   2.942
  174    HB2  PHE  25           1HB      PHE  25   4.076  -3.262   1.996
  175    HB3  PHE  25           2HB      PHE  25   5.237  -3.069   0.687
  176    HD1  PHE  25           HD1      PHE  25   6.058  -6.168   1.371
  177    HD2  PHE  25           HD2      PHE  25   2.569  -4.069   0.130
  178    HE1  PHE  25           HE1      PHE  25   5.205  -8.218   0.312
  179    HE2  PHE  25           HE2      PHE  25   1.711  -6.117  -0.930
  180    HZ   PHE  25           HZ       PHE  25   3.028  -8.195  -0.839
  181    H    VAL  26           H        VAL  26   7.260  -2.080   1.305
  182    HA   VAL  26           HA       VAL  26   9.042  -3.583  -0.315
  183    HB   VAL  26           HB       VAL  26   8.204  -1.051  -0.447
  184   HG11  VAL  26          1HG1      VAL  26   9.547  -0.499   1.615
  185   HG12  VAL  26          2HG1      VAL  26  10.995  -0.730   0.632
  186   HG13  VAL  26          3HG1      VAL  26   9.837   0.533   0.214
  187   HG21  VAL  26          3HG2      VAL  26   9.681  -0.760  -2.236
  188   HG22  VAL  26          1HG2      VAL  26  10.953  -1.702  -1.457
  189   HG23  VAL  26          2HG2      VAL  26   9.523  -2.511  -2.096
  190    H    SER  27           H        SER  27   9.230  -2.270   2.906
  191    HA   SER  27           HA       SER  27  12.009  -2.234   3.251
  192    HB2  SER  27           1HB      SER  27   9.677  -1.966   4.908
  193    HB3  SER  27           2HB      SER  27  10.850  -3.007   5.714
  194    HG   SER  27           HG       SER  27  10.990  -0.311   5.099
  195    H    LYS  28           H        LYS  28   9.772  -4.854   3.091
  196    HA   LYS  28           HA       LYS  28  11.382  -6.786   4.448
  197    HB2  LYS  28           1HB      LYS  28   8.870  -6.791   2.882
  198    HB3  LYS  28           2HB      LYS  28   9.773  -8.301   2.891
  199    HG2  LYS  28           1HG      LYS  28   8.052  -8.188   4.649
  200    HG3  LYS  28           2HG      LYS  28   9.684  -8.402   5.291
  201    HD2  LYS  28           1HD      LYS  28   9.796  -5.986   5.752
  202    HD3  LYS  28           2HD      LYS  28   8.143  -5.809   5.156
  203    HE2  LYS  28           1HE      LYS  28   8.850  -7.678   7.402
  204    HE3  LYS  28           2HE      LYS  28   8.464  -5.980   7.680
  205    HZ1  LYS  28           3HZ      LYS  28   6.298  -6.338   7.329
  206    HZ2  LYS  28           1HZ      LYS  28   6.658  -7.968   7.606
  207    HZ3  LYS  28           2HZ      LYS  28   6.560  -7.380   6.023
  208    H    LYS  29           H        LYS  29  11.741  -5.245   1.521
  209    HA   LYS  29           HA       LYS  29  13.169  -7.513   0.311
  210    HB2  LYS  29           1HB      LYS  29  12.515  -4.934  -1.092
  211    HB3  LYS  29           2HB      LYS  29  12.882  -6.502  -1.799
  212    HG2  LYS  29           1HG      LYS  29  10.369  -5.709  -0.347
  213    HG3  LYS  29           2HG      LYS  29  10.548  -6.061  -2.067
  214    HD2  LYS  29           1HD      LYS  29  10.969  -8.025   0.188
  215    HD3  LYS  29           2HD      LYS  29   9.547  -7.944  -0.854
  216    HE2  LYS  29           1HE      LYS  29  10.588  -9.382  -2.199
  217    HE3  LYS  29           2HE      LYS  29  11.679  -8.063  -2.623
  218    HZ1  LYS  29           3HZ      LYS  29  12.254  -9.604  -0.201
  219    HZ2  LYS  29           1HZ      LYS  29  13.319  -8.865  -1.289
  220    HZ3  LYS  29           2HZ      LYS  29  12.576 -10.329  -1.695
  221    H    ARG  30           H        ARG  30  13.526  -4.281   1.554
  222    HA   ARG  30           HA       ARG  30  16.297  -4.534   1.936
  223    HB2  ARG  30           1HB      ARG  30  17.052  -2.775   0.322
  224    HB3  ARG  30           2HB      ARG  30  16.548  -4.280  -0.433
  225    HG2  ARG  30           1HG      ARG  30  14.234  -2.778  -0.382
  226    HG3  ARG  30           2HG      ARG  30  15.496  -1.599  -0.748
  227    HD2  ARG  30           1HD      ARG  30  14.789  -4.103  -2.255
  228    HD3  ARG  30           2HD      ARG  30  14.747  -2.436  -2.828
  229    HE   ARG  30           HE       ARG  30  17.347  -2.780  -2.229
  230   HH11  ARG  30          1HH1      ARG  30  15.096  -4.666  -4.099
  231   HH12  ARG  30          2HH1      ARG  30  16.306  -5.287  -5.171
  232   HH21  ARG  30          1HH2      ARG  30  18.950  -3.591  -3.634
  233   HH22  ARG  30          2HH2      ARG  30  18.498  -4.676  -4.906
  234    H    ALA  31           H        ALA  31  17.206  -2.021   2.067
  235    HA   ALA  31           HA       ALA  31  15.252  -0.660   3.805
  236    HB1  ALA  31           3HB      ALA  31  16.984  -1.381   5.206
  237    HB2  ALA  31           1HB      ALA  31  18.230  -0.947   4.036
  238    HB3  ALA  31           2HB      ALA  31  17.347   0.316   4.895
  239    H    ILE  32           H        ILE  32  14.377   0.760   2.340
  240    HA   ILE  32           HA       ILE  32  16.210   2.830   1.340
  241    HB   ILE  32           HB       ILE  32  14.663   3.027  -0.671
  242   HG12  ILE  32          1HG1      ILE  32  14.011   0.165  -0.477
  243   HG13  ILE  32          2HG1      ILE  32  13.148   1.185   0.670
  244   HG21  ILE  32          1HG2      ILE  32  16.322   0.522  -0.415
  245   HG22  ILE  32          2HG2      ILE  32  15.863   1.320  -1.920
  246   HG23  ILE  32          3HG2      ILE  32  16.942   2.132  -0.784
  247   HD11  ILE  32          3HD1      ILE  32  11.927   2.190  -0.939
  248   HD12  ILE  32          1HD1      ILE  32  13.221   2.107  -2.133
  249   HD13  ILE  32          2HD1      ILE  32  12.252   0.675  -1.781
  250    H    LYS  33           H        LYS  33  15.684   4.463   2.681
  251    HA   LYS  33           HA       LYS  33  12.955   4.975   3.461
  252    HB2  LYS  33           1HB      LYS  33  15.204   6.904   3.912
  253    HB3  LYS  33           2HB      LYS  33  13.812   6.567   4.931
  254    HG2  LYS  33           1HG      LYS  33  14.817   4.291   5.346
  255    HG3  LYS  33           2HG      LYS  33  16.279   4.893   4.561
  256    HD2  LYS  33           1HD      LYS  33  15.440   6.817   6.480
  257    HD3  LYS  33           2HD      LYS  33  15.449   5.231   7.255
  258    HE2  LYS  33           1HE      LYS  33  17.772   5.865   5.548
  259    HE3  LYS  33           2HE      LYS  33  17.623   6.803   7.033
  260    HZ1  LYS  33           3HZ      LYS  33  18.903   4.590   7.080
  261    HZ2  LYS  33           1HZ      LYS  33  17.373   3.867   7.099
  262    HZ3  LYS  33           2HZ      LYS  33  17.824   4.926   8.339
  263    H    ASN  34           H        ASN  34  11.635   5.758   1.936
  264    HA   ASN  34           HA       ASN  34  12.562   8.094   0.397
  265    HB2  ASN  34           1HB      ASN  34  10.657   5.930  -0.524
  266    HB3  ASN  34           2HB      ASN  34  11.101   7.362  -1.448
  267   HD21  ASN  34          2HD2      ASN  34  11.632   4.194  -1.235
  268   HD22  ASN  34          1HD2      ASN  34  13.251   4.100  -1.832
  269    H    GLU  35           H        GLU  35  11.658   9.741   1.508
  270    HA   GLU  35           HA       GLU  35   9.049   9.586   2.673
  271    HB2  GLU  35           1HB      GLU  35  11.287  11.353   2.792
  272    HB3  GLU  35           2HB      GLU  35   9.865  12.299   2.377
  273    HG2  GLU  35           1HG      GLU  35  10.292  10.574   4.797
  274    HG3  GLU  35           2HG      GLU  35  10.055  12.320   4.733
  275    H    GLN  36           H        GLN  36  10.417  11.076  -0.227
  276    HA   GLN  36           HA       GLN  36   7.992  12.343  -1.027
  277    HB2  GLN  36           1HB      GLN  36  10.548  12.690  -1.748
  278    HB3  GLN  36           2HB      GLN  36  10.038  11.641  -3.063
  279    HG2  GLN  36           1HG      GLN  36   8.095  13.707  -2.642
  280    HG3  GLN  36           2HG      GLN  36   9.700  14.407  -2.845
  281   HE21  GLN  36          2HE2      GLN  36   7.107  12.710  -4.345
  282   HE22  GLN  36          1HE2      GLN  36   7.731  12.739  -5.955
  283    H    LEU  37           H        LEU  37   9.687   9.415  -2.134
  284    HA   LEU  37           HA       LEU  37   7.812   8.639  -4.062
  285    HB2  LEU  37           1HB      LEU  37   9.482   6.768  -2.399
  286    HB3  LEU  37           2HB      LEU  37   8.852   6.495  -4.022
  287    HG   LEU  37           HG       LEU  37  11.047   8.408  -3.237
  288   HD11  LEU  37          1HD1      LEU  37  12.533   6.880  -3.952
  289   HD12  LEU  37          2HD1      LEU  37  11.475   6.292  -5.235
  290   HD13  LEU  37          3HD1      LEU  37  11.242   5.739  -3.577
  291   HD21  LEU  37          3HD2      LEU  37   9.363   8.215  -5.639
  292   HD22  LEU  37          1HD2      LEU  37  11.100   8.292  -5.940
  293   HD23  LEU  37          2HD2      LEU  37  10.308   9.569  -5.016
  294    H    LEU  38           H        LEU  38   8.007   7.951  -0.604
  295    HA   LEU  38           HA       LEU  38   5.933   6.058  -0.478
  296    HB2  LEU  38           1HB      LEU  38   7.407   6.258   1.367
  297    HB3  LEU  38           2HB      LEU  38   7.057   7.976   1.548
  298    HG   LEU  38           HG       LEU  38   6.071   6.308   3.251
  299   HD11  LEU  38          1HD1      LEU  38   3.793   7.857   2.377
  300   HD12  LEU  38          2HD1      LEU  38   5.283   8.800   2.319
  301   HD13  LEU  38          3HD1      LEU  38   4.786   8.027   3.825
  302   HD21  LEU  38          3HD2      LEU  38   4.393   4.928   2.665
  303   HD22  LEU  38          1HD2      LEU  38   5.113   5.051   1.060
  304   HD23  LEU  38          2HD2      LEU  38   3.731   6.060   1.485
  305    H    GLN  39           H        GLN  39   5.899   9.580   0.012
  306    HA   GLN  39           HA       GLN  39   3.155   9.799   0.581
  307    HB2  GLN  39           1HB      GLN  39   5.375  11.587   0.077
  308    HB3  GLN  39           2HB      GLN  39   3.906  12.180  -0.687
  309    HG2  GLN  39           1HG      GLN  39   3.470  11.255   2.034
  310    HG3  GLN  39           2HG      GLN  39   4.644  12.566   1.928
  311   HE21  GLN  39          2HE2      GLN  39   1.474  11.650   0.619
  312   HE22  GLN  39          1HE2      GLN  39   0.782  13.228   0.729
  313    H    LEU  40           H        LEU  40   4.918  10.322  -2.471
  314    HA   LEU  40           HA       LEU  40   2.667  10.864  -4.053
  315    HB2  LEU  40           1HB      LEU  40   5.342  10.892  -4.454
  316    HB3  LEU  40           2HB      LEU  40   4.895   9.440  -5.350
  317    HG   LEU  40           HG       LEU  40   3.903  12.248  -5.829
  318   HD11  LEU  40          1HD1      LEU  40   6.209  10.997  -6.684
  319   HD12  LEU  40          2HD1      LEU  40   5.446  12.404  -7.425
  320   HD13  LEU  40          3HD1      LEU  40   5.094  10.787  -8.035
  321   HD21  LEU  40          3HD2      LEU  40   2.855  11.074  -7.869
  322   HD22  LEU  40          1HD2      LEU  40   2.036  10.948  -6.312
  323   HD23  LEU  40          2HD2      LEU  40   3.005   9.601  -6.910
  324    H    ILE  41           H        ILE  41   4.471   7.821  -3.627
  325    HA   ILE  41           HA       ILE  41   2.812   6.236  -5.242
  326    HB   ILE  41           HB       ILE  41   4.575   5.490  -2.912
  327   HG12  ILE  41          1HG1      ILE  41   5.006   4.900  -5.833
  328   HG13  ILE  41          2HG1      ILE  41   5.510   6.430  -5.124
  329   HG21  ILE  41          1HG2      ILE  41   3.013   3.730  -4.787
  330   HG22  ILE  41          2HG2      ILE  41   4.387   3.158  -3.843
  331   HG23  ILE  41          3HG2      ILE  41   2.949   3.768  -3.025
  332   HD11  ILE  41          3HD1      ILE  41   7.431   5.182  -5.000
  333   HD12  ILE  41          1HD1      ILE  41   6.733   4.917  -3.404
  334   HD13  ILE  41          2HD1      ILE  41   6.565   3.685  -4.654
  335    H    PHE  42           H        PHE  42   2.554   7.222  -1.893
  336    HA   PHE  42           HA       PHE  42   0.631   5.374  -1.029
  337    HB2  PHE  42           1HB      PHE  42   1.750   6.697   0.610
  338    HB3  PHE  42           2HB      PHE  42   1.239   8.198  -0.155
  339    HD1  PHE  42           HD1      PHE  42  -0.254   5.129   1.352
  340    HD2  PHE  42           HD2      PHE  42  -0.511   9.340   0.791
  341    HE1  PHE  42           HE1      PHE  42  -2.222   5.202   2.828
  342    HE2  PHE  42           HE2      PHE  42  -2.478   9.420   2.266
  343    HZ   PHE  42           HZ       PHE  42  -3.335   7.350   3.288
  344    H    LYS  43           H        LYS  43   0.229   8.638  -2.384
  345    HA   LYS  43           HA       LYS  43  -2.620   8.518  -2.377
  346    HB2  LYS  43           1HB      LYS  43  -0.741  10.512  -2.698
  347    HB3  LYS  43           2HB      LYS  43  -1.420  10.357  -4.312
  348    HG2  LYS  43           1HG      LYS  43  -3.422  11.193  -3.701
  349    HG3  LYS  43           2HG      LYS  43  -3.363  10.457  -2.098
  350    HD2  LYS  43           1HD      LYS  43  -2.566  12.327  -1.180
  351    HD3  LYS  43           2HD      LYS  43  -1.320  12.484  -2.420
  352    HE2  LYS  43           1HE      LYS  43  -4.180  13.213  -2.963
  353    HE3  LYS  43           2HE      LYS  43  -3.065  14.354  -2.212
  354    HZ1  LYS  43           3HZ      LYS  43  -3.384  14.181  -4.824
  355    HZ2  LYS  43           1HZ      LYS  43  -2.154  13.033  -4.644
  356    HZ3  LYS  43           2HZ      LYS  43  -1.910  14.622  -4.119
  357    H    SER  44           H        SER  44  -0.120   7.666  -4.663
  358    HA   SER  44           HA       SER  44  -1.796   7.468  -6.949
  359    HB2  SER  44           1HB      SER  44   0.937   6.397  -6.275
  360    HB3  SER  44           2HB      SER  44   0.141   5.990  -7.794
  361    HG   SER  44           HG       SER  44  -0.103   8.378  -8.000
  362    H    ILE  45           H        ILE  45  -0.470   5.024  -4.726
  363    HA   ILE  45           HA       ILE  45  -1.807   2.831  -5.909
  364    HB   ILE  45           HB       ILE  45  -0.693   3.167  -3.124
  365   HG12  ILE  45          1HG1      ILE  45   0.386   1.822  -5.611
  366   HG13  ILE  45          2HG1      ILE  45   0.996   3.298  -4.873
  367   HG21  ILE  45          1HG2      ILE  45  -2.390   1.447  -3.091
  368   HG22  ILE  45          2HG2      ILE  45  -1.685   0.683  -4.513
  369   HG23  ILE  45          3HG2      ILE  45  -0.795   0.703  -2.993
  370   HD11  ILE  45          3HD1      ILE  45   1.564   1.977  -2.851
  371   HD12  ILE  45          1HD1      ILE  45   1.096   0.521  -3.730
  372   HD13  ILE  45          2HD1      ILE  45   2.449   1.499  -4.299
  373    H    ASP  46           H        ASP  46  -2.707   5.130  -3.426
  374    HA   ASP  46           HA       ASP  46  -5.103   3.662  -2.714
  375    HB2  ASP  46           1HB      ASP  46  -3.580   5.230  -1.217
  376    HB3  ASP  46           2HB      ASP  46  -4.647   6.482  -1.848
  377    H    ALA  47           H        ALA  47  -6.949   3.819  -3.787
  378    HA   ALA  47           HA       ALA  47  -7.329   5.541  -5.983
  379    HB1  ALA  47           3HB      ALA  47  -9.474   4.087  -4.442
  380    HB2  ALA  47           1HB      ALA  47  -9.549   4.647  -6.113
  381    HB3  ALA  47           2HB      ALA  47  -8.450   3.341  -5.668
  382    H    ASP  48           H        ASP  48  -8.481   5.681  -2.639
  383    HA   ASP  48           HA       ASP  48  -9.558   8.367  -3.175
  384    HB2  ASP  48           1HB      ASP  48 -10.868   8.057  -1.091
  385    HB3  ASP  48           2HB      ASP  48 -11.236   6.842  -2.313
  386    H    GLY  49           H        GLY  49  -7.065   6.657  -1.612
  387    HA2  GLY  49           1HA      GLY  49  -5.345   7.319  -0.245
  388    HA3  GLY  49           2HA      GLY  49  -5.682   8.949  -0.808
  389    H    ASN  50           H        ASN  50  -7.978   6.953   0.944
  390    HA   ASN  50           HA       ASN  50  -8.219   9.013   2.962
  391    HB2  ASN  50           1HB      ASN  50 -10.090   7.633   3.810
  392    HB3  ASN  50           2HB      ASN  50 -10.250   7.985   2.091
  393   HD21  ASN  50          2HD2      ASN  50 -11.596   5.911   3.347
  394   HD22  ASN  50          1HD2      ASN  50 -11.002   4.409   2.734
  395    H    GLY  51           H        GLY  51  -6.074   8.752   3.868
  396    HA2  GLY  51           1HA      GLY  51  -4.737   8.084   5.618
  397    HA3  GLY  51           2HA      GLY  51  -6.089   7.123   6.197
  398    H    GLU  52           H        GLU  52  -6.452   5.372   4.091
  399    HA   GLU  52           HA       GLU  52  -3.907   4.107   3.513
  400    HB2  GLU  52           1HB      GLU  52  -4.810   1.902   4.459
  401    HB3  GLU  52           2HB      GLU  52  -4.194   3.085   5.603
  402    HG2  GLU  52           1HG      GLU  52  -6.328   1.949   6.257
  403    HG3  GLU  52           2HG      GLU  52  -6.367   3.711   6.276
  404    H    ILE  53           H        ILE  53  -4.214   2.123   2.159
  405    HA   ILE  53           HA       ILE  53  -6.382   2.611   0.261
  406    HB   ILE  53           HB       ILE  53  -4.164   0.628  -0.140
  407   HG12  ILE  53          1HG1      ILE  53  -3.441   2.969  -1.484
  408   HG13  ILE  53          2HG1      ILE  53  -3.926   3.509   0.119
  409   HG21  ILE  53          1HG2      ILE  53  -4.626   1.717  -2.538
  410   HG22  ILE  53          2HG2      ILE  53  -5.535   0.341  -1.918
  411   HG23  ILE  53          3HG2      ILE  53  -6.208   1.967  -1.801
  412   HD11  ILE  53          3HD1      ILE  53  -2.315   1.246   0.507
  413   HD12  ILE  53          1HD1      ILE  53  -1.508   2.238  -0.708
  414   HD13  ILE  53          2HD1      ILE  53  -1.928   2.931   0.859
  415    H    ASP  54           H        ASP  54  -8.128   1.371   0.185
  416    HA   ASP  54           HA       ASP  54  -8.382  -0.920   1.895
  417    HB2  ASP  54           1HB      ASP  54 -10.380  -0.154  -0.216
  418    HB3  ASP  54           2HB      ASP  54 -10.663  -0.899   1.354
  419    H    GLN  55           H        GLN  55  -9.125  -3.033   1.136
  420    HA   GLN  55           HA       GLN  55  -7.397  -4.199  -0.694
  421    HB2  GLN  55           1HB      GLN  55  -8.982  -6.138  -0.652
  422    HB3  GLN  55           2HB      GLN  55  -8.493  -5.564   0.936
  423    HG2  GLN  55           1HG      GLN  55 -10.625  -4.281   1.050
  424    HG3  GLN  55           2HG      GLN  55 -11.112  -5.063  -0.454
  425   HE21  GLN  55          2HE2      GLN  55 -12.901  -5.948   0.666
  426   HE22  GLN  55          1HE2      GLN  55 -12.712  -7.323   1.693
  427    H    ASN  56           H        ASN  56 -10.749  -3.130  -1.150
  428    HA   ASN  56           HA       ASN  56 -11.097  -4.018  -3.773
  429    HB2  ASN  56           1HB      ASN  56 -12.583  -2.541  -1.922
  430    HB3  ASN  56           2HB      ASN  56 -12.407  -1.470  -3.310
  431   HD21  ASN  56          2HD2      ASN  56 -14.452  -1.566  -4.065
  432   HD22  ASN  56          1HD2      ASN  56 -15.195  -3.004  -4.670
  433    H    GLU  57           H        GLU  57  -9.976  -0.851  -2.596
  434    HA   GLU  57           HA       GLU  57  -9.590   0.344  -5.093
  435    HB2  GLU  57           1HB      GLU  57  -7.981   0.843  -2.582
  436    HB3  GLU  57           2HB      GLU  57  -8.167   1.941  -3.942
  437    HG2  GLU  57           1HG      GLU  57 -10.394   2.405  -3.416
  438    HG3  GLU  57           2HG      GLU  57 -10.529   1.001  -2.359
  439    H    PHE  58           H        PHE  58  -7.373  -1.562  -3.090
  440    HA   PHE  58           HA       PHE  58  -5.103  -1.274  -4.728
  441    HB2  PHE  58           1HB      PHE  58  -5.325  -2.216  -2.311
  442    HB3  PHE  58           2HB      PHE  58  -5.620  -3.754  -3.114
  443    HD1  PHE  58           HD1      PHE  58  -3.160  -1.090  -2.532
  444    HD2  PHE  58           HD2      PHE  58  -3.859  -4.943  -4.199
  445    HE1  PHE  58           HE1      PHE  58  -0.733  -1.428  -2.756
  446    HE2  PHE  58           HE2      PHE  58  -1.433  -5.288  -4.427
  447    HZ   PHE  58           HZ       PHE  58   0.133  -3.530  -3.705
  448    H    ALA  59           H        ALA  59  -7.700  -3.670  -4.690
  449    HA   ALA  59           HA       ALA  59  -6.637  -5.442  -6.582
  450    HB1  ALA  59           3HB      ALA  59  -9.269  -5.753  -6.994
  451    HB2  ALA  59           1HB      ALA  59  -8.419  -6.420  -5.600
  452    HB3  ALA  59           2HB      ALA  59  -9.308  -4.904  -5.449
  453    H    LYS  60           H        LYS  60  -8.931  -2.752  -7.030
  454    HA   LYS  60           HA       LYS  60  -9.076  -2.988  -9.841
  455    HB2  LYS  60           1HB      LYS  60  -9.581  -0.558  -8.114
  456    HB3  LYS  60           2HB      LYS  60 -10.104  -0.760  -9.781
  457    HG2  LYS  60           1HG      LYS  60 -10.950  -2.755  -7.735
  458    HG3  LYS  60           2HG      LYS  60 -11.757  -1.187  -7.812
  459    HD2  LYS  60           1HD      LYS  60 -11.388  -2.840 -10.283
  460    HD3  LYS  60           2HD      LYS  60 -12.722  -3.165  -9.174
  461    HE2  LYS  60           1HE      LYS  60 -13.884  -1.475 -10.027
  462    HE3  LYS  60           2HE      LYS  60 -12.571  -0.353  -9.671
  463    HZ1  LYS  60           3HZ      LYS  60 -13.182  -0.438 -12.045
  464    HZ2  LYS  60           1HZ      LYS  60 -12.701  -2.059 -12.098
  465    HZ3  LYS  60           2HZ      LYS  60 -11.565  -0.849 -11.769
  466    H    PHE  61           H        PHE  61  -6.780  -1.507  -7.720
  467    HA   PHE  61           HA       PHE  61  -5.611   0.187  -9.737
  468    HB2  PHE  61           1HB      PHE  61  -5.325   1.072  -7.602
  469    HB3  PHE  61           2HB      PHE  61  -4.952  -0.496  -6.893
  470    HD1  PHE  61           HD1      PHE  61  -3.528   1.536  -9.685
  471    HD2  PHE  61           HD2      PHE  61  -2.822  -0.589  -6.065
  472    HE1  PHE  61           HE1      PHE  61  -1.126   2.033  -9.865
  473    HE2  PHE  61           HE2      PHE  61  -0.419  -0.095  -6.239
  474    HZ   PHE  61           HZ       PHE  61   0.433   1.219  -8.141
  475    H    TYR  62           H        TYR  62  -5.018  -2.988  -8.379
  476    HA   TYR  62           HA       TYR  62  -2.430  -3.400  -9.395
  477    HB2  TYR  62           1HB      TYR  62  -3.496  -4.821  -7.664
  478    HB3  TYR  62           2HB      TYR  62  -4.578  -5.471  -8.892
  479    HD1  TYR  62           HD2      TYR  62  -0.926  -5.054  -8.219
  480    HD2  TYR  62           HD1      TYR  62  -3.994  -7.445  -9.943
  481    HE1  TYR  62           HE2      TYR  62   0.735  -6.786  -8.758
  482    HE2  TYR  62           HE1      TYR  62  -2.342  -9.185 -10.485
  483    HH   TYR  62           HH       TYR  62   1.060  -8.846  -9.538
  484    H    GLY  63           H        GLY  63  -1.783  -3.471 -11.435
  485    HA2  GLY  63           1HA      GLY  63  -1.711  -4.246 -13.632
  486    HA3  GLY  63           2HA      GLY  63  -3.295  -4.970 -13.403
  487    H    SER  64           H        SER  64  -3.453  -1.849 -12.315
  488    HA   SER  64           HA       SER  64  -4.800  -1.006 -14.763
  489    HB2  SER  64           1HB      SER  64  -6.009  -0.773 -12.631
  490    HB3  SER  64           2HB      SER  64  -4.735   0.285 -12.023
  491    HG   SER  64           HG       SER  64  -6.843   1.051 -13.277
  492    H    ILE  65           H        ILE  65  -1.832  -1.095 -14.429
  493    HA   ILE  65           HA       ILE  65  -1.100   1.726 -14.538
  494    HB   ILE  65           HB       ILE  65   0.288  -0.024 -13.318
  495   HG12  ILE  65          1HG1      ILE  65   2.159   1.185 -15.231
  496   HG13  ILE  65          2HG1      ILE  65   0.979   2.315 -14.578
  497   HG21  ILE  65          1HG2      ILE  65   1.656  -1.502 -14.498
  498   HG22  ILE  65          2HG2      ILE  65   0.098  -1.623 -15.313
  499   HG23  ILE  65          3HG2      ILE  65   1.395  -0.667 -16.029
  500   HD11  ILE  65          3HD1      ILE  65   3.253   1.977 -13.385
  501   HD12  ILE  65          1HD1      ILE  65   1.775   2.109 -12.432
  502   HD13  ILE  65          2HD1      ILE  65   2.489   0.526 -12.735
  503    H    GLN  66           H        GLN  66  -2.631   0.075 -16.651
  504    HA   GLN  66           HA       GLN  66  -1.054  -0.183 -18.946
  505    HB2  GLN  66           1HB      GLN  66  -3.987   0.535 -18.842
  506    HB3  GLN  66           2HB      GLN  66  -3.134  -0.203 -20.192
  507    HG2  GLN  66           1HG      GLN  66  -2.613  -2.111 -18.565
  508    HG3  GLN  66           2HG      GLN  66  -3.877  -1.411 -17.556
  509   HE21  GLN  66          2HE2      GLN  66  -6.013  -1.286 -18.410
  510   HE22  GLN  66          1HE2      GLN  66  -6.533  -2.391 -19.631
  Start of MODEL    4
    1    H1   MET   1           H        MET   1   2.936 -12.032  -7.520
    2    HA   MET   1           HA       MET   1   1.688 -10.412  -8.773
    3    HB2  MET   1           1HB      MET   1   1.340 -13.008 -10.268
    4    HB3  MET   1           2HB      MET   1   1.542 -11.398 -10.944
    5    HG2  MET   1           1HG      MET   1   3.827 -11.320 -10.116
    6    HG3  MET   1           2HG      MET   1   3.628 -12.918  -9.398
    7    HE1  MET   1           3HE      MET   1   4.765 -15.226 -11.665
    8    HE2  MET   1           1HE      MET   1   3.804 -14.854 -10.233
    9    HE3  MET   1           2HE      MET   1   3.003 -15.261 -11.751
   10    H    ALA   2           H        ALA   2  -0.116 -10.428  -7.027
   11    HA   ALA   2           HA       ALA   2  -2.603 -10.541  -8.405
   12    HB1  ALA   2           3HB      ALA   2  -2.271 -12.948  -7.833
   13    HB2  ALA   2           1HB      ALA   2  -2.323 -12.496  -6.130
   14    HB3  ALA   2           2HB      ALA   2  -3.735 -12.235  -7.155
   15    H    GLU   3           H        GLU   3  -4.406 -10.522  -6.381
   16    HA   GLU   3           HA       GLU   3  -3.672  -8.079  -4.970
   17    HB2  GLU   3           1HB      GLU   3  -6.373  -9.404  -4.912
   18    HB3  GLU   3           2HB      GLU   3  -5.980  -7.713  -4.638
   19    HG2  GLU   3           1HG      GLU   3  -6.094  -9.219  -7.221
   20    HG3  GLU   3           2HG      GLU   3  -6.958  -7.756  -6.750
   21    H    ALA   4           H        ALA   4  -4.263 -11.437  -4.367
   22    HA   ALA   4           HA       ALA   4  -4.934 -11.424  -1.669
   23    HB1  ALA   4           3HB      ALA   4  -5.079 -13.555  -2.341
   24    HB2  ALA   4           1HB      ALA   4  -3.820 -13.357  -3.561
   25    HB3  ALA   4           2HB      ALA   4  -3.379 -13.655  -1.879
   26    H    LEU   5           H        LEU   5  -1.963 -10.616  -3.199
   27    HA   LEU   5           HA       LEU   5  -0.177 -11.157  -1.079
   28    HB2  LEU   5           1HB      LEU   5   0.235  -8.879  -2.968
   29    HB3  LEU   5           2HB      LEU   5   1.417 -10.000  -2.295
   30    HG   LEU   5           HG       LEU   5  -0.551 -10.536  -4.514
   31   HD11  LEU   5          1HD1      LEU   5   1.141  -9.637  -5.680
   32   HD12  LEU   5          2HD1      LEU   5   1.921 -11.196  -5.415
   33   HD13  LEU   5          3HD1      LEU   5   2.293  -9.833  -4.359
   34   HD21  LEU   5          3HD2      LEU   5   0.955 -12.365  -2.752
   35   HD22  LEU   5          1HD2      LEU   5   1.004 -12.720  -4.479
   36   HD23  LEU   5          2HD2      LEU   5  -0.546 -12.622  -3.642
   37    H    PHE   6           H        PHE   6  -2.192  -8.382  -1.866
   38    HA   PHE   6           HA       PHE   6  -1.093  -6.586   0.010
   39    HB2  PHE   6           1HB      PHE   6  -2.414  -5.544  -1.595
   40    HB3  PHE   6           2HB      PHE   6  -3.691  -6.750  -1.473
   41    HD1  PHE   6           HD2      PHE   6  -5.241  -6.709   0.461
   42    HD2  PHE   6           HD1      PHE   6  -2.413  -3.607  -0.241
   43    HE1  PHE   6           HE2      PHE   6  -6.497  -5.228   1.970
   44    HE2  PHE   6           HE1      PHE   6  -3.664  -2.120   1.269
   45    HZ   PHE   6           HZ       PHE   6  -5.709  -2.930   2.375
   46    H    LYS   7           H        LYS   7  -3.895  -8.762   0.195
   47    HA   LYS   7           HA       LYS   7  -4.465  -8.092   2.921
   48    HB2  LYS   7           1HB      LYS   7  -6.416  -8.954   2.251
   49    HB3  LYS   7           2HB      LYS   7  -5.673  -9.665   0.824
   50    HG2  LYS   7           1HG      LYS   7  -4.997 -11.608   2.152
   51    HG3  LYS   7           2HG      LYS   7  -5.768 -10.897   3.571
   52    HD2  LYS   7           1HD      LYS   7  -7.357 -11.266   1.070
   53    HD3  LYS   7           2HD      LYS   7  -7.040 -12.659   2.109
   54    HE2  LYS   7           1HE      LYS   7  -7.903 -10.333   3.617
   55    HE3  LYS   7           2HE      LYS   7  -9.083 -10.809   2.397
   56    HZ1  LYS   7           3HZ      LYS   7  -8.836 -13.126   3.319
   57    HZ2  LYS   7           1HZ      LYS   7  -9.619 -12.012   4.321
   58    HZ3  LYS   7           2HZ      LYS   7  -8.011 -12.436   4.624
   59    H    GLU   8           H        GLU   8  -2.469 -10.420   1.299
   60    HA   GLU   8           HA       GLU   8  -2.207 -12.280   3.420
   61    HB2  GLU   8           1HB      GLU   8  -1.610 -12.872   1.136
   62    HB3  GLU   8           2HB      GLU   8  -0.347 -11.649   1.122
   63    HG2  GLU   8           1HG      GLU   8   0.722 -12.907   3.027
   64    HG3  GLU   8           2HG      GLU   8  -0.432 -14.199   2.706
   65    H    ILE   9           H        ILE   9  -0.190  -9.543   2.381
   66    HA   ILE   9           HA       ILE   9   1.725  -9.835   4.452
   67    HB   ILE   9           HB       ILE   9   1.044  -7.399   2.801
   68   HG12  ILE   9          1HG1      ILE   9   1.791  -9.405   1.518
   69   HG13  ILE   9          2HG1      ILE   9   2.902  -8.045   1.395
   70   HG21  ILE   9          1HG2      ILE   9   3.270  -6.589   3.444
   71   HG22  ILE   9          2HG2      ILE   9   2.207  -6.778   4.838
   72   HG23  ILE   9          3HG2      ILE   9   3.457  -7.979   4.513
   73   HD11  ILE   9          3HD1      ILE   9   4.572  -9.211   2.275
   74   HD12  ILE   9          1HD1      ILE   9   3.565  -9.824   3.586
   75   HD13  ILE   9          2HD1      ILE   9   3.564 -10.635   2.019
   76    H    ASP  10           H        ASP  10  -1.403  -8.389   4.300
   77    HA   ASP  10           HA       ASP  10  -1.065  -6.639   6.545
   78    HB2  ASP  10           1HB      ASP  10  -3.229  -7.372   4.696
   79    HB3  ASP  10           2HB      ASP  10  -3.772  -7.017   6.334
   80    H    VAL  11           H        VAL  11  -0.117  -8.220   8.011
   81    HA   VAL  11           HA       VAL  11  -1.478 -10.498   8.934
   82    HB   VAL  11           HB       VAL  11   0.435  -8.819  10.555
   83   HG11  VAL  11          1HG1      VAL  11  -0.323 -10.400  12.024
   84   HG12  VAL  11          2HG1      VAL  11  -0.650 -11.583  10.756
   85   HG13  VAL  11          3HG1      VAL  11   1.008 -11.286  11.281
   86   HG21  VAL  11          3HG2      VAL  11   2.187 -10.353   9.622
   87   HG22  VAL  11          1HG2      VAL  11   0.991 -10.892   8.442
   88   HG23  VAL  11          2HG2      VAL  11   1.511  -9.206   8.465
   89    H    ASN  12           H        ASN  12  -2.087  -7.190   9.436
   90    HA   ASN  12           HA       ASN  12  -3.380  -7.492  12.000
   91    HB2  ASN  12           1HB      ASN  12  -4.142  -5.089  11.460
   92    HB3  ASN  12           2HB      ASN  12  -2.420  -5.368  11.706
   93   HD21  ASN  12          2HD2      ASN  12  -1.878  -3.542  10.517
   94   HD22  ASN  12          1HD2      ASN  12  -2.006  -3.498   8.794
   95    H    GLY  13           H        GLY  13  -4.212  -8.385   8.952
   96    HA2  GLY  13           1HA      GLY  13  -6.200  -8.774   7.851
   97    HA3  GLY  13           2HA      GLY  13  -6.770  -9.193   9.460
   98    H    ASP  14           H        ASP  14  -5.775  -6.010   8.289
   99    HA   ASP  14           HA       ASP  14  -8.388  -4.970   9.086
  100    HB2  ASP  14           1HB      ASP  14  -7.272  -2.733   8.783
  101    HB3  ASP  14           2HB      ASP  14  -6.547  -3.758  10.019
  102    H    GLY  15           H        GLY  15  -6.640  -5.825   6.288
  103    HA2  GLY  15           1HA      GLY  15  -7.219  -5.753   4.064
  104    HA3  GLY  15           2HA      GLY  15  -8.810  -5.203   4.569
  105    H    ALA  16           H        ALA  16  -6.385  -3.235   5.816
  106    HA   ALA  16           HA       ALA  16  -6.497  -1.401   3.522
  107    HB1  ALA  16           3HB      ALA  16  -6.569   0.326   5.635
  108    HB2  ALA  16           1HB      ALA  16  -7.962  -0.156   4.668
  109    HB3  ALA  16           2HB      ALA  16  -7.617  -0.979   6.190
  110    H    VAL  17           H        VAL  17  -4.656  -0.267   3.132
  111    HA   VAL  17           HA       VAL  17  -2.447  -0.580   5.059
  112    HB   VAL  17           HB       VAL  17  -2.363  -0.847   2.059
  113   HG11  VAL  17          1HG1      VAL  17  -0.413   0.367   3.711
  114   HG12  VAL  17          2HG1      VAL  17   0.207  -1.213   3.228
  115   HG13  VAL  17          3HG1      VAL  17  -0.293  -0.048   2.002
  116   HG21  VAL  17          3HG2      VAL  17  -1.519  -3.020   2.455
  117   HG22  VAL  17          1HG2      VAL  17  -1.245  -2.682   4.164
  118   HG23  VAL  17          2HG2      VAL  17  -2.890  -2.827   3.547
  119    H    SER  18           H        SER  18  -1.952   1.345   5.864
  120    HA   SER  18           HA       SER  18  -2.521   3.771   4.385
  121    HB2  SER  18           1HB      SER  18  -1.164   4.485   6.715
  122    HB3  SER  18           2HB      SER  18  -2.913   4.454   6.489
  123    HG   SER  18           HG       SER  18  -3.021   2.764   7.730
  124    H    TYR  19           H        TYR  19  -0.733   5.554   4.685
  125    HA   TYR  19           HA       TYR  19   1.323   5.050   2.944
  126    HB2  TYR  19           1HB      TYR  19   2.426   7.066   3.874
  127    HB3  TYR  19           2HB      TYR  19   0.708   7.310   3.577
  128    HD1  TYR  19           HD2      TYR  19  -0.881   7.308   5.510
  129    HD2  TYR  19           HD1      TYR  19   3.338   7.282   6.054
  130    HE1  TYR  19           HE2      TYR  19  -1.183   8.051   7.835
  131    HE2  TYR  19           HE1      TYR  19   3.049   8.023   8.380
  132    HH   TYR  19           HH       TYR  19   0.915   7.759  10.143
  133    H    GLU  20           H        GLU  20   1.444   4.892   6.491
  134    HA   GLU  20           HA       GLU  20   4.157   4.229   6.722
  135    HB2  GLU  20           1HB      GLU  20   1.814   4.266   8.453
  136    HB3  GLU  20           2HB      GLU  20   2.914   2.952   8.850
  137    HG2  GLU  20           1HG      GLU  20   4.369   5.394   8.415
  138    HG3  GLU  20           2HG      GLU  20   3.106   5.622   9.624
  139    H    GLU  21           H        GLU  21   1.282   2.151   6.537
  140    HA   GLU  21           HA       GLU  21   2.565  -0.311   6.819
  141    HB2  GLU  21           1HB      GLU  21  -0.008   0.591   5.611
  142    HB3  GLU  21           2HB      GLU  21   0.538  -1.044   5.267
  143    HG2  GLU  21           1HG      GLU  21   0.865  -0.887   7.973
  144    HG3  GLU  21           2HG      GLU  21  -0.577   0.091   7.711
  145    H    VAL  22           H        VAL  22   1.989   1.662   3.946
  146    HA   VAL  22           HA       VAL  22   2.836  -0.175   2.010
  147    HB   VAL  22           HB       VAL  22   2.919   2.840   2.022
  148   HG11  VAL  22          1HG1      VAL  22   4.464   2.501   0.384
  149   HG12  VAL  22          2HG1      VAL  22   3.871   0.884   0.004
  150   HG13  VAL  22          3HG1      VAL  22   2.999   2.303  -0.577
  151   HG21  VAL  22          3HG2      VAL  22   1.092   0.957   0.539
  152   HG22  VAL  22          1HG2      VAL  22   0.703   1.683   2.099
  153   HG23  VAL  22          2HG2      VAL  22   0.943   2.708   0.685
  154    H    LYS  23           H        LYS  23   4.676   2.438   3.590
  155    HA   LYS  23           HA       LYS  23   7.144   1.867   2.395
  156    HB2  LYS  23           1HB      LYS  23   6.161   3.528   4.577
  157    HB3  LYS  23           2HB      LYS  23   7.766   2.888   4.903
  158    HG2  LYS  23           1HG      LYS  23   7.017   4.357   2.386
  159    HG3  LYS  23           2HG      LYS  23   7.752   5.114   3.801
  160    HD2  LYS  23           1HD      LYS  23   8.960   2.851   2.210
  161    HD3  LYS  23           2HD      LYS  23   9.408   4.552   2.061
  162    HE2  LYS  23           1HE      LYS  23   9.709   2.800   4.497
  163    HE3  LYS  23           2HE      LYS  23  11.003   3.424   3.474
  164    HZ1  LYS  23           3HZ      LYS  23   9.649   4.684   5.648
  165    HZ2  LYS  23           1HZ      LYS  23   9.610   5.643   4.256
  166    HZ3  LYS  23           2HZ      LYS  23  11.092   5.123   4.882
  167    H    ALA  24           H        ALA  24   5.583   0.551   5.252
  168    HA   ALA  24           HA       ALA  24   7.859  -0.855   6.228
  169    HB1  ALA  24           3HB      ALA  24   6.459  -1.727   7.855
  170    HB2  ALA  24           1HB      ALA  24   5.680  -0.195   7.459
  171    HB3  ALA  24           2HB      ALA  24   5.047  -1.704   6.799
  172    H    PHE  25           H        PHE  25   5.082  -1.772   4.223
  173    HA   PHE  25           HA       PHE  25   5.494  -4.491   4.025
  174    HB2  PHE  25           1HB      PHE  25   4.323  -2.447   2.187
  175    HB3  PHE  25           2HB      PHE  25   4.578  -4.080   1.581
  176    HD1  PHE  25           HD1      PHE  25   3.763  -3.446   5.088
  177    HD2  PHE  25           HD2      PHE  25   2.227  -4.490   1.259
  178    HE1  PHE  25           HE1      PHE  25   1.653  -4.160   6.133
  179    HE2  PHE  25           HE2      PHE  25   0.113  -5.204   2.297
  180    HZ   PHE  25           HZ       PHE  25  -0.176  -5.039   4.738
  181    H    VAL  26           H        VAL  26   6.854  -1.954   1.931
  182    HA   VAL  26           HA       VAL  26   8.444  -3.750   0.403
  183    HB   VAL  26           HB       VAL  26   7.674  -1.244  -0.053
  184   HG11  VAL  26          1HG1      VAL  26   9.379   0.372   0.278
  185   HG12  VAL  26          2HG1      VAL  26   9.141  -0.434   1.830
  186   HG13  VAL  26          3HG1      VAL  26  10.527  -0.851   0.822
  187   HG21  VAL  26          3HG2      VAL  26   9.593  -3.052  -1.182
  188   HG22  VAL  26          1HG2      VAL  26   8.546  -1.887  -1.993
  189   HG23  VAL  26          2HG2      VAL  26  10.133  -1.388  -1.408
  190    H    SER  27           H        SER  27   8.935  -1.974   3.364
  191    HA   SER  27           HA       SER  27  11.743  -2.074   3.478
  192    HB2  SER  27           1HB      SER  27   9.550  -1.453   5.308
  193    HB3  SER  27           2HB      SER  27  10.926  -2.203   6.118
  194    HG   SER  27           HG       SER  27  11.006   0.090   4.444
  195    H    LYS  28           H        LYS  28   9.330  -4.482   3.981
  196    HA   LYS  28           HA       LYS  28  10.911  -6.250   5.576
  197    HB2  LYS  28           1HB      LYS  28   8.375  -6.589   3.985
  198    HB3  LYS  28           2HB      LYS  28   9.146  -7.944   4.800
  199    HG2  LYS  28           1HG      LYS  28   8.242  -5.422   6.170
  200    HG3  LYS  28           2HG      LYS  28   7.311  -6.920   6.098
  201    HD2  LYS  28           1HD      LYS  28  10.057  -6.616   7.314
  202    HD3  LYS  28           2HD      LYS  28   8.541  -6.696   8.214
  203    HE2  LYS  28           1HE      LYS  28   8.365  -8.923   6.668
  204    HE3  LYS  28           2HE      LYS  28  10.104  -8.831   6.938
  205    HZ1  LYS  28           3HZ      LYS  28   8.096  -8.718   9.118
  206    HZ2  LYS  28           1HZ      LYS  28   9.773  -8.870   9.277
  207    HZ3  LYS  28           2HZ      LYS  28   8.867 -10.140   8.627
  208    H    LYS  29           H        LYS  29  11.154  -5.312   2.401
  209    HA   LYS  29           HA       LYS  29  12.339  -7.876   1.572
  210    HB2  LYS  29           1HB      LYS  29  11.653  -5.615  -0.290
  211    HB3  LYS  29           2HB      LYS  29  11.901  -7.313  -0.676
  212    HG2  LYS  29           1HG      LYS  29   9.559  -6.107   0.779
  213    HG3  LYS  29           2HG      LYS  29   9.568  -6.812  -0.839
  214    HD2  LYS  29           1HD      LYS  29  10.129  -8.293   1.731
  215    HD3  LYS  29           2HD      LYS  29   8.619  -8.351   0.818
  216    HE2  LYS  29           1HE      LYS  29  11.329  -9.259  -0.146
  217    HE3  LYS  29           2HE      LYS  29   9.991 -10.300   0.337
  218    HZ1  LYS  29           3HZ      LYS  29   8.725  -9.015  -1.494
  219    HZ2  LYS  29           1HZ      LYS  29   9.787 -10.254  -1.939
  220    HZ3  LYS  29           2HZ      LYS  29  10.268  -8.638  -2.074
  221    H    ARG  30           H        ARG  30  12.981  -4.568   2.269
  222    HA   ARG  30           HA       ARG  30  15.773  -4.928   2.281
  223    HB2  ARG  30           1HB      ARG  30  16.341  -3.358   0.416
  224    HB3  ARG  30           2HB      ARG  30  15.677  -4.898  -0.112
  225    HG2  ARG  30           1HG      ARG  30  13.451  -3.286   0.131
  226    HG3  ARG  30           2HG      ARG  30  14.685  -2.206  -0.521
  227    HD2  ARG  30           1HD      ARG  30  13.677  -4.795  -1.671
  228    HD3  ARG  30           2HD      ARG  30  13.606  -3.184  -2.384
  229    HE   ARG  30           HE       ARG  30  15.834  -5.008  -2.423
  230   HH11  ARG  30          1HH1      ARG  30  14.825  -1.688  -2.705
  231   HH12  ARG  30          2HH1      ARG  30  16.212  -1.209  -3.627
  232   HH21  ARG  30          1HH2      ARG  30  17.664  -4.390  -3.637
  233   HH22  ARG  30          2HH2      ARG  30  17.825  -2.747  -4.158
  234    H    ALA  31           H        ALA  31  16.787  -2.472   2.059
  235    HA   ALA  31           HA       ALA  31  15.154  -0.857   3.906
  236    HB1  ALA  31           3HB      ALA  31  17.777   0.010   4.175
  237    HB2  ALA  31           1HB      ALA  31  16.885  -1.022   5.293
  238    HB3  ALA  31           2HB      ALA  31  17.903  -1.744   4.048
  239    H    ILE  32           H        ILE  32  14.153   0.480   2.445
  240    HA   ILE  32           HA       ILE  32  15.923   2.348   1.024
  241    HB   ILE  32           HB       ILE  32  14.138   2.456  -0.782
  242   HG12  ILE  32          1HG1      ILE  32  13.367  -0.328  -0.261
  243   HG13  ILE  32          2HG1      ILE  32  12.739   0.815   0.921
  244   HG21  ILE  32          1HG2      ILE  32  16.174   0.394  -0.331
  245   HG22  ILE  32          2HG2      ILE  32  14.984  -0.001  -1.569
  246   HG23  ILE  32          3HG2      ILE  32  15.936   1.477  -1.702
  247   HD11  ILE  32          3HD1      ILE  32  11.289   0.289  -1.095
  248   HD12  ILE  32          1HD1      ILE  32  11.529   1.990  -0.695
  249   HD13  ILE  32          2HD1      ILE  32  12.431   1.259  -2.024
  250    H    LYS  33           H        LYS  33  15.654   4.113   2.272
  251    HA   LYS  33           HA       LYS  33  13.032   4.854   3.262
  252    HB2  LYS  33           1HB      LYS  33  14.279   6.786   4.271
  253    HB3  LYS  33           2HB      LYS  33  14.847   5.201   4.779
  254    HG2  LYS  33           1HG      LYS  33  16.341   5.924   2.497
  255    HG3  LYS  33           2HG      LYS  33  16.305   7.325   3.571
  256    HD2  LYS  33           1HD      LYS  33  16.786   5.367   5.359
  257    HD3  LYS  33           2HD      LYS  33  17.569   4.682   3.934
  258    HE2  LYS  33           1HE      LYS  33  19.286   5.902   4.875
  259    HE3  LYS  33           2HE      LYS  33  18.625   7.050   3.712
  260    HZ1  LYS  33           3HZ      LYS  33  18.999   7.498   6.374
  261    HZ2  LYS  33           1HZ      LYS  33  17.335   7.214   6.259
  262    HZ3  LYS  33           2HZ      LYS  33  18.049   8.436   5.333
  263    H    ASN  34           H        ASN  34  11.706   5.649   1.736
  264    HA   ASN  34           HA       ASN  34  12.711   7.888   0.105
  265    HB2  ASN  34           1HB      ASN  34  10.736   5.740  -0.695
  266    HB3  ASN  34           2HB      ASN  34  11.084   7.177  -1.652
  267   HD21  ASN  34          2HD2      ASN  34  13.586   7.495  -1.883
  268   HD22  ASN  34          1HD2      ASN  34  14.431   6.090  -2.429
  269    H    GLU  35           H        GLU  35  11.917   9.612   1.179
  270    HA   GLU  35           HA       GLU  35   9.342   9.619   2.427
  271    HB2  GLU  35           1HB      GLU  35  11.646  11.381   2.273
  272    HB3  GLU  35           2HB      GLU  35  10.138  12.274   2.139
  273    HG2  GLU  35           1HG      GLU  35  10.635  10.282   4.327
  274    HG3  GLU  35           2HG      GLU  35  11.096  11.979   4.461
  275    H    GLN  36           H        GLN  36  10.690  10.996  -0.542
  276    HA   GLN  36           HA       GLN  36   8.285  12.319  -1.311
  277    HB2  GLN  36           1HB      GLN  36  10.829  12.589  -2.092
  278    HB3  GLN  36           2HB      GLN  36  10.271  11.521  -3.373
  279    HG2  GLN  36           1HG      GLN  36   8.331  13.547  -3.075
  280    HG3  GLN  36           2HG      GLN  36   9.910  14.329  -3.092
  281   HE21  GLN  36          2HE2      GLN  36   7.675  12.336  -4.872
  282   HE22  GLN  36          1HE2      GLN  36   8.410  12.547  -6.421
  283    H    LEU  37           H        LEU  37   9.857   9.305  -2.356
  284    HA   LEU  37           HA       LEU  37   7.918   8.556  -4.242
  285    HB2  LEU  37           1HB      LEU  37  10.281   7.609  -3.777
  286    HB3  LEU  37           2HB      LEU  37   9.457   6.560  -2.624
  287    HG   LEU  37           HG       LEU  37   7.969   5.931  -4.666
  288   HD11  LEU  37          1HD1      LEU  37   8.589   7.364  -6.358
  289   HD12  LEU  37          2HD1      LEU  37   9.558   5.938  -6.727
  290   HD13  LEU  37          3HD1      LEU  37  10.296   7.320  -5.919
  291   HD21  LEU  37          3HD2      LEU  37   9.106   3.999  -4.663
  292   HD22  LEU  37          1HD2      LEU  37  10.091   4.762  -3.414
  293   HD23  LEU  37          2HD2      LEU  37  10.628   4.780  -5.094
  294    H    LEU  38           H        LEU  38   8.157   7.992  -0.773
  295    HA   LEU  38           HA       LEU  38   6.067   6.126  -0.539
  296    HB2  LEU  38           1HB      LEU  38   7.621   6.436   1.255
  297    HB3  LEU  38           2HB      LEU  38   7.174   8.132   1.413
  298    HG   LEU  38           HG       LEU  38   6.310   6.410   3.146
  299   HD11  LEU  38          1HD1      LEU  38   5.003   8.100   3.752
  300   HD12  LEU  38          2HD1      LEU  38   3.950   7.862   2.358
  301   HD13  LEU  38          3HD1      LEU  38   5.389   8.870   2.212
  302   HD21  LEU  38          3HD2      LEU  38   5.376   5.090   1.010
  303   HD22  LEU  38          1HD2      LEU  38   3.967   6.088   1.373
  304   HD23  LEU  38          2HD2      LEU  38   4.621   5.005   2.602
  305    H    GLN  39           H        GLN  39   6.081   9.664  -0.201
  306    HA   GLN  39           HA       GLN  39   3.353   9.947   0.407
  307    HB2  GLN  39           1HB      GLN  39   5.470  11.645   0.292
  308    HB3  GLN  39           2HB      GLN  39   4.598  12.116  -1.160
  309    HG2  GLN  39           1HG      GLN  39   3.357  11.962   1.575
  310    HG3  GLN  39           2HG      GLN  39   4.022  13.433   0.867
  311   HE21  GLN  39          2HE2      GLN  39   2.826  14.574  -0.545
  312   HE22  GLN  39          1HE2      GLN  39   1.241  14.132  -1.067
  313    H    LEU  40           H        LEU  40   5.056  10.297  -2.703
  314    HA   LEU  40           HA       LEU  40   2.772  10.783  -4.259
  315    HB2  LEU  40           1HB      LEU  40   5.437  10.777  -4.721
  316    HB3  LEU  40           2HB      LEU  40   4.965   9.288  -5.535
  317    HG   LEU  40           HG       LEU  40   3.986  12.076  -6.130
  318   HD11  LEU  40          1HD1      LEU  40   4.930  11.141  -8.442
  319   HD12  LEU  40          2HD1      LEU  40   5.956  10.229  -7.336
  320   HD13  LEU  40          3HD1      LEU  40   5.940  11.991  -7.271
  321   HD21  LEU  40          3HD2      LEU  40   3.001   9.392  -7.006
  322   HD22  LEU  40          1HD2      LEU  40   2.887  10.779  -8.090
  323   HD23  LEU  40          2HD2      LEU  40   2.084  10.819  -6.520
  324    H    ILE  41           H        ILE  41   4.569   7.752  -3.728
  325    HA   ILE  41           HA       ILE  41   2.868   6.103  -5.231
  326    HB   ILE  41           HB       ILE  41   4.688   5.467  -2.913
  327   HG12  ILE  41          1HG1      ILE  41   5.734   6.248  -5.028
  328   HG13  ILE  41          2HG1      ILE  41   6.164   4.589  -4.628
  329   HG21  ILE  41          1HG2      ILE  41   3.052   3.618  -4.633
  330   HG22  ILE  41          2HG2      ILE  41   4.453   3.086  -3.703
  331   HG23  ILE  41          3HG2      ILE  41   3.047   3.756  -2.875
  332   HD11  ILE  41          3HD1      ILE  41   5.189   5.521  -7.042
  333   HD12  ILE  41          1HD1      ILE  41   5.333   3.837  -6.538
  334   HD13  ILE  41          2HD1      ILE  41   3.814   4.701  -6.301
  335    H    PHE  42           H        PHE  42   2.685   7.251  -1.930
  336    HA   PHE  42           HA       PHE  42   0.783   5.460  -0.926
  337    HB2  PHE  42           1HB      PHE  42   1.936   6.892   0.602
  338    HB3  PHE  42           2HB      PHE  42   1.376   8.338  -0.233
  339    HD1  PHE  42           HD1      PHE  42  -0.465   5.314   0.923
  340    HD2  PHE  42           HD2      PHE  42   0.078   9.523   1.256
  341    HE1  PHE  42           HE1      PHE  42  -2.395   5.439   2.445
  342    HE2  PHE  42           HE2      PHE  42  -1.851   9.655   2.779
  343    HZ   PHE  42           HZ       PHE  42  -3.089   7.611   3.376
  344    H    LYS  43           H        LYS  43   0.321   8.659  -2.416
  345    HA   LYS  43           HA       LYS  43  -2.527   8.485  -2.377
  346    HB2  LYS  43           1HB      LYS  43  -0.708  10.511  -2.751
  347    HB3  LYS  43           2HB      LYS  43  -1.351  10.286  -4.372
  348    HG2  LYS  43           1HG      LYS  43  -3.631  10.555  -3.472
  349    HG3  LYS  43           2HG      LYS  43  -2.937  10.871  -1.880
  350    HD2  LYS  43           1HD      LYS  43  -1.612  12.570  -3.701
  351    HD3  LYS  43           2HD      LYS  43  -3.335  12.674  -4.068
  352    HE2  LYS  43           1HE      LYS  43  -2.042  13.097  -1.376
  353    HE3  LYS  43           2HE      LYS  43  -2.715  14.347  -2.420
  354    HZ1  LYS  43           3HZ      LYS  43  -4.883  13.113  -2.209
  355    HZ2  LYS  43           1HZ      LYS  43  -4.341  13.891  -0.807
  356    HZ3  LYS  43           2HZ      LYS  43  -4.168  12.216  -0.966
  357    H    SER  44           H        SER  44  -0.030   7.592  -4.644
  358    HA   SER  44           HA       SER  44  -1.703   7.309  -6.922
  359    HB2  SER  44           1HB      SER  44   1.048   6.345  -6.196
  360    HB3  SER  44           2HB      SER  44   0.259   5.752  -7.659
  361    HG   SER  44           HG       SER  44   1.126   7.519  -8.448
  362    H    ILE  45           H        ILE  45  -0.421   4.972  -4.568
  363    HA   ILE  45           HA       ILE  45  -1.697   2.712  -5.686
  364    HB   ILE  45           HB       ILE  45  -0.667   3.215  -2.896
  365   HG12  ILE  45          1HG1      ILE  45   0.441   1.646  -5.234
  366   HG13  ILE  45          2HG1      ILE  45   1.048   3.189  -4.641
  367   HG21  ILE  45          1HG2      ILE  45  -1.699   0.663  -4.123
  368   HG22  ILE  45          2HG2      ILE  45  -0.801   0.756  -2.608
  369   HG23  ILE  45          3HG2      ILE  45  -2.380   1.532  -2.747
  370   HD11  ILE  45          3HD1      ILE  45   2.486   1.462  -3.860
  371   HD12  ILE  45          1HD1      ILE  45   1.571   2.072  -2.482
  372   HD13  ILE  45          2HD1      ILE  45   1.124   0.538  -3.229
  373    H    ASP  46           H        ASP  46  -2.689   5.084  -3.293
  374    HA   ASP  46           HA       ASP  46  -5.106   3.645  -2.626
  375    HB2  ASP  46           1HB      ASP  46  -3.649   5.321  -1.166
  376    HB3  ASP  46           2HB      ASP  46  -4.729   6.511  -1.889
  377    H    ALA  47           H        ALA  47  -6.897   3.709  -3.794
  378    HA   ALA  47           HA       ALA  47  -7.209   5.358  -6.066
  379    HB1  ALA  47           3HB      ALA  47  -8.258   3.109  -5.720
  380    HB2  ALA  47           1HB      ALA  47  -9.404   3.883  -4.626
  381    HB3  ALA  47           2HB      ALA  47  -9.352   4.352  -6.326
  382    H    ASP  48           H        ASP  48  -8.501   5.541  -2.782
  383    HA   ASP  48           HA       ASP  48  -9.694   8.149  -3.444
  384    HB2  ASP  48           1HB      ASP  48 -11.057   7.843  -1.396
  385    HB3  ASP  48           2HB      ASP  48 -11.313   6.559  -2.574
  386    H    GLY  49           H        GLY  49  -7.152   6.639  -1.774
  387    HA2  GLY  49           1HA      GLY  49  -5.501   7.443  -0.397
  388    HA3  GLY  49           2HA      GLY  49  -5.938   9.037  -0.993
  389    H    ASN  50           H        ASN  50  -8.125   6.916   0.752
  390    HA   ASN  50           HA       ASN  50  -8.534   8.983   2.738
  391    HB2  ASN  50           1HB      ASN  50 -10.347   7.528   3.554
  392    HB3  ASN  50           2HB      ASN  50 -10.475   7.812   1.821
  393   HD21  ASN  50          2HD2      ASN  50 -11.703   5.693   3.186
  394   HD22  ASN  50          1HD2      ASN  50 -11.019   4.214   2.614
  395    H    GLY  51           H        GLY  51  -6.386   8.848   3.677
  396    HA2  GLY  51           1HA      GLY  51  -5.044   8.276   5.455
  397    HA3  GLY  51           2HA      GLY  51  -6.356   7.258   6.031
  398    H    GLU  52           H        GLU  52  -6.599   5.454   3.957
  399    HA   GLU  52           HA       GLU  52  -3.993   4.313   3.413
  400    HB2  GLU  52           1HB      GLU  52  -4.791   2.082   4.422
  401    HB3  GLU  52           2HB      GLU  52  -4.193   3.319   5.519
  402    HG2  GLU  52           1HG      GLU  52  -6.262   2.128   6.262
  403    HG3  GLU  52           2HG      GLU  52  -6.377   3.886   6.219
  404    H    ILE  53           H        ILE  53  -4.195   2.275   2.118
  405    HA   ILE  53           HA       ILE  53  -6.369   2.602   0.200
  406    HB   ILE  53           HB       ILE  53  -4.094   0.663  -0.095
  407   HG12  ILE  53          1HG1      ILE  53  -3.401   2.942  -1.536
  408   HG13  ILE  53          2HG1      ILE  53  -3.951   3.569   0.014
  409   HG21  ILE  53          1HG2      ILE  53  -6.035   2.026  -1.917
  410   HG22  ILE  53          2HG2      ILE  53  -4.495   1.433  -2.537
  411   HG23  ILE  53          3HG2      ILE  53  -5.634   0.314  -1.789
  412   HD11  ILE  53          3HD1      ILE  53  -2.273   1.359   0.541
  413   HD12  ILE  53          1HD1      ILE  53  -1.463   2.380  -0.647
  414   HD13  ILE  53          2HD1      ILE  53  -1.991   3.064   0.891
  415    H    ASP  54           H        ASP  54  -8.090   1.327   0.192
  416    HA   ASP  54           HA       ASP  54  -8.290  -0.904   1.984
  417    HB2  ASP  54           1HB      ASP  54 -10.289  -0.227  -0.164
  418    HB3  ASP  54           2HB      ASP  54 -10.573  -0.988   1.399
  419    H    GLN  55           H        GLN  55  -8.977  -3.063   1.310
  420    HA   GLN  55           HA       GLN  55  -7.214  -4.267  -0.454
  421    HB2  GLN  55           1HB      GLN  55  -8.777  -6.228  -0.368
  422    HB3  GLN  55           2HB      GLN  55  -8.308  -5.593   1.205
  423    HG2  GLN  55           1HG      GLN  55 -10.461  -4.317   1.231
  424    HG3  GLN  55           2HG      GLN  55 -10.924  -5.204  -0.220
  425   HE21  GLN  55          2HE2      GLN  55 -10.261  -5.429   3.190
  426   HE22  GLN  55          1HE2      GLN  55 -10.997  -6.973   3.435
  427    H    ASN  56           H        ASN  56 -10.597  -3.329  -0.999
  428    HA   ASN  56           HA       ASN  56 -10.846  -4.296  -3.606
  429    HB2  ASN  56           1HB      ASN  56 -12.472  -2.930  -1.831
  430    HB3  ASN  56           2HB      ASN  56 -12.272  -1.784  -3.154
  431   HD21  ASN  56          2HD2      ASN  56 -12.588  -5.314  -2.954
  432   HD22  ASN  56          1HD2      ASN  56 -13.898  -5.429  -4.076
  433    H    GLU  57           H        GLU  57  -9.907  -1.052  -2.479
  434    HA   GLU  57           HA       GLU  57  -9.540   0.124  -4.979
  435    HB2  GLU  57           1HB      GLU  57  -7.965   0.703  -2.465
  436    HB3  GLU  57           2HB      GLU  57  -8.176   1.781  -3.838
  437    HG2  GLU  57           1HG      GLU  57 -10.443   2.143  -3.345
  438    HG3  GLU  57           2HG      GLU  57 -10.499   0.780  -2.228
  439    H    PHE  58           H        PHE  58  -7.337  -1.801  -3.009
  440    HA   PHE  58           HA       PHE  58  -5.026  -1.403  -4.579
  441    HB2  PHE  58           1HB      PHE  58  -5.178  -2.368  -2.217
  442    HB3  PHE  58           2HB      PHE  58  -5.612  -3.893  -2.983
  443    HD1  PHE  58           HD2      PHE  58  -2.945  -1.424  -2.496
  444    HD2  PHE  58           HD1      PHE  58  -3.985  -5.206  -4.149
  445    HE1  PHE  58           HE2      PHE  58  -0.560  -1.941  -2.804
  446    HE2  PHE  58           HE1      PHE  58  -1.600  -5.730  -4.458
  447    HZ   PHE  58           HZ       PHE  58   0.115  -4.097  -3.786
  448    H    ALA  59           H        ALA  59  -7.532  -3.907  -4.629
  449    HA   ALA  59           HA       ALA  59  -6.397  -5.551  -6.591
  450    HB1  ALA  59           3HB      ALA  59  -8.983  -6.020  -7.012
  451    HB2  ALA  59           1HB      ALA  59  -8.129  -6.624  -5.591
  452    HB3  ALA  59           2HB      ALA  59  -9.113  -5.164  -5.475
  453    H    LYS  60           H        LYS  60  -8.832  -2.971  -6.937
  454    HA   LYS  60           HA       LYS  60  -8.943  -3.109  -9.762
  455    HB2  LYS  60           1HB      LYS  60  -9.995  -1.349  -7.651
  456    HB3  LYS  60           2HB      LYS  60  -9.734  -0.556  -9.199
  457    HG2  LYS  60           1HG      LYS  60 -12.015  -1.404  -8.969
  458    HG3  LYS  60           2HG      LYS  60 -11.157  -2.175 -10.304
  459    HD2  LYS  60           1HD      LYS  60 -11.253  -4.206  -9.346
  460    HD3  LYS  60           2HD      LYS  60 -10.898  -3.570  -7.738
  461    HE2  LYS  60           1HE      LYS  60 -13.573  -3.389  -9.122
  462    HE3  LYS  60           2HE      LYS  60 -13.144  -4.594  -7.909
  463    HZ1  LYS  60           3HZ      LYS  60 -12.526  -2.109  -6.837
  464    HZ2  LYS  60           1HZ      LYS  60 -13.768  -3.157  -6.366
  465    HZ3  LYS  60           2HZ      LYS  60 -14.065  -1.961  -7.523
  466    H    PHE  61           H        PHE  61  -6.773  -1.576  -7.554
  467    HA   PHE  61           HA       PHE  61  -5.720   0.303  -9.465
  468    HB2  PHE  61           1HB      PHE  61  -5.461   1.111  -7.313
  469    HB3  PHE  61           2HB      PHE  61  -5.067  -0.473  -6.654
  470    HD1  PHE  61           HD1      PHE  61  -3.637   1.767  -9.279
  471    HD2  PHE  61           HD2      PHE  61  -2.945  -0.615  -5.820
  472    HE1  PHE  61           HE1      PHE  61  -1.244   2.328  -9.377
  473    HE2  PHE  61           HE2      PHE  61  -0.550  -0.056  -5.911
  474    HZ   PHE  61           HZ       PHE  61   0.303   1.417  -7.690
  475    H    TYR  62           H        TYR  62  -4.919  -2.900  -8.300
  476    HA   TYR  62           HA       TYR  62  -2.304  -3.080  -9.308
  477    HB2  TYR  62           1HB      TYR  62  -4.057  -4.759  -7.932
  478    HB3  TYR  62           2HB      TYR  62  -3.733  -5.603  -9.442
  479    HD1  TYR  62           HD2      TYR  62  -1.695  -3.574  -7.044
  480    HD2  TYR  62           HD1      TYR  62  -2.091  -7.199  -9.235
  481    HE1  TYR  62           HE2      TYR  62   0.458  -4.348  -6.142
  482    HE2  TYR  62           HE1      TYR  62   0.060  -7.984  -8.339
  483    HH   TYR  62           HH       TYR  62   1.645  -7.605  -6.762
  484    H    GLY  63           H        GLY  63  -1.631  -2.973 -11.338
  485    HA2  GLY  63           1HA      GLY  63  -1.486  -3.536 -13.587
  486    HA3  GLY  63           2HA      GLY  63  -2.978  -4.449 -13.425
  487    H    SER  64           H        SER  64  -3.486  -1.448 -12.123
  488    HA   SER  64           HA       SER  64  -5.139  -0.651 -14.330
  489    HB2  SER  64           1HB      SER  64  -5.935  -0.237 -12.084
  490    HB3  SER  64           2HB      SER  64  -4.495   0.707 -11.703
  491    HG   SER  64           HG       SER  64  -5.252   2.358 -12.836
  492    H    ILE  65           H        ILE  65  -2.871  -0.713 -15.556
  493    HA   ILE  65           HA       ILE  65  -1.531   1.874 -15.414
  494    HB   ILE  65           HB       ILE  65  -0.871  -0.303 -17.377
  495   HG12  ILE  65          1HG1      ILE  65   0.063  -0.087 -14.507
  496   HG13  ILE  65          2HG1      ILE  65  -0.944  -1.364 -15.177
  497   HG21  ILE  65          1HG2      ILE  65   0.851   1.000 -17.896
  498   HG22  ILE  65          2HG2      ILE  65   0.149   2.247 -16.868
  499   HG23  ILE  65          3HG2      ILE  65   1.335   1.122 -16.205
  500   HD11  ILE  65          3HD1      ILE  65   0.909  -2.505 -15.561
  501   HD12  ILE  65          1HD1      ILE  65   1.330  -1.308 -16.785
  502   HD13  ILE  65          2HD1      ILE  65   1.914  -1.122 -15.130
  503    H    GLN  66           H        GLN  66  -4.331   1.239 -16.550
  504    HA   GLN  66           HA       GLN  66  -4.386   1.591 -19.300
  505    HB2  GLN  66           1HB      GLN  66  -6.658   2.209 -19.066
  506    HB3  GLN  66           2HB      GLN  66  -6.332   1.092 -17.747
  507    HG2  GLN  66           1HG      GLN  66  -7.380   2.650 -16.523
  508    HG3  GLN  66           2HG      GLN  66  -5.795   3.422 -16.525
  509   HE21  GLN  66          2HE2      GLN  66  -5.816   5.485 -17.014
  510   HE22  GLN  66          1HE2      GLN  66  -6.972   6.289 -18.015
  Start of MODEL    5
    1    H1   MET   1           H        MET   1  -3.551 -13.980  -7.430
    2    HA   MET   1           HA       MET   1  -1.280 -13.900  -6.059
    3    HB2  MET   1           1HB      MET   1   0.553 -14.196  -7.805
    4    HB3  MET   1           2HB      MET   1  -0.197 -15.663  -7.192
    5    HG2  MET   1           1HG      MET   1  -1.632 -15.726  -9.198
    6    HG3  MET   1           2HG      MET   1  -0.776 -14.316  -9.818
    7    HE1  MET   1           3HE      MET   1   1.004 -14.145 -10.876
    8    HE2  MET   1           1HE      MET   1   2.485 -15.076 -10.656
    9    HE3  MET   1           2HE      MET   1   1.395 -15.455 -11.990
   10    H    ALA   2           H        ALA   2  -3.201 -12.121  -6.840
   11    HA   ALA   2           HA       ALA   2  -1.631 -10.113  -8.318
   12    HB1  ALA   2           3HB      ALA   2  -4.599 -10.607  -8.485
   13    HB2  ALA   2           1HB      ALA   2  -3.779  -9.204  -9.173
   14    HB3  ALA   2           2HB      ALA   2  -3.407 -10.824  -9.767
   15    H    GLU   3           H        GLU   3  -4.736  -9.997  -6.591
   16    HA   GLU   3           HA       GLU   3  -3.771  -7.682  -5.102
   17    HB2  GLU   3           1HB      GLU   3  -6.043  -7.224  -4.580
   18    HB3  GLU   3           2HB      GLU   3  -6.010  -7.705  -6.270
   19    HG2  GLU   3           1HG      GLU   3  -7.704  -9.039  -5.703
   20    HG3  GLU   3           2HG      GLU   3  -6.445 -10.090  -5.057
   21    H    ALA   4           H        ALA   4  -4.396 -11.032  -4.668
   22    HA   ALA   4           HA       ALA   4  -5.004 -11.198  -1.964
   23    HB1  ALA   4           3HB      ALA   4  -3.151 -13.196  -3.169
   24    HB2  ALA   4           1HB      ALA   4  -4.548 -13.441  -2.120
   25    HB3  ALA   4           2HB      ALA   4  -4.781 -13.034  -3.820
   26    H    LEU   5           H        LEU   5  -2.054 -10.304  -3.508
   27    HA   LEU   5           HA       LEU   5  -0.240 -10.938  -1.438
   28    HB2  LEU   5           1HB      LEU   5   0.154  -8.585  -3.233
   29    HB3  LEU   5           2HB      LEU   5   1.341  -9.738  -2.627
   30    HG   LEU   5           HG       LEU   5  -0.661 -10.168  -4.840
   31   HD11  LEU   5          1HD1      LEU   5   2.282  -9.723  -4.692
   32   HD12  LEU   5          2HD1      LEU   5   1.095  -9.060  -5.816
   33   HD13  LEU   5          3HD1      LEU   5   1.623 -10.734  -5.978
   34   HD21  LEU   5          3HD2      LEU   5   1.025 -12.337  -4.819
   35   HD22  LEU   5          1HD2      LEU   5  -0.639 -12.316  -4.232
   36   HD23  LEU   5          2HD2      LEU   5   0.696 -12.076  -3.105
   37    H    PHE   6           H        PHE   6  -2.285  -8.149  -2.065
   38    HA   PHE   6           HA       PHE   6  -1.148  -6.428  -0.134
   39    HB2  PHE   6           1HB      PHE   6  -2.484  -5.311  -1.671
   40    HB3  PHE   6           2HB      PHE   6  -3.758  -6.524  -1.598
   41    HD1  PHE   6           HD2      PHE   6  -5.294  -6.578   0.348
   42    HD2  PHE   6           HD1      PHE   6  -2.476  -3.440  -0.230
   43    HE1  PHE   6           HE2      PHE   6  -6.541  -5.171   1.934
   44    HE2  PHE   6           HE1      PHE   6  -3.718  -2.028   1.358
   45    HZ   PHE   6           HZ       PHE   6  -5.755  -2.893   2.441
   46    H    LYS   7           H        LYS   7  -3.949  -8.609  -0.010
   47    HA   LYS   7           HA       LYS   7  -4.491  -8.054   2.747
   48    HB2  LYS   7           1HB      LYS   7  -6.447  -8.894   2.064
   49    HB3  LYS   7           2HB      LYS   7  -5.719  -9.540   0.600
   50    HG2  LYS   7           1HG      LYS   7  -5.021 -11.536   1.838
   51    HG3  LYS   7           2HG      LYS   7  -5.782 -10.889   3.293
   52    HD2  LYS   7           1HD      LYS   7  -7.390 -11.160   0.790
   53    HD3  LYS   7           2HD      LYS   7  -7.062 -12.592   1.769
   54    HE2  LYS   7           1HE      LYS   7  -8.400 -11.905   3.460
   55    HE3  LYS   7           2HE      LYS   7  -7.998 -10.204   3.229
   56    HZ1  LYS   7           3HZ      LYS   7  -9.706  -9.902   1.821
   57    HZ2  LYS   7           1HZ      LYS   7 -10.350 -11.268   2.584
   58    HZ3  LYS   7           2HZ      LYS   7  -9.548 -11.426   1.104
   59    H    GLU   8           H        GLU   8  -2.511 -10.312   1.011
   60    HA   GLU   8           HA       GLU   8  -2.222 -12.247   3.063
   61    HB2  GLU   8           1HB      GLU   8  -1.671 -12.764   0.748
   62    HB3  GLU   8           2HB      GLU   8  -0.400 -11.550   0.754
   63    HG2  GLU   8           1HG      GLU   8   1.015 -13.140   1.343
   64    HG3  GLU   8           2HG      GLU   8   0.194 -13.217   2.901
   65    H    ILE   9           H        ILE   9  -0.214  -9.485   2.073
   66    HA   ILE   9           HA       ILE   9   1.736  -9.850   4.102
   67    HB   ILE   9           HB       ILE   9   1.044  -7.369   2.525
   68   HG12  ILE   9          1HG1      ILE   9   1.772  -9.347   1.188
   69   HG13  ILE   9          2HG1      ILE   9   2.880  -7.983   1.081
   70   HG21  ILE   9          1HG2      ILE   9   3.469  -7.999   4.202
   71   HG22  ILE   9          2HG2      ILE   9   3.286  -6.588   3.162
   72   HG23  ILE   9          3HG2      ILE   9   2.231  -6.794   4.560
   73   HD11  ILE   9          3HD1      ILE   9   3.592  -9.786   3.227
   74   HD12  ILE   9          1HD1      ILE   9   3.531 -10.599   1.663
   75   HD13  ILE   9          2HD1      ILE   9   4.562  -9.185   1.881
   76    H    ASP  10           H        ASP  10  -1.383  -8.378   4.040
   77    HA   ASP  10           HA       ASP  10  -0.998  -6.693   6.327
   78    HB2  ASP  10           1HB      ASP  10  -3.190  -7.359   4.492
   79    HB3  ASP  10           2HB      ASP  10  -3.713  -7.068   6.149
   80    H    VAL  11           H        VAL  11  -0.026  -8.326   7.726
   81    HA   VAL  11           HA       VAL  11  -1.377 -10.621   8.615
   82    HB   VAL  11           HB       VAL  11   0.560  -8.985  10.251
   83   HG11  VAL  11          1HG1      VAL  11  -0.571 -11.719  10.423
   84   HG12  VAL  11          2HG1      VAL  11   1.129 -11.515  10.851
   85   HG13  VAL  11          3HG1      VAL  11  -0.112 -10.597  11.705
   86   HG21  VAL  11          3HG2      VAL  11   2.219 -10.696   9.224
   87   HG22  VAL  11          1HG2      VAL  11   1.012 -10.835   7.945
   88   HG23  VAL  11          2HG2      VAL  11   1.758  -9.274   8.288
   89    H    ASN  12           H        ASN  12  -1.966  -7.324   9.222
   90    HA   ASN  12           HA       ASN  12  -3.229  -7.701  11.792
   91    HB2  ASN  12           1HB      ASN  12  -3.981  -5.280  11.348
   92    HB3  ASN  12           2HB      ASN  12  -2.255  -5.574  11.541
   93   HD21  ASN  12          2HD2      ASN  12  -1.739  -3.708  10.401
   94   HD22  ASN  12          1HD2      ASN  12  -1.908  -3.607   8.685
   95    H    GLY  13           H        GLY  13  -4.104  -8.486   8.723
   96    HA2  GLY  13           1HA      GLY  13  -6.109  -8.823   7.634
   97    HA3  GLY  13           2HA      GLY  13  -6.655  -9.309   9.232
   98    H    ASP  14           H        ASP  14  -5.669  -6.076   8.198
   99    HA   ASP  14           HA       ASP  14  -8.259  -5.064   9.088
  100    HB2  ASP  14           1HB      ASP  14  -7.148  -2.819   8.815
  101    HB3  ASP  14           2HB      ASP  14  -6.388  -3.882   9.997
  102    H    GLY  15           H        GLY  15  -6.597  -5.823   6.208
  103    HA2  GLY  15           1HA      GLY  15  -7.255  -5.688   4.008
  104    HA3  GLY  15           2HA      GLY  15  -8.825  -5.147   4.581
  105    H    ALA  16           H        ALA  16  -6.367  -3.220   5.817
  106    HA   ALA  16           HA       ALA  16  -6.513  -1.328   3.574
  107    HB1  ALA  16           3HB      ALA  16  -6.683   0.477   5.438
  108    HB2  ALA  16           1HB      ALA  16  -8.136  -0.371   4.907
  109    HB3  ALA  16           2HB      ALA  16  -7.335  -0.844   6.406
  110    H    VAL  17           H        VAL  17  -4.666  -0.218   3.176
  111    HA   VAL  17           HA       VAL  17  -2.450  -0.539   5.093
  112    HB   VAL  17           HB       VAL  17  -2.373  -0.790   2.089
  113   HG11  VAL  17          1HG1      VAL  17  -0.284  -0.043   2.031
  114   HG12  VAL  17          2HG1      VAL  17  -0.421   0.414   3.730
  115   HG13  VAL  17          3HG1      VAL  17   0.189  -1.182   3.290
  116   HG21  VAL  17          3HG2      VAL  17  -1.461  -2.967   2.507
  117   HG22  VAL  17          1HG2      VAL  17  -1.352  -2.642   4.237
  118   HG23  VAL  17          2HG2      VAL  17  -2.931  -2.796   3.465
  119    H    SER  18           H        SER  18  -1.950   1.383   5.900
  120    HA   SER  18           HA       SER  18  -2.520   3.813   4.430
  121    HB2  SER  18           1HB      SER  18  -1.143   4.504   6.761
  122    HB3  SER  18           2HB      SER  18  -2.892   4.506   6.532
  123    HG   SER  18           HG       SER  18  -1.593   3.064   8.230
  124    H    TYR  19           H        TYR  19  -0.726   5.592   4.730
  125    HA   TYR  19           HA       TYR  19   1.319   5.091   2.975
  126    HB2  TYR  19           1HB      TYR  19   2.433   7.099   3.912
  127    HB3  TYR  19           2HB      TYR  19   0.715   7.350   3.622
  128    HD1  TYR  19           HD1      TYR  19  -0.868   7.344   5.559
  129    HD2  TYR  19           HD2      TYR  19   3.353   7.305   6.090
  130    HE1  TYR  19           HE1      TYR  19  -1.160   8.075   7.889
  131    HE2  TYR  19           HE2      TYR  19   3.073   8.034   8.421
  132    HH   TYR  19           HH       TYR  19   0.056   8.022  10.001
  133    H    GLU  20           H        GLU  20   1.460   4.917   6.521
  134    HA   GLU  20           HA       GLU  20   4.174   4.239   6.728
  135    HB2  GLU  20           1HB      GLU  20   1.831   4.242   8.483
  136    HB3  GLU  20           2HB      GLU  20   2.993   2.983   8.879
  137    HG2  GLU  20           1HG      GLU  20   4.219   5.581   8.386
  138    HG3  GLU  20           2HG      GLU  20   3.087   5.577   9.737
  139    H    GLU  21           H        GLU  21   1.281   2.183   6.565
  140    HA   GLU  21           HA       GLU  21   2.545  -0.289   6.839
  141    HB2  GLU  21           1HB      GLU  21  -0.026   0.630   5.639
  142    HB3  GLU  21           2HB      GLU  21   0.504  -1.014   5.312
  143    HG2  GLU  21           1HG      GLU  21   0.841  -0.791   8.027
  144    HG3  GLU  21           2HG      GLU  21  -0.624   0.141   7.728
  145    H    VAL  22           H        VAL  22   1.982   1.698   3.978
  146    HA   VAL  22           HA       VAL  22   2.796  -0.150   2.033
  147    HB   VAL  22           HB       VAL  22   2.887   2.864   2.047
  148   HG11  VAL  22          1HG1      VAL  22   3.932   0.930   0.083
  149   HG12  VAL  22          2HG1      VAL  22   2.944   2.238  -0.572
  150   HG13  VAL  22          3HG1      VAL  22   4.384   2.609   0.377
  151   HG21  VAL  22          3HG2      VAL  22   1.064   0.975   0.566
  152   HG22  VAL  22          1HG2      VAL  22   0.670   1.718   2.117
  153   HG23  VAL  22          2HG2      VAL  22   0.916   2.728   0.692
  154    H    LYS  23           H        LYS  23   4.664   2.461   3.586
  155    HA   LYS  23           HA       LYS  23   7.120   1.872   2.379
  156    HB2  LYS  23           1HB      LYS  23   6.167   3.526   4.586
  157    HB3  LYS  23           2HB      LYS  23   7.782   2.892   4.868
  158    HG2  LYS  23           1HG      LYS  23   6.957   4.379   2.384
  159    HG3  LYS  23           2HG      LYS  23   7.740   5.120   3.782
  160    HD2  LYS  23           1HD      LYS  23   8.891   2.872   2.129
  161    HD3  LYS  23           2HD      LYS  23   9.337   4.574   1.984
  162    HE2  LYS  23           1HE      LYS  23   9.713   2.794   4.390
  163    HE3  LYS  23           2HE      LYS  23  10.975   3.425   3.332
  164    HZ1  LYS  23           3HZ      LYS  23  10.273   5.686   4.035
  165    HZ2  LYS  23           1HZ      LYS  23  10.914   4.750   5.289
  166    HZ3  LYS  23           2HZ      LYS  23   9.242   4.977   5.174
  167    H    ALA  24           H        ALA  24   5.570   0.561   5.244
  168    HA   ALA  24           HA       ALA  24   7.843  -0.854   6.209
  169    HB1  ALA  24           3HB      ALA  24   5.656  -0.192   7.438
  170    HB2  ALA  24           1HB      ALA  24   5.038  -1.711   6.789
  171    HB3  ALA  24           2HB      ALA  24   6.452  -1.712   7.845
  172    H    PHE  25           H        PHE  25   5.056  -1.762   4.214
  173    HA   PHE  25           HA       PHE  25   5.463  -4.482   4.010
  174    HB2  PHE  25           1HB      PHE  25   4.284  -2.431   2.184
  175    HB3  PHE  25           2HB      PHE  25   4.540  -4.060   1.567
  176    HD1  PHE  25           HD2      PHE  25   3.734  -3.445   5.082
  177    HD2  PHE  25           HD1      PHE  25   2.190  -4.475   1.251
  178    HE1  PHE  25           HE2      PHE  25   1.629  -4.168   6.129
  179    HE2  PHE  25           HE1      PHE  25   0.081  -5.200   2.292
  180    HZ   PHE  25           HZ       PHE  25  -0.201  -5.047   4.734
  181    H    VAL  26           H        VAL  26   6.814  -1.945   1.909
  182    HA   VAL  26           HA       VAL  26   8.396  -3.741   0.373
  183    HB   VAL  26           HB       VAL  26   7.628  -1.232  -0.075
  184   HG11  VAL  26          1HG1      VAL  26   9.107  -0.426   1.798
  185   HG12  VAL  26          2HG1      VAL  26  10.488  -0.849   0.784
  186   HG13  VAL  26          3HG1      VAL  26   9.341   0.378   0.246
  187   HG21  VAL  26          3HG2      VAL  26  10.291  -2.119  -1.140
  188   HG22  VAL  26          1HG2      VAL  26   8.794  -2.944  -1.578
  189   HG23  VAL  26          2HG2      VAL  26   9.007  -1.237  -1.968
  190    H    SER  27           H        SER  27   8.903  -1.968   3.333
  191    HA   SER  27           HA       SER  27  11.712  -2.071   3.434
  192    HB2  SER  27           1HB      SER  27   9.528  -1.447   5.273
  193    HB3  SER  27           2HB      SER  27  10.901  -2.206   6.079
  194    HG   SER  27           HG       SER  27  11.247  -0.059   4.277
  195    H    LYS  28           H        LYS  28   9.300  -4.479   3.941
  196    HA   LYS  28           HA       LYS  28  10.880  -6.251   5.530
  197    HB2  LYS  28           1HB      LYS  28   8.343  -6.580   3.942
  198    HB3  LYS  28           2HB      LYS  28   9.116  -7.944   4.738
  199    HG2  LYS  28           1HG      LYS  28   8.212  -5.436   6.137
  200    HG3  LYS  28           2HG      LYS  28   7.288  -6.938   6.055
  201    HD2  LYS  28           1HD      LYS  28  10.034  -6.623   7.269
  202    HD3  LYS  28           2HD      LYS  28   8.519  -6.739   8.168
  203    HE2  LYS  28           1HE      LYS  28   8.945  -8.936   8.233
  204    HE3  LYS  28           2HE      LYS  28   8.399  -8.943   6.557
  205    HZ1  LYS  28           3HZ      LYS  28  11.113  -8.197   6.657
  206    HZ2  LYS  28           1HZ      LYS  28  10.413  -9.545   5.912
  207    HZ3  LYS  28           2HZ      LYS  28  10.908  -9.633   7.526
  208    H    LYS  29           H        LYS  29  11.115  -5.309   2.352
  209    HA   LYS  29           HA       LYS  29  12.306  -7.870   1.521
  210    HB2  LYS  29           1HB      LYS  29  11.621  -5.602  -0.335
  211    HB3  LYS  29           2HB      LYS  29  11.873  -7.298  -0.726
  212    HG2  LYS  29           1HG      LYS  29   9.527  -6.102   0.729
  213    HG3  LYS  29           2HG      LYS  29   9.538  -6.797  -0.893
  214    HD2  LYS  29           1HD      LYS  29  10.095  -8.291   1.671
  215    HD3  LYS  29           2HD      LYS  29   8.589  -8.348   0.752
  216    HE2  LYS  29           1HE      LYS  29  10.605  -8.916  -1.094
  217    HE3  LYS  29           2HE      LYS  29  11.043  -9.814   0.359
  218    HZ1  LYS  29           3HZ      LYS  29   8.598 -10.038  -1.279
  219    HZ2  LYS  29           1HZ      LYS  29   8.611 -10.561   0.330
  220    HZ3  LYS  29           2HZ      LYS  29   9.666 -11.257  -0.794
  221    H    ARG  30           H        ARG  30  12.953  -4.569   2.238
  222    HA   ARG  30           HA       ARG  30  15.743  -4.930   2.250
  223    HB2  ARG  30           1HB      ARG  30  16.315  -3.354   0.389
  224    HB3  ARG  30           2HB      ARG  30  15.652  -4.894  -0.143
  225    HG2  ARG  30           1HG      ARG  30  13.426  -3.285   0.096
  226    HG3  ARG  30           2HG      ARG  30  14.660  -2.202  -0.550
  227    HD2  ARG  30           1HD      ARG  30  13.659  -4.792  -1.706
  228    HD3  ARG  30           2HD      ARG  30  13.586  -3.180  -2.418
  229    HE   ARG  30           HE       ARG  30  16.234  -3.588  -2.166
  230   HH11  ARG  30          1HH1      ARG  30  13.672  -5.516  -3.522
  231   HH12  ARG  30          2HH1      ARG  30  14.692  -6.279  -4.697
  232   HH21  ARG  30          1HH2      ARG  30  17.587  -4.585  -3.708
  233   HH22  ARG  30          2HH2      ARG  30  16.918  -5.750  -4.802
  234    H    ALA  31           H        ALA  31  16.762  -2.477   2.040
  235    HA   ALA  31           HA       ALA  31  15.123  -0.862   3.884
  236    HB1  ALA  31           3HB      ALA  31  17.094  -1.730   4.985
  237    HB2  ALA  31           1HB      ALA  31  18.127  -1.078   3.712
  238    HB3  ALA  31           2HB      ALA  31  17.246   0.015   4.780
  239    H    ILE  32           H        ILE  32  14.132   0.474   2.412
  240    HA   ILE  32           HA       ILE  32  15.913   2.349   1.014
  241    HB   ILE  32           HB       ILE  32  14.151   2.455  -0.814
  242   HG12  ILE  32          1HG1      ILE  32  13.380  -0.332  -0.313
  243   HG13  ILE  32          2HG1      ILE  32  12.739   0.801   0.870
  244   HG21  ILE  32          1HG2      ILE  32  15.111   0.585  -2.030
  245   HG22  ILE  32          2HG2      ILE  32  16.355   1.416  -1.097
  246   HG23  ILE  32          3HG2      ILE  32  15.698  -0.116  -0.522
  247   HD11  ILE  32          3HD1      ILE  32  12.449   1.207  -2.089
  248   HD12  ILE  32          1HD1      ILE  32  11.279   0.313  -1.119
  249   HD13  ILE  32          2HD1      ILE  32  11.584   2.018  -0.784
  250    H    LYS  33           H        LYS  33  15.620   4.109   2.267
  251    HA   LYS  33           HA       LYS  33  12.986   4.838   3.229
  252    HB2  LYS  33           1HB      LYS  33  15.392   6.602   3.486
  253    HB3  LYS  33           2HB      LYS  33  14.045   6.391   4.597
  254    HG2  LYS  33           1HG      LYS  33  15.017   3.957   4.795
  255    HG3  LYS  33           2HG      LYS  33  16.497   4.748   4.249
  256    HD2  LYS  33           1HD      LYS  33  16.622   6.095   6.134
  257    HD3  LYS  33           2HD      LYS  33  14.904   5.916   6.498
  258    HE2  LYS  33           1HE      LYS  33  15.371   3.494   6.987
  259    HE3  LYS  33           2HE      LYS  33  17.088   3.872   6.856
  260    HZ1  LYS  33           3HZ      LYS  33  15.149   4.865   8.859
  261    HZ2  LYS  33           1HZ      LYS  33  16.644   5.615   8.609
  262    HZ3  LYS  33           2HZ      LYS  33  16.582   4.006   9.123
  263    H    ASN  34           H        ASN  34  11.662   5.636   1.705
  264    HA   ASN  34           HA       ASN  34  12.672   7.871   0.072
  265    HB2  ASN  34           1HB      ASN  34  10.637   5.782  -0.746
  266    HB3  ASN  34           2HB      ASN  34  11.131   7.166  -1.719
  267   HD21  ASN  34          2HD2      ASN  34  11.425   4.041  -1.684
  268   HD22  ASN  34          1HD2      ASN  34  13.053   3.827  -2.219
  269    H    GLU  35           H        GLU  35  11.876   9.593   1.148
  270    HA   GLU  35           HA       GLU  35   9.295   9.602   2.382
  271    HB2  GLU  35           1HB      GLU  35  11.619  11.248   2.408
  272    HB3  GLU  35           2HB      GLU  35  10.248  12.259   1.975
  273    HG2  GLU  35           1HG      GLU  35  10.610  10.603   4.452
  274    HG3  GLU  35           2HG      GLU  35  10.466  12.354   4.324
  275    H    GLN  36           H        GLN  36  10.661  10.964  -0.584
  276    HA   GLN  36           HA       GLN  36   8.275  12.312  -1.364
  277    HB2  GLN  36           1HB      GLN  36  10.817  12.549  -2.144
  278    HB3  GLN  36           2HB      GLN  36  10.257  11.468  -3.414
  279    HG2  GLN  36           1HG      GLN  36   8.361  13.570  -3.086
  280    HG3  GLN  36           2HG      GLN  36   9.973  14.264  -3.246
  281   HE21  GLN  36          2HE2      GLN  36  11.285  12.928  -4.999
  282   HE22  GLN  36          1HE2      GLN  36  10.466  12.786  -6.514
  283    H    LEU  37           H        LEU  37   9.813   9.286  -2.428
  284    HA   LEU  37           HA       LEU  37   7.851   8.551  -4.290
  285    HB2  LEU  37           1HB      LEU  37   9.487   6.633  -2.651
  286    HB3  LEU  37           2HB      LEU  37   8.820   6.382  -4.263
  287    HG   LEU  37           HG       LEU  37  11.101   8.211  -3.520
  288   HD11  LEU  37          1HD1      LEU  37  11.530   6.150  -5.525
  289   HD12  LEU  37          2HD1      LEU  37  11.108   5.495  -3.944
  290   HD13  LEU  37          3HD1      LEU  37  12.493   6.574  -4.110
  291   HD21  LEU  37          3HD2      LEU  37  11.292   8.507  -5.996
  292   HD22  LEU  37          1HD2      LEU  37   9.874   9.265  -5.273
  293   HD23  LEU  37          2HD2      LEU  37   9.709   7.744  -6.151
  294    H    LEU  38           H        LEU  38   8.114   7.973  -0.824
  295    HA   LEU  38           HA       LEU  38   6.004   6.134  -0.575
  296    HB2  LEU  38           1HB      LEU  38   7.574   6.428   1.209
  297    HB3  LEU  38           2HB      LEU  38   7.145   8.130   1.369
  298    HG   LEU  38           HG       LEU  38   6.274   6.420   3.110
  299   HD11  LEU  38          1HD1      LEU  38   3.936   7.917   2.287
  300   HD12  LEU  38          2HD1      LEU  38   5.403   8.893   2.222
  301   HD13  LEU  38          3HD1      LEU  38   4.943   8.092   3.724
  302   HD21  LEU  38          3HD2      LEU  38   3.916   6.114   1.358
  303   HD22  LEU  38          1HD2      LEU  38   4.576   5.027   2.579
  304   HD23  LEU  38          2HD2      LEU  38   5.314   5.108   0.979
  305    H    GLN  39           H        GLN  39   6.057   9.672  -0.247
  306    HA   GLN  39           HA       GLN  39   3.339   9.988   0.386
  307    HB2  GLN  39           1HB      GLN  39   5.580  11.689  -0.264
  308    HB3  GLN  39           2HB      GLN  39   4.117  12.270  -1.048
  309    HG2  GLN  39           1HG      GLN  39   4.144  11.576   1.863
  310    HG3  GLN  39           2HG      GLN  39   4.691  13.150   1.288
  311   HE21  GLN  39          2HE2      GLN  39   2.963  14.055   2.517
  312   HE22  GLN  39          1HE2      GLN  39   1.353  14.057   1.890
  313    H    LEU  40           H        LEU  40   5.010  10.315  -2.744
  314    HA   LEU  40           HA       LEU  40   2.710  10.806  -4.276
  315    HB2  LEU  40           1HB      LEU  40   5.369  10.789  -4.767
  316    HB3  LEU  40           2HB      LEU  40   4.882   9.300  -5.573
  317    HG   LEU  40           HG       LEU  40   3.894  12.089  -6.159
  318   HD11  LEU  40          1HD1      LEU  40   5.736  10.172  -7.533
  319   HD12  LEU  40          2HD1      LEU  40   5.966  11.883  -7.181
  320   HD13  LEU  40          3HD1      LEU  40   4.846  11.388  -8.450
  321   HD21  LEU  40          3HD2      LEU  40   2.856  10.689  -8.143
  322   HD22  LEU  40          1HD2      LEU  40   1.994  10.910  -6.619
  323   HD23  LEU  40          2HD2      LEU  40   2.866   9.407  -6.931
  324    H    ILE  41           H        ILE  41   4.502   7.771  -3.758
  325    HA   ILE  41           HA       ILE  41   2.788   6.121  -5.239
  326    HB   ILE  41           HB       ILE  41   4.603   5.483  -2.918
  327   HG12  ILE  41          1HG1      ILE  41   4.930   4.768  -5.829
  328   HG13  ILE  41          2HG1      ILE  41   5.522   6.287  -5.166
  329   HG21  ILE  41          1HG2      ILE  41   2.940   3.655  -4.629
  330   HG22  ILE  41          2HG2      ILE  41   4.366   3.102  -3.753
  331   HG23  ILE  41          3HG2      ILE  41   2.990   3.762  -2.869
  332   HD11  ILE  41          3HD1      ILE  41   6.369   3.516  -4.365
  333   HD12  ILE  41          1HD1      ILE  41   7.317   4.706  -5.256
  334   HD13  ILE  41          2HD1      ILE  41   6.896   4.997  -3.567
  335    H    PHE  42           H        PHE  42   2.622   7.282  -1.941
  336    HA   PHE  42           HA       PHE  42   0.708   5.504  -0.930
  337    HB2  PHE  42           1HB      PHE  42   1.883   6.929   0.591
  338    HB3  PHE  42           2HB      PHE  42   1.323   8.378  -0.238
  339    HD1  PHE  42           HD1      PHE  42  -0.302   5.339   1.203
  340    HD2  PHE  42           HD2      PHE  42  -0.181   9.588   0.984
  341    HE1  PHE  42           HE1      PHE  42  -2.221   5.471   2.738
  342    HE2  PHE  42           HE2      PHE  42  -2.099   9.725   2.520
  343    HZ   PHE  42           HZ       PHE  42  -3.120   7.666   3.400
  344    H    LYS  43           H        LYS  43   0.265   8.716  -2.401
  345    HA   LYS  43           HA       LYS  43  -2.583   8.560  -2.361
  346    HB2  LYS  43           1HB      LYS  43  -0.764  10.581  -2.708
  347    HB3  LYS  43           2HB      LYS  43  -1.379  10.366  -4.342
  348    HG2  LYS  43           1HG      LYS  43  -3.705  10.495  -3.267
  349    HG3  LYS  43           2HG      LYS  43  -2.863  11.157  -1.865
  350    HD2  LYS  43           1HD      LYS  43  -2.316  13.097  -2.938
  351    HD3  LYS  43           2HD      LYS  43  -2.248  12.327  -4.525
  352    HE2  LYS  43           1HE      LYS  43  -4.913  12.298  -3.343
  353    HE3  LYS  43           2HE      LYS  43  -4.282  13.925  -3.588
  354    HZ1  LYS  43           3HZ      LYS  43  -5.549  12.632  -5.479
  355    HZ2  LYS  43           1HZ      LYS  43  -4.003  12.016  -5.784
  356    HZ3  LYS  43           2HZ      LYS  43  -4.273  13.685  -5.832
  357    H    SER  44           H        SER  44  -0.097   7.637  -4.620
  358    HA   SER  44           HA       SER  44  -1.772   7.390  -6.905
  359    HB2  SER  44           1HB      SER  44   0.910   6.158  -6.243
  360    HB3  SER  44           2HB      SER  44   0.119   6.007  -7.812
  361    HG   SER  44           HG       SER  44   1.479   7.742  -7.952
  362    H    ILE  45           H        ILE  45  -0.492   5.018  -4.585
  363    HA   ILE  45           HA       ILE  45  -1.806   2.785  -5.710
  364    HB   ILE  45           HB       ILE  45  -0.748   3.242  -2.922
  365   HG12  ILE  45          1HG1      ILE  45   0.339   1.719  -5.300
  366   HG13  ILE  45          2HG1      ILE  45   0.960   3.240  -4.668
  367   HG21  ILE  45          1HG2      ILE  45  -1.792   0.713  -4.186
  368   HG22  ILE  45          2HG2      ILE  45  -0.891   0.782  -2.672
  369   HG23  ILE  45          3HG2      ILE  45  -2.467   1.562  -2.795
  370   HD11  ILE  45          3HD1      ILE  45   2.394   1.501  -3.932
  371   HD12  ILE  45          1HD1      ILE  45   1.466   2.051  -2.535
  372   HD13  ILE  45          2HD1      ILE  45   1.033   0.544  -3.346
  373    H    ASP  46           H        ASP  46  -2.745   5.142  -3.282
  374    HA   ASP  46           HA       ASP  46  -5.167   3.723  -2.594
  375    HB2  ASP  46           1HB      ASP  46  -3.677   5.382  -1.147
  376    HB3  ASP  46           2HB      ASP  46  -4.759   6.582  -1.849
  377    H    ALA  47           H        ALA  47  -6.968   3.804  -3.746
  378    HA   ALA  47           HA       ALA  47  -7.296   5.471  -6.002
  379    HB1  ALA  47           3HB      ALA  47  -9.435   3.943  -4.526
  380    HB2  ALA  47           1HB      ALA  47  -9.496   4.512  -6.194
  381    HB3  ALA  47           2HB      ALA  47  -8.354   3.248  -5.734
  382    H    ASP  48           H        ASP  48  -8.542   5.642  -2.701
  383    HA   ASP  48           HA       ASP  48  -9.732   8.259  -3.331
  384    HB2  ASP  48           1HB      ASP  48 -11.067   7.947  -1.267
  385    HB3  ASP  48           2HB      ASP  48 -11.349   6.673  -2.450
  386    H    GLY  49           H        GLY  49  -7.179   6.723  -1.699
  387    HA2  GLY  49           1HA      GLY  49  -5.509   7.507  -0.333
  388    HA3  GLY  49           2HA      GLY  49  -5.936   9.106  -0.924
  389    H    ASN  50           H        ASN  50  -8.130   7.008   0.838
  390    HA   ASN  50           HA       ASN  50  -8.497   9.077   2.830
  391    HB2  ASN  50           1HB      ASN  50 -10.315   7.634   3.665
  392    HB3  ASN  50           2HB      ASN  50 -10.461   7.930   1.934
  393   HD21  ASN  50          2HD2      ASN  50 -11.712   5.822   3.263
  394   HD22  ASN  50          1HD2      ASN  50 -11.043   4.336   2.688
  395    H    GLY  51           H        GLY  51  -6.343   8.921   3.751
  396    HA2  GLY  51           1HA      GLY  51  -4.994   8.335   5.519
  397    HA3  GLY  51           2HA      GLY  51  -6.308   7.325   6.101
  398    H    GLU  52           H        GLU  52  -6.581   5.528   4.025
  399    HA   GLU  52           HA       GLU  52  -3.988   4.369   3.459
  400    HB2  GLU  52           1HB      GLU  52  -4.770   2.145   4.467
  401    HB3  GLU  52           2HB      GLU  52  -4.198   3.384   5.575
  402    HG2  GLU  52           1HG      GLU  52  -6.262   2.165   6.289
  403    HG3  GLU  52           2HG      GLU  52  -6.394   3.923   6.258
  404    H    ILE  53           H        ILE  53  -4.213   2.339   2.156
  405    HA   ILE  53           HA       ILE  53  -6.398   2.689   0.255
  406    HB   ILE  53           HB       ILE  53  -4.137   0.739  -0.067
  407   HG12  ILE  53          1HG1      ILE  53  -3.439   3.020  -1.501
  408   HG13  ILE  53          2HG1      ILE  53  -3.976   3.644   0.056
  409   HG21  ILE  53          1HG2      ILE  53  -6.093   2.113  -1.861
  410   HG22  ILE  53          2HG2      ILE  53  -4.555   1.541  -2.502
  411   HG23  ILE  53          3HG2      ILE  53  -5.676   0.402  -1.758
  412   HD11  ILE  53          3HD1      ILE  53  -2.291   1.401   0.512
  413   HD12  ILE  53          1HD1      ILE  53  -1.491   2.495  -0.615
  414   HD13  ILE  53          2HD1      ILE  53  -2.038   3.089   0.954
  415    H    ASP  54           H        ASP  54  -8.129   1.428   0.263
  416    HA   ASP  54           HA       ASP  54  -8.324  -0.813   2.041
  417    HB2  ASP  54           1HB      ASP  54 -10.349  -0.137  -0.078
  418    HB3  ASP  54           2HB      ASP  54 -10.612  -0.861   1.507
  419    H    GLN  55           H        GLN  55  -9.031  -2.964   1.361
  420    HA   GLN  55           HA       GLN  55  -7.297  -4.167  -0.433
  421    HB2  GLN  55           1HB      GLN  55  -8.872  -6.117  -0.341
  422    HB3  GLN  55           2HB      GLN  55  -8.382  -5.498   1.230
  423    HG2  GLN  55           1HG      GLN  55 -10.522  -4.215   1.303
  424    HG3  GLN  55           2HG      GLN  55 -11.009  -5.064  -0.164
  425   HE21  GLN  55          2HE2      GLN  55 -10.329  -5.367   3.236
  426   HE22  GLN  55          1HE2      GLN  55 -11.074  -6.911   3.453
  427    H    ASN  56           H        ASN  56 -10.661  -3.153  -0.935
  428    HA   ASN  56           HA       ASN  56 -10.980  -4.120  -3.533
  429    HB2  ASN  56           1HB      ASN  56 -12.634  -2.915  -1.814
  430    HB3  ASN  56           2HB      ASN  56 -12.256  -1.524  -2.827
  431   HD21  ASN  56          2HD2      ASN  56 -14.285  -4.097  -2.424
  432   HD22  ASN  56          1HD2      ASN  56 -14.934  -4.196  -4.022
  433    H    GLU  57           H        GLU  57  -9.924  -0.901  -2.438
  434    HA   GLU  57           HA       GLU  57  -9.539   0.225  -4.968
  435    HB2  GLU  57           1HB      GLU  57  -7.975   0.836  -2.457
  436    HB3  GLU  57           2HB      GLU  57  -8.163   1.887  -3.854
  437    HG2  GLU  57           1HG      GLU  57 -10.393   2.341  -3.367
  438    HG3  GLU  57           2HG      GLU  57 -10.539   0.951  -2.293
  439    H    PHE  58           H        PHE  58  -7.323  -1.594  -2.893
  440    HA   PHE  58           HA       PHE  58  -5.035  -1.302  -4.518
  441    HB2  PHE  58           1HB      PHE  58  -5.191  -2.120  -2.083
  442    HB3  PHE  58           2HB      PHE  58  -5.564  -3.698  -2.771
  443    HD1  PHE  58           HD1      PHE  58  -3.887  -4.750  -4.339
  444    HD2  PHE  58           HD2      PHE  58  -2.986  -1.370  -1.914
  445    HE1  PHE  58           HE1      PHE  58  -1.483  -5.203  -4.605
  446    HE2  PHE  58           HE2      PHE  58  -0.582  -1.817  -2.178
  447    HZ   PHE  58           HZ       PHE  58   0.173  -3.734  -3.526
  448    H    ALA  59           H        ALA  59  -7.587  -3.743  -4.416
  449    HA   ALA  59           HA       ALA  59  -6.470  -5.566  -6.227
  450    HB1  ALA  59           3HB      ALA  59  -8.879  -5.310  -4.808
  451    HB2  ALA  59           1HB      ALA  59  -9.321  -5.492  -6.506
  452    HB3  ALA  59           2HB      ALA  59  -8.307  -6.705  -5.723
  453    H    LYS  60           H        LYS  60  -8.814  -2.944  -6.808
  454    HA   LYS  60           HA       LYS  60  -8.886  -3.289  -9.616
  455    HB2  LYS  60           1HB      LYS  60  -9.534  -0.821  -7.994
  456    HB3  LYS  60           2HB      LYS  60 -10.015  -1.116  -9.659
  457    HG2  LYS  60           1HG      LYS  60 -10.814  -3.048  -7.533
  458    HG3  LYS  60           2HG      LYS  60 -11.693  -1.528  -7.717
  459    HD2  LYS  60           1HD      LYS  60 -11.180  -3.193 -10.135
  460    HD3  LYS  60           2HD      LYS  60 -12.440  -3.698  -9.008
  461    HE2  LYS  60           1HE      LYS  60 -12.499  -0.849  -9.697
  462    HE3  LYS  60           2HE      LYS  60 -12.782  -1.932 -11.059
  463    HZ1  LYS  60           3HZ      LYS  60 -14.834  -1.296  -9.902
  464    HZ2  LYS  60           1HZ      LYS  60 -14.264  -2.030  -8.489
  465    HZ3  LYS  60           2HZ      LYS  60 -14.573  -2.967  -9.862
  466    H    PHE  61           H        PHE  61  -6.705  -1.658  -7.489
  467    HA   PHE  61           HA       PHE  61  -5.557   0.031  -9.521
  468    HB2  PHE  61           1HB      PHE  61  -5.300   1.007  -7.444
  469    HB3  PHE  61           2HB      PHE  61  -4.997  -0.530  -6.642
  470    HD1  PHE  61           HD1      PHE  61  -3.405   1.455  -9.376
  471    HD2  PHE  61           HD2      PHE  61  -2.898  -0.740  -5.765
  472    HE1  PHE  61           HE1      PHE  61  -0.986   1.900  -9.451
  473    HE2  PHE  61           HE2      PHE  61  -0.478  -0.298  -5.833
  474    HZ   PHE  61           HZ       PHE  61   0.481   1.023  -7.676
  475    H    TYR  62           H        TYR  62  -4.889  -3.096  -8.098
  476    HA   TYR  62           HA       TYR  62  -2.260  -3.430  -9.044
  477    HB2  TYR  62           1HB      TYR  62  -3.335  -4.852  -7.307
  478    HB3  TYR  62           2HB      TYR  62  -4.332  -5.580  -8.563
  479    HD1  TYR  62           HD1      TYR  62  -3.241  -6.942 -10.356
  480    HD2  TYR  62           HD2      TYR  62  -1.107  -5.572  -6.941
  481    HE1  TYR  62           HE1      TYR  62  -1.484  -8.608 -10.794
  482    HE2  TYR  62           HE2      TYR  62   0.657  -7.232  -7.370
  483    HH   TYR  62           HH       TYR  62   0.279  -9.759  -9.682
  484    H    GLY  63           H        GLY  63  -1.563  -3.526 -11.067
  485    HA2  GLY  63           1HA      GLY  63  -1.412  -4.269 -13.259
  486    HA3  GLY  63           2HA      GLY  63  -2.916  -5.148 -13.030
  487    H    SER  64           H        SER  64  -3.403  -2.041 -11.998
  488    HA   SER  64           HA       SER  64  -4.806  -1.382 -14.472
  489    HB2  SER  64           1HB      SER  64  -5.332  -0.976 -11.702
  490    HB3  SER  64           2HB      SER  64  -5.193   0.610 -12.462
  491    HG   SER  64           HG       SER  64  -7.213   0.178 -12.954
  492    H    ILE  65           H        ILE  65  -1.847  -1.163 -14.113
  493    HA   ILE  65           HA       ILE  65  -1.405   1.716 -14.269
  494    HB   ILE  65           HB       ILE  65   0.143   0.136 -13.006
  495   HG12  ILE  65          1HG1      ILE  65   1.620   1.698 -15.107
  496   HG13  ILE  65          2HG1      ILE  65   0.623   2.522 -13.913
  497   HG21  ILE  65          1HG2      ILE  65   1.528  -1.324 -14.088
  498   HG22  ILE  65          2HG2      ILE  65   0.115  -1.416 -15.138
  499   HG23  ILE  65          3HG2      ILE  65   1.492  -0.415 -15.597
  500   HD11  ILE  65          3HD1      ILE  65   3.274   1.433 -13.660
  501   HD12  ILE  65          1HD1      ILE  65   2.393   2.519 -12.586
  502   HD13  ILE  65          2HD1      ILE  65   2.191   0.773 -12.435
  503    H    GLN  66           H        GLN  66  -2.738  -0.122 -16.363
  504    HA   GLN  66           HA       GLN  66  -1.185  -0.349 -18.640
  505    HB2  GLN  66           1HB      GLN  66  -3.195  -0.551 -19.867
  506    HB3  GLN  66           2HB      GLN  66  -3.556  -1.182 -18.266
  507    HG2  GLN  66           1HG      GLN  66  -4.279   1.372 -17.910
  508    HG3  GLN  66           2HG      GLN  66  -4.583   1.214 -19.638
  509   HE21  GLN  66          2HE2      GLN  66  -6.676   0.930 -19.917
  510   HE22  GLN  66          1HE2      GLN  66  -7.679  -0.162 -19.031
  Start of MODEL    6
    1    H1   MET   1           H        MET   1  -1.111 -13.513  -4.868
    2    HA   MET   1           HA       MET   1  -0.562 -15.202  -6.975
    3    HB2  MET   1           1HB      MET   1  -3.539 -14.753  -6.699
    4    HB3  MET   1           2HB      MET   1  -2.732 -15.547  -8.045
    5    HG2  MET   1           1HG      MET   1  -1.842 -16.988  -5.898
    6    HG3  MET   1           2HG      MET   1  -3.494 -16.588  -5.432
    7    HE1  MET   1           3HE      MET   1  -5.745 -18.261  -7.856
    8    HE2  MET   1           1HE      MET   1  -5.453 -16.859  -6.826
    9    HE3  MET   1           2HE      MET   1  -5.077 -16.781  -8.547
   10    H    ALA   2           H        ALA   2  -2.400 -12.403  -5.906
   11    HA   ALA   2           HA       ALA   2  -1.056 -10.721  -7.803
   12    HB1  ALA   2           3HB      ALA   2  -3.532  -9.922  -8.516
   13    HB2  ALA   2           1HB      ALA   2  -2.561 -11.066  -9.444
   14    HB3  ALA   2           2HB      ALA   2  -3.798 -11.656  -8.332
   15    H    GLU   3           H        GLU   3  -4.252 -10.461  -6.259
   16    HA   GLU   3           HA       GLU   3  -3.363  -8.008  -4.948
   17    HB2  GLU   3           1HB      GLU   3  -5.769  -7.705  -4.413
   18    HB3  GLU   3           2HB      GLU   3  -5.456  -7.852  -6.137
   19    HG2  GLU   3           1HG      GLU   3  -6.048 -10.389  -4.813
   20    HG3  GLU   3           2HG      GLU   3  -7.364  -9.217  -4.760
   21    H    ALA   4           H        ALA   4  -4.026 -11.302  -4.249
   22    HA   ALA   4           HA       ALA   4  -4.824 -11.253  -1.600
   23    HB1  ALA   4           3HB      ALA   4  -3.500 -13.180  -3.363
   24    HB2  ALA   4           1HB      ALA   4  -3.165 -13.414  -1.648
   25    HB3  ALA   4           2HB      ALA   4  -4.832 -13.405  -2.227
   26    H    LEU   5           H        LEU   5  -1.744 -10.472  -2.978
   27    HA   LEU   5           HA       LEU   5  -0.104 -10.834  -0.725
   28    HB2  LEU   5           1HB      LEU   5   0.349  -8.621  -2.684
   29    HB3  LEU   5           2HB      LEU   5   1.528  -9.650  -1.875
   30    HG   LEU   5           HG       LEU   5  -0.248 -10.381  -4.198
   31   HD11  LEU   5          1HD1      LEU   5   2.123 -10.924  -5.106
   32   HD12  LEU   5          2HD1      LEU   5   2.665  -9.825  -3.838
   33   HD13  LEU   5          3HD1      LEU   5   1.558  -9.254  -5.086
   34   HD21  LEU   5          3HD2      LEU   5   1.203 -12.533  -4.032
   35   HD22  LEU   5          1HD2      LEU   5  -0.230 -12.366  -3.018
   36   HD23  LEU   5          2HD2      LEU   5   1.369 -12.071  -2.338
   37    H    PHE   6           H        PHE   6  -2.103  -8.126  -1.775
   38    HA   PHE   6           HA       PHE   6  -1.203  -6.228   0.088
   39    HB2  PHE   6           1HB      PHE   6  -2.485  -5.330  -1.639
   40    HB3  PHE   6           2HB      PHE   6  -3.730  -6.568  -1.492
   41    HD1  PHE   6           HD1      PHE   6  -5.326  -6.478   0.417
   42    HD2  PHE   6           HD2      PHE   6  -2.618  -3.308  -0.438
   43    HE1  PHE   6           HE1      PHE   6  -6.682  -4.954   1.793
   44    HE2  PHE   6           HE2      PHE   6  -3.968  -1.779   0.938
   45    HZ   PHE   6           HZ       PHE   6  -6.002  -2.601   2.056
   46    H    LYS   7           H        LYS   7  -3.914  -8.519   0.239
   47    HA   LYS   7           HA       LYS   7  -4.662  -7.753   2.893
   48    HB2  LYS   7           1HB      LYS   7  -6.523  -8.759   2.173
   49    HB3  LYS   7           2HB      LYS   7  -5.668  -9.491   0.822
   50    HG2  LYS   7           1HG      LYS   7  -4.955 -11.327   2.279
   51    HG3  LYS   7           2HG      LYS   7  -5.843 -10.598   3.618
   52    HD2  LYS   7           1HD      LYS   7  -7.270 -11.169   1.059
   53    HD3  LYS   7           2HD      LYS   7  -6.926 -12.499   2.169
   54    HE2  LYS   7           1HE      LYS   7  -8.331  -9.955   2.968
   55    HE3  LYS   7           2HE      LYS   7  -9.167 -11.428   2.479
   56    HZ1  LYS   7           3HZ      LYS   7  -8.541 -10.854   4.999
   57    HZ2  LYS   7           1HZ      LYS   7  -7.172 -11.746   4.561
   58    HZ3  LYS   7           2HZ      LYS   7  -8.710 -12.434   4.420
   59    H    GLU   8           H        GLU   8  -2.458 -10.044   1.503
   60    HA   GLU   8           HA       GLU   8  -2.215 -11.783   3.722
   61    HB2  GLU   8           1HB      GLU   8  -1.442 -12.281   1.391
   62    HB3  GLU   8           2HB      GLU   8  -0.111 -11.159   1.645
   63    HG2  GLU   8           1HG      GLU   8   0.568 -12.580   3.605
   64    HG3  GLU   8           2HG      GLU   8  -0.622 -13.759   3.058
   65    H    ILE   9           H        ILE   9  -0.469  -8.864   2.750
   66    HA   ILE   9           HA       ILE   9   1.450  -8.960   4.836
   67    HB   ILE   9           HB       ILE   9   0.479  -6.631   3.179
   68   HG12  ILE   9          1HG1      ILE   9   1.609  -8.480   1.952
   69   HG13  ILE   9          2HG1      ILE   9   2.504  -6.965   1.893
   70   HG21  ILE   9          1HG2      ILE   9   1.387  -5.705   5.164
   71   HG22  ILE   9          2HG2      ILE   9   2.743  -6.832   5.149
   72   HG23  ILE   9          3HG2      ILE   9   2.634  -5.568   3.925
   73   HD11  ILE   9          3HD1      ILE   9   4.270  -7.852   2.912
   74   HD12  ILE   9          1HD1      ILE   9   3.280  -8.670   4.120
   75   HD13  ILE   9          2HD1      ILE   9   3.535  -9.410   2.539
   76    H    ASP  10           H        ASP  10  -1.834  -7.914   4.680
   77    HA   ASP  10           HA       ASP  10  -1.706  -6.237   7.019
   78    HB2  ASP  10           1HB      ASP  10  -3.901  -7.216   5.226
   79    HB3  ASP  10           2HB      ASP  10  -4.300  -6.502   6.785
   80    H    VAL  11           H        VAL  11  -0.693  -7.841   8.420
   81    HA   VAL  11           HA       VAL  11  -1.875 -10.274   9.143
   82    HB   VAL  11           HB       VAL  11  -0.252  -8.510  10.976
   83   HG11  VAL  11          1HG1      VAL  11  -0.814 -10.218  12.348
   84   HG12  VAL  11          2HG1      VAL  11  -1.155 -11.322  11.015
   85   HG13  VAL  11          3HG1      VAL  11   0.511 -11.027  11.514
   86   HG21  VAL  11          3HG2      VAL  11   1.389  -8.661   9.471
   87   HG22  VAL  11          1HG2      VAL  11   1.457 -10.379   9.862
   88   HG23  VAL  11          2HG2      VAL  11   0.490  -9.823   8.495
   89    H    ASN  12           H        ASN  12  -2.804  -7.060   9.844
   90    HA   ASN  12           HA       ASN  12  -4.256  -7.694  12.259
   91    HB2  ASN  12           1HB      ASN  12  -5.164  -5.312  11.870
   92    HB3  ASN  12           2HB      ASN  12  -3.450  -5.488  12.234
   93   HD21  ASN  12          2HD2      ASN  12  -3.101  -3.451  11.266
   94   HD22  ASN  12          1HD2      ASN  12  -3.045  -3.282   9.548
   95    H    GLY  13           H        GLY  13  -4.784  -8.393   9.106
   96    HA2  GLY  13           1HA      GLY  13  -6.637  -8.890   7.837
   97    HA3  GLY  13           2HA      GLY  13  -7.345  -9.357   9.376
   98    H    ASP  14           H        ASP  14  -6.395  -6.155   8.170
   99    HA   ASP  14           HA       ASP  14  -9.126  -5.235   8.737
  100    HB2  ASP  14           1HB      ASP  14  -8.096  -2.947   8.673
  101    HB3  ASP  14           2HB      ASP  14  -7.470  -3.987   9.948
  102    H    GLY  15           H        GLY  15  -6.983  -5.932   6.185
  103    HA2  GLY  15           1HA      GLY  15  -7.260  -5.813   3.906
  104    HA3  GLY  15           2HA      GLY  15  -8.923  -5.330   4.202
  105    H    ALA  16           H        ALA  16  -6.480  -3.429   5.687
  106    HA   ALA  16           HA       ALA  16  -6.612  -1.446   3.522
  107    HB1  ALA  16           3HB      ALA  16  -6.581   0.137   5.741
  108    HB2  ALA  16           1HB      ALA  16  -8.018  -0.260   4.799
  109    HB3  ALA  16           2HB      ALA  16  -7.632  -1.184   6.251
  110    H    VAL  17           H        VAL  17  -4.739  -0.407   3.098
  111    HA   VAL  17           HA       VAL  17  -2.492  -0.837   4.957
  112    HB   VAL  17           HB       VAL  17  -2.468  -0.960   1.943
  113   HG11  VAL  17          1HG1      VAL  17  -0.456   0.073   3.614
  114   HG12  VAL  17          2HG1      VAL  17   0.077  -1.536   3.122
  115   HG13  VAL  17          3HG1      VAL  17  -0.340  -0.331   1.902
  116   HG21  VAL  17          3HG2      VAL  17  -1.384  -2.994   3.863
  117   HG22  VAL  17          1HG2      VAL  17  -3.087  -2.980   3.403
  118   HG23  VAL  17          2HG2      VAL  17  -1.843  -3.199   2.172
  119    H    SER  18           H        SER  18  -1.945   1.048   5.824
  120    HA   SER  18           HA       SER  18  -2.480   3.538   4.450
  121    HB2  SER  18           1HB      SER  18  -1.031   4.120   6.764
  122    HB3  SER  18           2HB      SER  18  -2.784   4.160   6.586
  123    HG   SER  18           HG       SER  18  -1.171   2.310   7.849
  124    H    TYR  19           H        TYR  19  -0.639   5.262   4.752
  125    HA   TYR  19           HA       TYR  19   1.356   4.754   2.936
  126    HB2  TYR  19           1HB      TYR  19   2.520   6.729   3.868
  127    HB3  TYR  19           2HB      TYR  19   0.798   7.012   3.641
  128    HD1  TYR  19           HD1      TYR  19  -0.719   7.003   5.629
  129    HD2  TYR  19           HD2      TYR  19   3.516   6.875   6.018
  130    HE1  TYR  19           HE1      TYR  19  -0.920   7.697   7.980
  131    HE2  TYR  19           HE2      TYR  19   3.326   7.568   8.370
  132    HH   TYR  19           HH       TYR  19   1.945   8.014  10.053
  133    H    GLU  20           H        GLU  20   1.552   4.498   6.473
  134    HA   GLU  20           HA       GLU  20   4.259   3.793   6.635
  135    HB2  GLU  20           1HB      GLU  20   1.973   3.867   8.406
  136    HB3  GLU  20           2HB      GLU  20   2.960   2.448   8.722
  137    HG2  GLU  20           1HG      GLU  20   4.772   4.547   8.447
  138    HG3  GLU  20           2HG      GLU  20   3.438   5.201   9.395
  139    H    GLU  21           H        GLU  21   1.358   1.740   6.479
  140    HA   GLU  21           HA       GLU  21   2.614  -0.738   6.641
  141    HB2  GLU  21           1HB      GLU  21   0.037   0.232   5.499
  142    HB3  GLU  21           2HB      GLU  21   0.558  -1.397   5.094
  143    HG2  GLU  21           1HG      GLU  21   0.912  -1.512   7.726
  144    HG3  GLU  21           2HG      GLU  21  -0.346  -0.278   7.677
  145    H    VAL  22           H        VAL  22   2.084   1.367   3.866
  146    HA   VAL  22           HA       VAL  22   2.892  -0.445   1.862
  147    HB   VAL  22           HB       VAL  22   2.933   2.572   1.925
  148   HG11  VAL  22          1HG1      VAL  22   2.991   2.165  -0.657
  149   HG12  VAL  22          2HG1      VAL  22   4.490   2.182   0.274
  150   HG13  VAL  22          3HG1      VAL  22   3.762   0.647  -0.199
  151   HG21  VAL  22          3HG2      VAL  22   0.917   2.454   0.674
  152   HG22  VAL  22          1HG2      VAL  22   1.093   0.717   0.430
  153   HG23  VAL  22          2HG2      VAL  22   0.733   1.350   2.036
  154    H    LYS  23           H        LYS  23   4.706   2.202   3.420
  155    HA   LYS  23           HA       LYS  23   7.159   1.760   2.201
  156    HB2  LYS  23           1HB      LYS  23   6.154   3.329   4.360
  157    HB3  LYS  23           2HB      LYS  23   7.634   2.544   4.899
  158    HG2  LYS  23           1HG      LYS  23   8.418   3.427   2.478
  159    HG3  LYS  23           2HG      LYS  23   7.232   4.663   2.900
  160    HD2  LYS  23           1HD      LYS  23   9.027   3.967   5.097
  161    HD3  LYS  23           2HD      LYS  23   9.860   4.633   3.690
  162    HE2  LYS  23           1HE      LYS  23   7.406   5.957   4.783
  163    HE3  LYS  23           2HE      LYS  23   8.981   6.239   5.525
  164    HZ1  LYS  23           3HZ      LYS  23   8.987   6.497   2.658
  165    HZ2  LYS  23           1HZ      LYS  23   9.620   7.531   3.840
  166    HZ3  LYS  23           2HZ      LYS  23   7.980   7.617   3.431
  167    H    ALA  24           H        ALA  24   5.733   0.209   5.023
  168    HA   ALA  24           HA       ALA  24   8.053  -1.220   5.810
  169    HB1  ALA  24           3HB      ALA  24   6.226  -0.831   7.358
  170    HB2  ALA  24           1HB      ALA  24   5.144  -1.800   6.358
  171    HB3  ALA  24           2HB      ALA  24   6.511  -2.561   7.173
  172    H    PHE  25           H        PHE  25   5.287  -2.024   3.753
  173    HA   PHE  25           HA       PHE  25   5.732  -4.713   3.337
  174    HB2  PHE  25           1HB      PHE  25   3.796  -3.364   2.472
  175    HB3  PHE  25           2HB      PHE  25   4.852  -2.769   1.197
  176    HD1  PHE  25           HD2      PHE  25   5.719  -6.078   1.998
  177    HD2  PHE  25           HD1      PHE  25   2.842  -3.778  -0.135
  178    HE1  PHE  25           HE2      PHE  25   5.167  -8.044   0.628
  179    HE2  PHE  25           HE1      PHE  25   2.285  -5.742  -1.508
  180    HZ   PHE  25           HZ       PHE  25   3.449  -7.878  -1.129
  181    H    VAL  26           H        VAL  26   7.051  -2.004   1.436
  182    HA   VAL  26           HA       VAL  26   8.671  -3.651  -0.218
  183    HB   VAL  26           HB       VAL  26   7.871  -1.113  -0.454
  184   HG11  VAL  26          1HG1      VAL  26  10.740  -0.796   0.397
  185   HG12  VAL  26          2HG1      VAL  26   9.587   0.470  -0.027
  186   HG13  VAL  26          3HG1      VAL  26   9.374  -0.457   1.458
  187   HG21  VAL  26          3HG2      VAL  26   8.713  -2.288  -2.317
  188   HG22  VAL  26          1HG2      VAL  26   9.734  -0.859  -2.162
  189   HG23  VAL  26          2HG2      VAL  26  10.321  -2.425  -1.604
  190    H    SER  27           H        SER  27   9.128  -2.127   2.882
  191    HA   SER  27           HA       SER  27  11.925  -2.141   3.017
  192    HB2  SER  27           1HB      SER  27   9.696  -1.938   4.930
  193    HB3  SER  27           2HB      SER  27  11.183  -2.596   5.612
  194    HG   SER  27           HG       SER  27  11.028  -0.274   5.701
  195    H    LYS  28           H        LYS  28   9.632  -4.708   3.195
  196    HA   LYS  28           HA       LYS  28  11.278  -6.585   4.579
  197    HB2  LYS  28           1HB      LYS  28   8.677  -6.617   3.181
  198    HB3  LYS  28           2HB      LYS  28   9.548  -8.145   3.185
  199    HG2  LYS  28           1HG      LYS  28   7.943  -7.889   5.055
  200    HG3  LYS  28           2HG      LYS  28   9.603  -8.189   5.572
  201    HD2  LYS  28           1HD      LYS  28   8.913  -5.352   5.283
  202    HD3  LYS  28           2HD      LYS  28   8.000  -6.202   6.532
  203    HE2  LYS  28           1HE      LYS  28   9.790  -6.394   7.869
  204    HE3  LYS  28           2HE      LYS  28  10.859  -6.817   6.532
  205    HZ1  LYS  28           3HZ      LYS  28  11.600  -4.741   6.406
  206    HZ2  LYS  28           1HZ      LYS  28  10.836  -4.450   7.887
  207    HZ3  LYS  28           2HZ      LYS  28  10.043  -4.080   6.440
  208    H    LYS  29           H        LYS  29  11.478  -5.256   1.525
  209    HA   LYS  29           HA       LYS  29  12.805  -7.628   0.401
  210    HB2  LYS  29           1HB      LYS  29  12.114  -5.136  -1.136
  211    HB3  LYS  29           2HB      LYS  29  12.417  -6.754  -1.754
  212    HG2  LYS  29           1HG      LYS  29  10.001  -5.818  -0.224
  213    HG3  LYS  29           2HG      LYS  29  10.079  -6.291  -1.923
  214    HD2  LYS  29           1HD      LYS  29  10.592  -8.100   0.438
  215    HD3  LYS  29           2HD      LYS  29   9.119  -8.067  -0.535
  216    HE2  LYS  29           1HE      LYS  29  10.051  -9.563  -1.888
  217    HE3  LYS  29           2HE      LYS  29  11.231  -8.339  -2.356
  218    HZ1  LYS  29           3HZ      LYS  29  12.063 -10.568  -1.433
  219    HZ2  LYS  29           1HZ      LYS  29  11.634  -9.948   0.081
  220    HZ3  LYS  29           2HZ      LYS  29  12.783  -9.146  -0.866
  221    H    ARG  30           H        ARG  30  13.314  -4.392   1.510
  222    HA   ARG  30           HA       ARG  30  16.102  -4.678   1.666
  223    HB2  ARG  30           1HB      ARG  30  16.748  -2.957  -0.036
  224    HB3  ARG  30           2HB      ARG  30  16.172  -4.473  -0.717
  225    HG2  ARG  30           1HG      ARG  30  13.885  -2.937  -0.516
  226    HG3  ARG  30           2HG      ARG  30  15.129  -1.789  -1.014
  227    HD2  ARG  30           1HD      ARG  30  14.269  -4.320  -2.390
  228    HD3  ARG  30           2HD      ARG  30  14.200  -2.668  -3.004
  229    HE   ARG  30           HE       ARG  30  16.444  -4.442  -3.081
  230   HH11  ARG  30          1HH1      ARG  30  15.483  -1.098  -2.958
  231   HH12  ARG  30          2HH1      ARG  30  16.940  -0.517  -3.693
  232   HH21  ARG  30          1HH2      ARG  30  18.367  -3.689  -4.050
  233   HH22  ARG  30          2HH2      ARG  30  18.579  -1.992  -4.315
  234    H    ALA  31           H        ALA  31  17.063  -2.190   1.691
  235    HA   ALA  31           HA       ALA  31  15.268  -0.754   3.538
  236    HB1  ALA  31           3HB      ALA  31  17.043  -1.428   4.865
  237    HB2  ALA  31           1HB      ALA  31  18.229  -1.183   3.582
  238    HB3  ALA  31           2HB      ALA  31  17.511   0.207   4.397
  239    H    ILE  32           H        ILE  32  14.321   0.654   2.103
  240    HA   ILE  32           HA       ILE  32  16.121   2.671   0.946
  241    HB   ILE  32           HB       ILE  32  14.460   2.861  -0.968
  242   HG12  ILE  32          1HG1      ILE  32  13.739   0.033  -0.729
  243   HG13  ILE  32          2HG1      ILE  32  13.018   1.041   0.520
  244   HG21  ILE  32          1HG2      ILE  32  15.876   1.654  -2.232
  245   HG22  ILE  32          2HG2      ILE  32  16.766   1.466  -0.723
  246   HG23  ILE  32          3HG2      ILE  32  15.666   0.198  -1.261
  247   HD11  ILE  32          3HD1      ILE  32  12.854   1.961  -2.297
  248   HD12  ILE  32          1HD1      ILE  32  11.822   0.627  -1.782
  249   HD13  ILE  32          2HD1      ILE  32  11.724   2.186  -0.962
  250    H    LYS  33           H        LYS  33  15.708   4.333   2.292
  251    HA   LYS  33           HA       LYS  33  13.030   4.913   3.206
  252    HB2  LYS  33           1HB      LYS  33  14.142   6.868   4.317
  253    HB3  LYS  33           2HB      LYS  33  14.798   5.302   4.771
  254    HG2  LYS  33           1HG      LYS  33  16.824   5.918   4.136
  255    HG3  LYS  33           2HG      LYS  33  16.238   6.315   2.518
  256    HD2  LYS  33           1HD      LYS  33  16.141   8.523   2.960
  257    HD3  LYS  33           2HD      LYS  33  15.558   8.271   4.607
  258    HE2  LYS  33           1HE      LYS  33  17.988   7.421   5.032
  259    HE3  LYS  33           2HE      LYS  33  18.361   8.337   3.572
  260    HZ1  LYS  33           3HZ      LYS  33  16.827  10.019   5.108
  261    HZ2  LYS  33           1HZ      LYS  33  18.501  10.109   4.876
  262    HZ3  LYS  33           2HZ      LYS  33  17.875   9.280   6.211
  263    H    ASN  34           H        ASN  34  11.679   5.717   1.716
  264    HA   ASN  34           HA       ASN  34  12.601   8.036   0.152
  265    HB2  ASN  34           1HB      ASN  34  10.623   5.912  -0.706
  266    HB3  ASN  34           2HB      ASN  34  11.060   7.339  -1.643
  267   HD21  ASN  34          2HD2      ASN  34  11.518   4.174  -1.516
  268   HD22  ASN  34          1HD2      ASN  34  13.121   4.049  -2.149
  269    H    GLU  35           H        GLU  35  11.771   9.700   1.294
  270    HA   GLU  35           HA       GLU  35   9.201   9.600   2.548
  271    HB2  GLU  35           1HB      GLU  35   9.608  12.040   2.952
  272    HB3  GLU  35           2HB      GLU  35  10.872  10.979   3.557
  273    HG2  GLU  35           1HG      GLU  35  12.313  12.291   2.505
  274    HG3  GLU  35           2HG      GLU  35  11.710  11.596   1.001
  275    H    GLN  36           H        GLN  36  10.501  11.085  -0.388
  276    HA   GLN  36           HA       GLN  36   8.074  12.393  -1.104
  277    HB2  GLN  36           1HB      GLN  36  10.603  12.715  -1.903
  278    HB3  GLN  36           2HB      GLN  36  10.052  11.663  -3.200
  279    HG2  GLN  36           1HG      GLN  36   8.099  13.682  -2.813
  280    HG3  GLN  36           2HG      GLN  36   9.682  14.453  -2.901
  281   HE21  GLN  36          2HE2      GLN  36   7.277  12.637  -4.596
  282   HE22  GLN  36          1HE2      GLN  36   7.974  12.780  -6.169
  283    H    LEU  37           H        LEU  37   9.681   9.444  -2.282
  284    HA   LEU  37           HA       LEU  37   7.723   8.712  -4.146
  285    HB2  LEU  37           1HB      LEU  37   9.420   6.793  -2.570
  286    HB3  LEU  37           2HB      LEU  37   8.742   6.563  -4.180
  287    HG   LEU  37           HG       LEU  37  10.986   8.431  -3.418
  288   HD11  LEU  37          1HD1      LEU  37  11.121   5.758  -3.824
  289   HD12  LEU  37          2HD1      LEU  37  12.429   6.886  -4.175
  290   HD13  LEU  37          3HD1      LEU  37  11.351   6.358  -5.466
  291   HD21  LEU  37          3HD2      LEU  37   9.600   9.435  -5.145
  292   HD22  LEU  37          1HD2      LEU  37   9.681   7.951  -6.096
  293   HD23  LEU  37          2HD2      LEU  37  11.141   8.902  -5.820
  294    H    LEU  38           H        LEU  38   8.028   8.030  -0.700
  295    HA   LEU  38           HA       LEU  38   5.958   6.141  -0.494
  296    HB2  LEU  38           1HB      LEU  38   7.525   6.396   1.290
  297    HB3  LEU  38           2HB      LEU  38   7.093   8.091   1.499
  298    HG   LEU  38           HG       LEU  38   6.244   6.347   3.207
  299   HD11  LEU  38          1HD1      LEU  38   3.997   7.987   2.179
  300   HD12  LEU  38          2HD1      LEU  38   5.479   8.821   2.640
  301   HD13  LEU  38          3HD1      LEU  38   4.626   7.824   3.818
  302   HD21  LEU  38          3HD2      LEU  38   3.873   6.033   1.479
  303   HD22  LEU  38          1HD2      LEU  38   4.579   4.926   2.657
  304   HD23  LEU  38          2HD2      LEU  38   5.285   5.066   1.047
  305    H    GLN  39           H        GLN  39   5.942   9.667  -0.048
  306    HA   GLN  39           HA       GLN  39   3.213   9.891   0.603
  307    HB2  GLN  39           1HB      GLN  39   5.392  11.632   0.324
  308    HB3  GLN  39           2HB      GLN  39   4.192  12.204  -0.828
  309    HG2  GLN  39           1HG      GLN  39   2.993  11.573   1.722
  310    HG3  GLN  39           2HG      GLN  39   4.297  12.747   1.887
  311   HE21  GLN  39          2HE2      GLN  39   2.780  14.339   2.457
  312   HE22  GLN  39          1HE2      GLN  39   1.784  15.101   1.269
  313    H    LEU  40           H        LEU  40   4.892  10.392  -2.498
  314    HA   LEU  40           HA       LEU  40   2.601  10.929  -4.022
  315    HB2  LEU  40           1HB      LEU  40   5.262  10.950  -4.498
  316    HB3  LEU  40           2HB      LEU  40   4.793   9.489  -5.364
  317    HG   LEU  40           HG       LEU  40   3.781  12.289  -5.848
  318   HD11  LEU  40          1HD1      LEU  40   5.093  10.596  -7.905
  319   HD12  LEU  40          2HD1      LEU  40   6.106  11.348  -6.674
  320   HD13  LEU  40          3HD1      LEU  40   5.091  12.349  -7.712
  321   HD21  LEU  40          3HD2      LEU  40   1.905  11.206  -6.474
  322   HD22  LEU  40          1HD2      LEU  40   2.722   9.651  -6.620
  323   HD23  LEU  40          2HD2      LEU  40   2.848  10.837  -7.918
  324    H    ILE  41           H        ILE  41   4.403   7.882  -3.614
  325    HA   ILE  41           HA       ILE  41   2.694   6.293  -5.174
  326    HB   ILE  41           HB       ILE  41   4.532   5.565  -2.898
  327   HG12  ILE  41          1HG1      ILE  41   5.570   6.434  -4.976
  328   HG13  ILE  41          2HG1      ILE  41   5.993   4.754  -4.665
  329   HG21  ILE  41          1HG2      ILE  41   2.904   3.847  -2.914
  330   HG22  ILE  41          2HG2      ILE  41   2.879   3.790  -4.676
  331   HG23  ILE  41          3HG2      ILE  41   4.295   3.218  -3.795
  332   HD11  ILE  41          3HD1      ILE  41   3.943   5.744  -6.630
  333   HD12  ILE  41          1HD1      ILE  41   5.535   5.089  -7.008
  334   HD13  ILE  41          2HD1      ILE  41   4.301   4.051  -6.296
  335    H    PHE  42           H        PHE  42   2.536   7.306  -1.828
  336    HA   PHE  42           HA       PHE  42   0.640   5.470  -0.888
  337    HB2  PHE  42           1HB      PHE  42   1.801   6.815   0.703
  338    HB3  PHE  42           2HB      PHE  42   1.268   8.305  -0.068
  339    HD1  PHE  42           HD1      PHE  42  -0.518   5.244   1.098
  340    HD2  PHE  42           HD2      PHE  42  -0.121   9.475   1.329
  341    HE1  PHE  42           HE1      PHE  42  -2.446   5.339   2.625
  342    HE2  PHE  42           HE2      PHE  42  -2.047   9.577   2.857
  343    HZ   PHE  42           HZ       PHE  42  -3.211   7.507   3.508
  344    H    LYS  43           H        LYS  43   0.174   8.741  -2.215
  345    HA   LYS  43           HA       LYS  43  -2.672   8.574  -2.160
  346    HB2  LYS  43           1HB      LYS  43  -0.852  10.610  -2.451
  347    HB3  LYS  43           2HB      LYS  43  -1.503  10.462  -4.078
  348    HG2  LYS  43           1HG      LYS  43  -3.797  10.610  -3.051
  349    HG3  LYS  43           2HG      LYS  43  -2.998  11.048  -1.539
  350    HD2  LYS  43           1HD      LYS  43  -2.290  13.083  -2.346
  351    HD3  LYS  43           2HD      LYS  43  -2.303  12.540  -4.025
  352    HE2  LYS  43           1HE      LYS  43  -4.761  13.016  -2.346
  353    HE3  LYS  43           2HE      LYS  43  -4.096  14.167  -3.504
  354    HZ1  LYS  43           3HZ      LYS  43  -5.364  13.169  -5.008
  355    HZ2  LYS  43           1HZ      LYS  43  -5.749  11.892  -3.967
  356    HZ3  LYS  43           2HZ      LYS  43  -4.342  11.826  -4.902
  357    H    SER  44           H        SER  44  -0.199   7.788  -4.494
  358    HA   SER  44           HA       SER  44  -1.896   7.615  -6.765
  359    HB2  SER  44           1HB      SER  44   0.866   6.658  -6.106
  360    HB3  SER  44           2HB      SER  44   0.068   6.057  -7.560
  361    HG   SER  44           HG       SER  44   0.846   7.842  -8.377
  362    H    ILE  45           H        ILE  45  -0.563   5.143  -4.579
  363    HA   ILE  45           HA       ILE  45  -1.902   2.964  -5.784
  364    HB   ILE  45           HB       ILE  45  -0.768   3.279  -3.006
  365   HG12  ILE  45          1HG1      ILE  45   0.260   1.908  -5.500
  366   HG13  ILE  45          2HG1      ILE  45   0.899   3.381  -4.780
  367   HG21  ILE  45          1HG2      ILE  45  -1.820   0.808  -4.376
  368   HG22  ILE  45          2HG2      ILE  45  -0.900   0.815  -2.872
  369   HG23  ILE  45          3HG2      ILE  45  -2.486   1.584  -2.940
  370   HD11  ILE  45          3HD1      ILE  45   2.348   1.602  -4.194
  371   HD12  ILE  45          1HD1      ILE  45   1.445   2.039  -2.744
  372   HD13  ILE  45          2HD1      ILE  45   1.001   0.597  -3.659
  373    H    ASP  46           H        ASP  46  -2.802   5.240  -3.280
  374    HA   ASP  46           HA       ASP  46  -5.183   3.765  -2.551
  375    HB2  ASP  46           1HB      ASP  46  -3.671   5.392  -1.096
  376    HB3  ASP  46           2HB      ASP  46  -4.775   6.606  -1.737
  377    H    ALA  47           H        ALA  47  -7.021   3.862  -3.642
  378    HA   ALA  47           HA       ALA  47  -7.432   5.576  -5.846
  379    HB1  ALA  47           3HB      ALA  47  -9.506   4.524  -6.115
  380    HB2  ALA  47           1HB      ALA  47  -8.476   3.290  -5.389
  381    HB3  ALA  47           2HB      ALA  47  -9.645   4.160  -4.395
  382    H    ASP  48           H        ASP  48  -8.589   5.668  -2.507
  383    HA   ASP  48           HA       ASP  48  -9.787   8.304  -3.043
  384    HB2  ASP  48           1HB      ASP  48 -11.060   7.939  -0.940
  385    HB3  ASP  48           2HB      ASP  48 -11.393   6.718  -2.164
  386    H    GLY  49           H        GLY  49  -7.199   6.721  -1.509
  387    HA2  GLY  49           1HA      GLY  49  -5.497   7.467  -0.163
  388    HA3  GLY  49           2HA      GLY  49  -5.928   9.080  -0.711
  389    H    ASN  50           H        ASN  50  -8.093   6.955   1.057
  390    HA   ASN  50           HA       ASN  50  -8.391   8.984   3.105
  391    HB2  ASN  50           1HB      ASN  50 -10.211   7.533   3.944
  392    HB3  ASN  50           2HB      ASN  50 -10.399   7.912   2.234
  393   HD21  ASN  50          2HD2      ASN  50 -11.712   5.797   3.367
  394   HD22  ASN  50          1HD2      ASN  50 -11.065   4.317   2.756
  395    H    GLY  51           H        GLY  51  -6.229   8.770   3.984
  396    HA2  GLY  51           1HA      GLY  51  -4.856   8.112   5.709
  397    HA3  GLY  51           2HA      GLY  51  -6.175   7.103   6.285
  398    H    GLU  52           H        GLU  52  -6.509   5.375   4.162
  399    HA   GLU  52           HA       GLU  52  -3.939   4.196   3.525
  400    HB2  GLU  52           1HB      GLU  52  -4.748   1.952   4.463
  401    HB3  GLU  52           2HB      GLU  52  -4.151   3.143   5.610
  402    HG2  GLU  52           1HG      GLU  52  -6.221   1.943   6.311
  403    HG3  GLU  52           2HG      GLU  52  -6.346   3.701   6.308
  404    H    ILE  53           H        ILE  53  -4.212   2.212   2.159
  405    HA   ILE  53           HA       ILE  53  -6.409   2.664   0.292
  406    HB   ILE  53           HB       ILE  53  -4.173   0.703  -0.123
  407   HG12  ILE  53          1HG1      ILE  53  -3.477   3.028  -1.489
  408   HG13  ILE  53          2HG1      ILE  53  -3.982   3.597   0.097
  409   HG21  ILE  53          1HG2      ILE  53  -4.609   1.574  -2.526
  410   HG22  ILE  53          2HG2      ILE  53  -5.742   0.436  -1.800
  411   HG23  ILE  53          3HG2      ILE  53  -6.131   2.155  -1.851
  412   HD11  ILE  53          3HD1      ILE  53  -2.345   1.371   0.554
  413   HD12  ILE  53          1HD1      ILE  53  -1.542   2.334  -0.685
  414   HD13  ILE  53          2HD1      ILE  53  -1.978   3.069   0.858
  415    H    ASP  54           H        ASP  54  -8.152   1.419   0.256
  416    HA   ASP  54           HA       ASP  54  -8.361  -0.881   1.960
  417    HB2  ASP  54           1HB      ASP  54 -10.389  -0.090  -0.119
  418    HB3  ASP  54           2HB      ASP  54 -10.655  -0.892   1.426
  419    H    GLN  55           H        GLN  55  -9.092  -2.998   1.213
  420    HA   GLN  55           HA       GLN  55  -7.387  -4.155  -0.637
  421    HB2  GLN  55           1HB      GLN  55  -8.931  -6.105  -0.578
  422    HB3  GLN  55           2HB      GLN  55  -8.508  -5.500   1.018
  423    HG2  GLN  55           1HG      GLN  55 -10.711  -5.663   1.383
  424    HG3  GLN  55           2HG      GLN  55 -10.762  -4.102   0.565
  425   HE21  GLN  55          2HE2      GLN  55 -12.638  -4.168  -0.494
  426   HE22  GLN  55          1HE2      GLN  55 -13.092  -5.382  -1.637
  427    H    ASN  56           H        ASN  56 -10.727  -3.051  -1.076
  428    HA   ASN  56           HA       ASN  56 -11.104  -3.939  -3.693
  429    HB2  ASN  56           1HB      ASN  56 -12.588  -2.505  -1.848
  430    HB3  ASN  56           2HB      ASN  56 -12.351  -1.352  -3.158
  431   HD21  ASN  56          2HD2      ASN  56 -13.835  -1.387  -4.668
  432   HD22  ASN  56          1HD2      ASN  56 -14.815  -2.740  -5.109
  433    H    GLU  57           H        GLU  57  -9.941  -0.781  -2.535
  434    HA   GLU  57           HA       GLU  57  -9.537   0.379  -5.052
  435    HB2  GLU  57           1HB      GLU  57  -7.966   0.923  -2.526
  436    HB3  GLU  57           2HB      GLU  57  -8.128   1.995  -3.910
  437    HG2  GLU  57           1HG      GLU  57 -10.311   2.544  -3.401
  438    HG3  GLU  57           2HG      GLU  57 -10.558   1.093  -2.432
  439    H    PHE  58           H        PHE  58  -7.349  -1.491  -2.985
  440    HA   PHE  58           HA       PHE  58  -5.061  -1.233  -4.613
  441    HB2  PHE  58           1HB      PHE  58  -5.224  -2.057  -2.182
  442    HB3  PHE  58           2HB      PHE  58  -5.628  -3.625  -2.873
  443    HD1  PHE  58           HD1      PHE  58  -3.978  -4.848  -4.220
  444    HD2  PHE  58           HD2      PHE  58  -3.003  -1.205  -2.245
  445    HE1  PHE  58           HE1      PHE  58  -1.584  -5.345  -4.495
  446    HE2  PHE  58           HE2      PHE  58  -0.607  -1.696  -2.517
  447    HZ   PHE  58           HZ       PHE  58   0.105  -3.767  -3.643
  448    H    ALA  59           H        ALA  59  -7.656  -3.629  -4.518
  449    HA   ALA  59           HA       ALA  59  -6.575  -5.469  -6.333
  450    HB1  ALA  59           3HB      ALA  59  -9.208  -4.922  -5.175
  451    HB2  ALA  59           1HB      ALA  59  -9.255  -5.692  -6.762
  452    HB3  ALA  59           2HB      ALA  59  -8.377  -6.455  -5.435
  453    H    LYS  60           H        LYS  60  -8.853  -2.789  -6.910
  454    HA   LYS  60           HA       LYS  60  -8.940  -3.128  -9.718
  455    HB2  LYS  60           1HB      LYS  60  -9.881  -1.130  -7.762
  456    HB3  LYS  60           2HB      LYS  60  -9.585  -0.507  -9.379
  457    HG2  LYS  60           1HG      LYS  60 -11.906  -1.180  -9.090
  458    HG3  LYS  60           2HG      LYS  60 -11.099  -2.160 -10.317
  459    HD2  LYS  60           1HD      LYS  60 -11.231  -4.055  -9.079
  460    HD3  LYS  60           2HD      LYS  60 -11.024  -3.197  -7.550
  461    HE2  LYS  60           1HE      LYS  60 -13.236  -2.971  -7.244
  462    HE3  LYS  60           2HE      LYS  60 -13.527  -2.583  -8.940
  463    HZ1  LYS  60           3HZ      LYS  60 -14.313  -4.848  -7.795
  464    HZ2  LYS  60           1HZ      LYS  60 -12.804  -5.338  -8.381
  465    HZ3  LYS  60           2HZ      LYS  60 -13.962  -4.716  -9.444
  466    H    PHE  61           H        PHE  61  -6.708  -1.556  -7.594
  467    HA   PHE  61           HA       PHE  61  -5.512   0.090  -9.632
  468    HB2  PHE  61           1HB      PHE  61  -5.243   1.060  -7.547
  469    HB3  PHE  61           2HB      PHE  61  -4.951  -0.484  -6.753
  470    HD1  PHE  61           HD1      PHE  61  -3.361   1.480  -9.504
  471    HD2  PHE  61           HD2      PHE  61  -2.848  -0.708  -5.890
  472    HE1  PHE  61           HE1      PHE  61  -0.938   1.897  -9.599
  473    HE2  PHE  61           HE2      PHE  61  -0.424  -0.294  -5.979
  474    HZ   PHE  61           HZ       PHE  61   0.535   1.010  -7.836
  475    H    TYR  62           H        TYR  62  -4.942  -3.051  -8.204
  476    HA   TYR  62           HA       TYR  62  -2.321  -3.452  -9.175
  477    HB2  TYR  62           1HB      TYR  62  -3.128  -4.862  -7.415
  478    HB3  TYR  62           2HB      TYR  62  -4.496  -5.394  -8.387
  479    HD1  TYR  62           HD2      TYR  62  -4.188  -7.028 -10.178
  480    HD2  TYR  62           HD1      TYR  62  -0.923  -5.800  -7.742
  481    HE1  TYR  62           HE2      TYR  62  -2.878  -8.952 -10.974
  482    HE2  TYR  62           HE1      TYR  62   0.397  -7.720  -8.532
  483    HH   TYR  62           HH       TYR  62  -0.038  -9.318 -11.099
  484    H    GLY  63           H        GLY  63  -1.651  -3.672 -11.198
  485    HA2  GLY  63           1HA      GLY  63  -1.618  -4.740 -13.308
  486    HA3  GLY  63           2HA      GLY  63  -3.322  -5.120 -13.116
  487    H    SER  64           H        SER  64  -2.897  -1.964 -12.217
  488    HA   SER  64           HA       SER  64  -3.952  -1.036 -14.775
  489    HB2  SER  64           1HB      SER  64  -5.171  -0.434 -12.719
  490    HB3  SER  64           2HB      SER  64  -3.738   0.399 -12.116
  491    HG   SER  64           HG       SER  64  -5.597   1.208 -13.970
  492    H    ILE  65           H        ILE  65  -1.072  -1.679 -14.267
  493    HA   ILE  65           HA       ILE  65   0.202   0.933 -14.511
  494    HB   ILE  65           HB       ILE  65   1.634  -1.704 -14.668
  495   HG12  ILE  65          1HG1      ILE  65   0.810  -0.220 -12.162
  496   HG13  ILE  65          2HG1      ILE  65   0.233  -1.804 -12.667
  497   HG21  ILE  65          1HG2      ILE  65   2.438   0.966 -14.810
  498   HG22  ILE  65          2HG2      ILE  65   2.919   0.418 -13.205
  499   HG23  ILE  65          3HG2      ILE  65   3.471  -0.453 -14.635
  500   HD11  ILE  65          3HD1      ILE  65   2.466  -2.717 -12.401
  501   HD12  ILE  65          1HD1      ILE  65   3.073  -1.127 -11.940
  502   HD13  ILE  65          2HD1      ILE  65   1.911  -1.961 -10.908
  503    H    GLN  66           H        GLN  66  -1.523  -0.548 -16.600
  504    HA   GLN  66           HA       GLN  66  -0.031  -1.359 -18.775
  505    HB2  GLN  66           1HB      GLN  66  -2.705  -0.043 -18.503
  506    HB3  GLN  66           2HB      GLN  66  -2.026  -0.290 -20.105
  507    HG2  GLN  66           1HG      GLN  66  -1.709  -2.736 -19.325
  508    HG3  GLN  66           2HG      GLN  66  -2.896  -2.313 -18.092
  509   HE21  GLN  66          2HE2      GLN  66  -4.920  -1.314 -18.918
  510   HE22  GLN  66          1HE2      GLN  66  -5.574  -1.933 -20.392
  Start of MODEL    7
    1    H1   MET   1           H        MET   1  -2.157 -13.426  -4.904
    2    HA   MET   1           HA       MET   1   0.024 -14.176  -6.233
    3    HB2  MET   1           1HB      MET   1  -2.277 -14.981  -8.014
    4    HB3  MET   1           2HB      MET   1  -0.560 -15.151  -8.350
    5    HG2  MET   1           1HG      MET   1  -0.792 -16.560  -6.043
    6    HG3  MET   1           2HG      MET   1  -2.358 -16.857  -6.796
    7    HE1  MET   1           3HE      MET   1  -0.007 -19.586  -6.593
    8    HE2  MET   1           1HE      MET   1  -1.707 -19.139  -6.449
    9    HE3  MET   1           2HE      MET   1  -1.162 -20.097  -7.825
   10    H    ALA   2           H        ALA   2  -3.106 -12.670  -6.619
   11    HA   ALA   2           HA       ALA   2  -1.863 -10.543  -8.236
   12    HB1  ALA   2           3HB      ALA   2  -4.533 -11.796  -8.284
   13    HB2  ALA   2           1HB      ALA   2  -4.489 -10.049  -8.524
   14    HB3  ALA   2           2HB      ALA   2  -3.574 -11.110  -9.595
   15    H    GLU   3           H        GLU   3  -4.696 -10.740  -6.079
   16    HA   GLU   3           HA       GLU   3  -3.809  -8.225  -4.840
   17    HB2  GLU   3           1HB      GLU   3  -6.194  -8.035  -4.088
   18    HB3  GLU   3           2HB      GLU   3  -5.968  -7.976  -5.830
   19    HG2  GLU   3           1HG      GLU   3  -7.074  -9.906  -6.179
   20    HG3  GLU   3           2HG      GLU   3  -6.487 -10.640  -4.689
   21    H    ALA   4           H        ALA   4  -4.422 -11.557  -4.261
   22    HA   ALA   4           HA       ALA   4  -4.999 -11.617  -1.547
   23    HB1  ALA   4           3HB      ALA   4  -3.438 -13.537  -3.258
   24    HB2  ALA   4           1HB      ALA   4  -3.871 -13.868  -1.581
   25    HB3  ALA   4           2HB      ALA   4  -5.135 -13.632  -2.788
   26    H    LEU   5           H        LEU   5  -2.060 -10.787  -3.155
   27    HA   LEU   5           HA       LEU   5  -0.227 -11.315  -1.078
   28    HB2  LEU   5           1HB      LEU   5   0.130  -9.033  -2.970
   29    HB3  LEU   5           2HB      LEU   5   1.333 -10.148  -2.326
   30    HG   LEU   5           HG       LEU   5  -0.679 -10.686  -4.505
   31   HD11  LEU   5          1HD1      LEU   5   2.207 -10.068  -4.395
   32   HD12  LEU   5          2HD1      LEU   5   1.013  -9.712  -5.643
   33   HD13  LEU   5          3HD1      LEU   5   1.710 -11.327  -5.524
   34   HD21  LEU   5          3HD2      LEU   5   0.701 -12.895  -4.581
   35   HD22  LEU   5          1HD2      LEU   5  -0.637 -12.733  -3.444
   36   HD23  LEU   5          2HD2      LEU   5   1.024 -12.531  -2.885
   37    H    PHE   6           H        PHE   6  -2.290  -8.563  -1.798
   38    HA   PHE   6           HA       PHE   6  -1.150  -6.767   0.063
   39    HB2  PHE   6           1HB      PHE   6  -2.495  -5.736  -1.540
   40    HB3  PHE   6           2HB      PHE   6  -3.786  -6.920  -1.361
   41    HD1  PHE   6           HD2      PHE   6  -5.257  -6.840   0.640
   42    HD2  PHE   6           HD1      PHE   6  -2.437  -3.773  -0.232
   43    HE1  PHE   6           HE2      PHE   6  -6.443  -5.319   2.169
   44    HE2  PHE   6           HE1      PHE   6  -3.618  -2.248   1.296
   45    HZ   PHE   6           HZ       PHE   6  -5.624  -3.020   2.498
   46    H    LYS   7           H        LYS   7  -3.971  -8.918   0.272
   47    HA   LYS   7           HA       LYS   7  -4.532  -8.267   2.992
   48    HB2  LYS   7           1HB      LYS   7  -6.456  -9.200   2.344
   49    HB3  LYS   7           2HB      LYS   7  -5.699  -9.888   0.914
   50    HG2  LYS   7           1HG      LYS   7  -4.952 -11.806   2.241
   51    HG3  LYS   7           2HG      LYS   7  -5.739 -11.118   3.663
   52    HD2  LYS   7           1HD      LYS   7  -7.334 -11.534   1.175
   53    HD3  LYS   7           2HD      LYS   7  -6.958 -12.922   2.200
   54    HE2  LYS   7           1HE      LYS   7  -7.797 -11.204   4.076
   55    HE3  LYS   7           2HE      LYS   7  -8.725 -10.601   2.703
   56    HZ1  LYS   7           3HZ      LYS   7  -8.701 -13.485   3.278
   57    HZ2  LYS   7           1HZ      LYS   7  -9.893 -12.553   2.520
   58    HZ3  LYS   7           2HZ      LYS   7  -9.691 -12.465   4.196
   59    H    GLU   8           H        GLU   8  -2.588 -10.683   1.379
   60    HA   GLU   8           HA       GLU   8  -2.234 -12.436   3.560
   61    HB2  GLU   8           1HB      GLU   8  -1.697 -13.076   1.259
   62    HB3  GLU   8           2HB      GLU   8  -0.405 -11.886   1.216
   63    HG2  GLU   8           1HG      GLU   8   0.611 -13.149   3.173
   64    HG3  GLU   8           2HG      GLU   8  -0.542 -14.428   2.798
   65    H    ILE   9           H        ILE   9  -0.303  -9.695   2.393
   66    HA   ILE   9           HA       ILE   9   1.697  -9.911   4.395
   67    HB   ILE   9           HB       ILE   9   0.911  -7.506   2.746
   68   HG12  ILE   9          1HG1      ILE   9   3.286  -9.270   2.241
   69   HG13  ILE   9          2HG1      ILE   9   1.701  -9.727   1.624
   70   HG21  ILE   9          1HG2      ILE   9   3.143  -6.661   3.267
   71   HG22  ILE   9          2HG2      ILE   9   2.191  -6.895   4.733
   72   HG23  ILE   9          3HG2      ILE   9   3.438  -8.063   4.296
   73   HD11  ILE   9          3HD1      ILE   9   2.877  -8.590  -0.101
   74   HD12  ILE   9          1HD1      ILE   9   1.597  -7.522   0.475
   75   HD13  ILE   9          2HD1      ILE   9   3.267  -7.246   0.973
   76    H    ASP  10           H        ASP  10  -1.450  -8.476   4.306
   77    HA   ASP  10           HA       ASP  10  -1.033  -6.744   6.566
   78    HB2  ASP  10           1HB      ASP  10  -3.198  -7.325   4.681
   79    HB3  ASP  10           2HB      ASP  10  -3.763  -7.045   6.326
   80    H    VAL  11           H        VAL  11  -0.171  -8.336   8.043
   81    HA   VAL  11           HA       VAL  11  -1.566 -10.611   8.908
   82    HB   VAL  11           HB       VAL  11   0.284  -8.941  10.610
   83   HG11  VAL  11          1HG1      VAL  11  -0.706 -11.763  10.706
   84   HG12  VAL  11          2HG1      VAL  11   0.847 -11.334  11.425
   85   HG13  VAL  11          3HG1      VAL  11  -0.633 -10.560  11.993
   86   HG21  VAL  11          3HG2      VAL  11   0.815 -10.605   8.238
   87   HG22  VAL  11          1HG2      VAL  11   1.747  -9.277   8.926
   88   HG23  VAL  11          2HG2      VAL  11   1.867 -10.892   9.624
   89    H    ASN  12           H        ASN  12  -2.171  -7.299   9.441
   90    HA   ASN  12           HA       ASN  12  -3.581  -7.645  11.938
   91    HB2  ASN  12           1HB      ASN  12  -4.285  -5.220  11.429
   92    HB3  ASN  12           2HB      ASN  12  -2.579  -5.529  11.741
   93   HD21  ASN  12          2HD2      ASN  12  -1.922  -3.711  10.623
   94   HD22  ASN  12          1HD2      ASN  12  -1.990  -3.608   8.899
   95    H    GLY  13           H        GLY  13  -4.284  -8.426   8.819
   96    HA2  GLY  13           1HA      GLY  13  -6.227  -8.734   7.615
   97    HA3  GLY  13           2HA      GLY  13  -6.858  -9.241   9.174
   98    H    ASP  14           H        ASP  14  -5.812  -5.994   8.260
   99    HA   ASP  14           HA       ASP  14  -8.431  -4.980   9.038
  100    HB2  ASP  14           1HB      ASP  14  -7.291  -2.735   8.770
  101    HB3  ASP  14           2HB      ASP  14  -6.619  -3.785  10.013
  102    H    GLY  15           H        GLY  15  -6.648  -5.701   6.208
  103    HA2  GLY  15           1HA      GLY  15  -7.254  -5.582   3.991
  104    HA3  GLY  15           2HA      GLY  15  -8.836  -5.025   4.515
  105    H    ALA  16           H        ALA  16  -6.480  -3.089   5.868
  106    HA   ALA  16           HA       ALA  16  -6.439  -1.229   3.598
  107    HB1  ALA  16           3HB      ALA  16  -8.149  -0.190   4.693
  108    HB2  ALA  16           1HB      ALA  16  -7.629  -0.760   6.279
  109    HB3  ALA  16           2HB      ALA  16  -6.779   0.574   5.498
  110    H    VAL  17           H        VAL  17  -4.540  -0.207   3.320
  111    HA   VAL  17           HA       VAL  17  -2.547  -0.394   5.484
  112    HB   VAL  17           HB       VAL  17  -0.790  -0.696   3.831
  113   HG11  VAL  17          1HG1      VAL  17  -1.374  -2.962   3.055
  114   HG12  VAL  17          2HG1      VAL  17  -1.801  -2.698   4.746
  115   HG13  VAL  17          3HG1      VAL  17  -3.053  -2.664   3.504
  116   HG21  VAL  17          3HG2      VAL  17  -1.828  -1.377   1.456
  117   HG22  VAL  17          1HG2      VAL  17  -3.007  -0.162   1.951
  118   HG23  VAL  17          2HG2      VAL  17  -1.298   0.262   1.841
  119    H    SER  18           H        SER  18  -1.881   1.522   6.167
  120    HA   SER  18           HA       SER  18  -2.434   3.900   4.599
  121    HB2  SER  18           1HB      SER  18  -1.106   4.748   6.865
  122    HB3  SER  18           2HB      SER  18  -2.855   4.606   6.698
  123    HG   SER  18           HG       SER  18  -2.835   2.940   7.987
  124    H    TYR  19           H        TYR  19  -0.606   5.667   4.864
  125    HA   TYR  19           HA       TYR  19   1.425   5.097   3.122
  126    HB2  TYR  19           1HB      TYR  19   2.495   7.125   3.841
  127    HB3  TYR  19           2HB      TYR  19   0.755   7.374   3.928
  128    HD1  TYR  19           HD2      TYR  19  -0.377   7.447   6.122
  129    HD2  TYR  19           HD1      TYR  19   3.857   7.173   5.810
  130    HE1  TYR  19           HE2      TYR  19  -0.164   8.138   8.474
  131    HE2  TYR  19           HE1      TYR  19   4.081   7.861   8.161
  132    HH   TYR  19           HH       TYR  19   2.328   9.356   9.815
  133    H    GLU  20           H        GLU  20   1.417   4.697   6.625
  134    HA   GLU  20           HA       GLU  20   4.175   4.016   6.832
  135    HB2  GLU  20           1HB      GLU  20   1.911   4.296   8.609
  136    HB3  GLU  20           2HB      GLU  20   2.829   2.846   8.996
  137    HG2  GLU  20           1HG      GLU  20   4.610   5.047   8.540
  138    HG3  GLU  20           2HG      GLU  20   3.393   5.482   9.739
  139    H    GLU  21           H        GLU  21   1.185   2.152   6.548
  140    HA   GLU  21           HA       GLU  21   2.303  -0.398   6.930
  141    HB2  GLU  21           1HB      GLU  21  -0.153   0.530   5.449
  142    HB3  GLU  21           2HB      GLU  21   0.269  -1.170   5.604
  143    HG2  GLU  21           1HG      GLU  21   0.413  -0.389   8.184
  144    HG3  GLU  21           2HG      GLU  21  -0.843   0.693   7.582
  145    H    VAL  22           H        VAL  22   1.589   1.378   3.929
  146    HA   VAL  22           HA       VAL  22   2.542  -0.542   2.136
  147    HB   VAL  22           HB       VAL  22   1.227   1.309   1.333
  148   HG11  VAL  22          1HG1      VAL  22   3.541   3.111   2.037
  149   HG12  VAL  22          2HG1      VAL  22   2.001   3.591   1.321
  150   HG13  VAL  22          3HG1      VAL  22   2.053   2.973   2.973
  151   HG21  VAL  22          3HG2      VAL  22   2.221   1.162  -0.651
  152   HG22  VAL  22          1HG2      VAL  22   3.562   2.170  -0.105
  153   HG23  VAL  22          2HG2      VAL  22   3.608   0.425   0.150
  154    H    LYS  23           H        LYS  23   4.217   2.119   3.763
  155    HA   LYS  23           HA       LYS  23   6.682   1.883   2.450
  156    HB2  LYS  23           1HB      LYS  23   5.681   3.593   4.282
  157    HB3  LYS  23           2HB      LYS  23   6.725   2.628   5.317
  158    HG2  LYS  23           1HG      LYS  23   7.723   3.846   2.766
  159    HG3  LYS  23           2HG      LYS  23   7.704   4.742   4.287
  160    HD2  LYS  23           1HD      LYS  23   8.991   2.036   4.044
  161    HD3  LYS  23           2HD      LYS  23   9.863   3.524   3.671
  162    HE2  LYS  23           1HE      LYS  23   8.409   3.398   6.254
  163    HE3  LYS  23           2HE      LYS  23   9.871   2.425   6.097
  164    HZ1  LYS  23           3HZ      LYS  23  11.143   4.353   5.619
  165    HZ2  LYS  23           1HZ      LYS  23  10.219   4.708   6.992
  166    HZ3  LYS  23           2HZ      LYS  23   9.765   5.325   5.484
  167    H    ALA  24           H        ALA  24   5.506   0.380   5.443
  168    HA   ALA  24           HA       ALA  24   7.887  -1.009   6.049
  169    HB1  ALA  24           3HB      ALA  24   6.640  -2.164   7.687
  170    HB2  ALA  24           1HB      ALA  24   5.947  -0.545   7.602
  171    HB3  ALA  24           2HB      ALA  24   5.123  -1.900   6.829
  172    H    PHE  25           H        PHE  25   5.030  -1.873   4.163
  173    HA   PHE  25           HA       PHE  25   5.438  -4.573   3.795
  174    HB2  PHE  25           1HB      PHE  25   4.204  -2.429   2.120
  175    HB3  PHE  25           2HB      PHE  25   4.445  -4.020   1.406
  176    HD1  PHE  25           HD2      PHE  25   3.696  -3.505   4.963
  177    HD2  PHE  25           HD1      PHE  25   2.130  -4.527   1.139
  178    HE1  PHE  25           HE2      PHE  25   1.622  -4.294   6.027
  179    HE2  PHE  25           HE1      PHE  25   0.053  -5.316   2.197
  180    HZ   PHE  25           HZ       PHE  25  -0.202  -5.202   4.644
  181    H    VAL  26           H        VAL  26   6.724  -1.921   1.798
  182    HA   VAL  26           HA       VAL  26   8.266  -3.627   0.125
  183    HB   VAL  26           HB       VAL  26   7.486  -1.068  -0.116
  184   HG11  VAL  26          1HG1      VAL  26  10.414  -0.832   0.547
  185   HG12  VAL  26          2HG1      VAL  26   9.290   0.465   0.140
  186   HG13  VAL  26          3HG1      VAL  26   9.124  -0.401   1.668
  187   HG21  VAL  26          3HG2      VAL  26   8.179  -2.353  -1.986
  188   HG22  VAL  26          1HG2      VAL  26   9.187  -0.905  -1.969
  189   HG23  VAL  26          2HG2      VAL  26   9.840  -2.441  -1.398
  190    H    SER  27           H        SER  27   8.843  -2.030   3.166
  191    HA   SER  27           HA       SER  27  11.646  -2.074   3.200
  192    HB2  SER  27           1HB      SER  27   9.553  -1.455   5.026
  193    HB3  SER  27           2HB      SER  27  10.657  -2.564   5.838
  194    HG   SER  27           HG       SER  27  11.076  -0.139   5.817
  195    H    LYS  28           H        LYS  28   9.331  -4.599   3.521
  196    HA   LYS  28           HA       LYS  28  10.971  -6.456   4.933
  197    HB2  LYS  28           1HB      LYS  28   8.356  -6.493   3.567
  198    HB3  LYS  28           2HB      LYS  28   9.209  -8.031   3.583
  199    HG2  LYS  28           1HG      LYS  28   7.633  -7.725   5.471
  200    HG3  LYS  28           2HG      LYS  28   9.297  -8.036   5.971
  201    HD2  LYS  28           1HD      LYS  28   8.661  -5.197   5.645
  202    HD3  LYS  28           2HD      LYS  28   7.720  -6.003   6.902
  203    HE2  LYS  28           1HE      LYS  28  10.510  -6.765   7.001
  204    HE3  LYS  28           2HE      LYS  28  10.312  -5.018   7.121
  205    HZ1  LYS  28           3HZ      LYS  28   9.751  -5.298   9.229
  206    HZ2  LYS  28           1HZ      LYS  28   9.833  -6.982   9.082
  207    HZ3  LYS  28           2HZ      LYS  28   8.384  -6.174   8.754
  208    H    LYS  29           H        LYS  29  11.156  -5.220   1.837
  209    HA   LYS  29           HA       LYS  29  12.437  -7.637   0.765
  210    HB2  LYS  29           1HB      LYS  29  11.796  -5.161  -0.819
  211    HB3  LYS  29           2HB      LYS  29  12.064  -6.798  -1.406
  212    HG2  LYS  29           1HG      LYS  29   9.673  -5.785   0.115
  213    HG3  LYS  29           2HG      LYS  29   9.734  -6.283  -1.577
  214    HD2  LYS  29           1HD      LYS  29  10.220  -8.071   0.806
  215    HD3  LYS  29           2HD      LYS  29   8.743  -8.019  -0.159
  216    HE2  LYS  29           1HE      LYS  29  10.261  -8.542  -2.156
  217    HE3  LYS  29           2HE      LYS  29  11.478  -8.973  -0.954
  218    HZ1  LYS  29           3HZ      LYS  29  10.252 -10.914  -1.656
  219    HZ2  LYS  29           1HZ      LYS  29   8.784 -10.194  -1.226
  220    HZ3  LYS  29           2HZ      LYS  29   9.915 -10.587  -0.032
  221    H    ARG  30           H        ARG  30  13.033  -4.415   1.845
  222    HA   ARG  30           HA       ARG  30  15.810  -4.755   1.985
  223    HB2  ARG  30           1HB      ARG  30  16.487  -3.072   0.250
  224    HB3  ARG  30           2HB      ARG  30  15.888  -4.595  -0.399
  225    HG2  ARG  30           1HG      ARG  30  13.626  -3.013  -0.225
  226    HG3  ARG  30           2HG      ARG  30  14.890  -1.903  -0.760
  227    HD2  ARG  30           1HD      ARG  30  13.973  -4.452  -2.064
  228    HD3  ARG  30           2HD      ARG  30  13.936  -2.817  -2.722
  229    HE   ARG  30           HE       ARG  30  16.577  -3.288  -2.279
  230   HH11  ARG  30          1HH1      ARG  30  14.068  -4.953  -4.024
  231   HH12  ARG  30          2HH1      ARG  30  15.149  -5.619  -5.203
  232   HH21  ARG  30          1HH2      ARG  30  18.011  -4.159  -3.825
  233   HH22  ARG  30          2HH2      ARG  30  17.392  -5.168  -5.087
  234    H    ALA  31           H        ALA  31  16.836  -2.301   1.980
  235    HA   ALA  31           HA       ALA  31  15.073  -0.781   3.789
  236    HB1  ALA  31           3HB      ALA  31  17.650  -1.819   4.238
  237    HB2  ALA  31           1HB      ALA  31  17.822  -0.067   4.125
  238    HB3  ALA  31           2HB      ALA  31  16.703  -0.771   5.293
  239    H    ILE  32           H        ILE  32  14.180   0.620   2.308
  240    HA   ILE  32           HA       ILE  32  16.046   2.573   1.149
  241    HB   ILE  32           HB       ILE  32  15.419   1.250  -0.727
  242   HG12  ILE  32          1HG1      ILE  32  14.220   2.865  -2.118
  243   HG13  ILE  32          2HG1      ILE  32  13.632   3.692  -0.680
  244   HG21  ILE  32          1HG2      ILE  32  12.913   1.022   0.691
  245   HG22  ILE  32          2HG2      ILE  32  12.660   1.437  -1.003
  246   HG23  ILE  32          3HG2      ILE  32  13.586  -0.001  -0.578
  247   HD11  ILE  32          3HD1      ILE  32  15.702   4.575  -2.030
  248   HD12  ILE  32          1HD1      ILE  32  15.634   4.693  -0.271
  249   HD13  ILE  32          2HD1      ILE  32  16.563   3.402  -1.034
  250    H    LYS  33           H        LYS  33  15.645   4.272   2.450
  251    HA   LYS  33           HA       LYS  33  12.984   4.919   3.345
  252    HB2  LYS  33           1HB      LYS  33  14.117   6.917   4.352
  253    HB3  LYS  33           2HB      LYS  33  14.774   5.369   4.866
  254    HG2  LYS  33           1HG      LYS  33  16.793   5.911   4.137
  255    HG3  LYS  33           2HG      LYS  33  16.166   6.327   2.540
  256    HD2  LYS  33           1HD      LYS  33  16.181   8.529   2.982
  257    HD3  LYS  33           2HD      LYS  33  15.546   8.299   4.613
  258    HE2  LYS  33           1HE      LYS  33  17.756   7.689   5.411
  259    HE3  LYS  33           2HE      LYS  33  18.407   7.824   3.778
  260    HZ1  LYS  33           3HZ      LYS  33  18.829   9.935   4.243
  261    HZ2  LYS  33           1HZ      LYS  33  17.994   9.859   5.712
  262    HZ3  LYS  33           2HZ      LYS  33  17.164  10.227   4.285
  263    H    ASN  34           H        ASN  34  11.611   5.664   1.844
  264    HA   ASN  34           HA       ASN  34  12.517   7.912   0.167
  265    HB2  ASN  34           1HB      ASN  34  10.588   5.697  -0.558
  266    HB3  ASN  34           2HB      ASN  34  10.871   7.129  -1.543
  267   HD21  ASN  34          2HD2      ASN  34  11.260   4.553  -2.482
  268   HD22  ASN  34          1HD2      ASN  34  12.946   4.313  -2.776
  269    H    GLU  35           H        GLU  35  11.710   9.614   1.275
  270    HA   GLU  35           HA       GLU  35   9.145   9.569   2.543
  271    HB2  GLU  35           1HB      GLU  35  11.412  11.381   2.369
  272    HB3  GLU  35           2HB      GLU  35   9.880  12.239   2.268
  273    HG2  GLU  35           1HG      GLU  35   9.631  10.360   4.352
  274    HG3  GLU  35           2HG      GLU  35  11.189  11.159   4.556
  275    H    GLN  36           H        GLN  36  10.444  10.979  -0.432
  276    HA   GLN  36           HA       GLN  36   7.983  12.232  -1.173
  277    HB2  GLN  36           1HB      GLN  36   9.950  13.217  -2.046
  278    HB3  GLN  36           2HB      GLN  36  10.554  11.676  -2.637
  279    HG2  GLN  36           1HG      GLN  36   9.494  11.886  -4.577
  280    HG3  GLN  36           2HG      GLN  36   7.991  12.375  -3.798
  281   HE21  GLN  36          2HE2      GLN  36  11.218  13.837  -3.888
  282   HE22  GLN  36          1HE2      GLN  36  10.700  15.357  -4.525
  283    H    LEU  37           H        LEU  37   9.727   9.362  -2.359
  284    HA   LEU  37           HA       LEU  37   7.882   8.544  -4.268
  285    HB2  LEU  37           1HB      LEU  37  10.261   7.640  -3.526
  286    HB3  LEU  37           2HB      LEU  37   9.270   6.475  -2.650
  287    HG   LEU  37           HG       LEU  37   8.167   5.942  -4.862
  288   HD11  LEU  37          1HD1      LEU  37   8.727   7.004  -6.731
  289   HD12  LEU  37          2HD1      LEU  37  10.450   6.791  -6.417
  290   HD13  LEU  37          3HD1      LEU  37   9.589   8.164  -5.720
  291   HD21  LEU  37          3HD2      LEU  37  10.003   4.495  -5.586
  292   HD22  LEU  37          1HD2      LEU  37   9.815   4.474  -3.833
  293   HD23  LEU  37          2HD2      LEU  37  11.121   5.404  -4.568
  294    H    LEU  38           H        LEU  38   8.068   7.709  -0.823
  295    HA   LEU  38           HA       LEU  38   5.890   5.933  -0.785
  296    HB2  LEU  38           1HB      LEU  38   7.653   6.278   0.996
  297    HB3  LEU  38           2HB      LEU  38   6.744   7.704   1.493
  298    HG   LEU  38           HG       LEU  38   6.342   5.674   2.886
  299   HD11  LEU  38          1HD1      LEU  38   4.599   7.612   2.071
  300   HD12  LEU  38          2HD1      LEU  38   4.296   6.442   3.354
  301   HD13  LEU  38          3HD1      LEU  38   3.702   6.134   1.723
  302   HD21  LEU  38          3HD2      LEU  38   6.347   4.247   0.655
  303   HD22  LEU  38          1HD2      LEU  38   4.615   4.566   0.740
  304   HD23  LEU  38          2HD2      LEU  38   5.428   3.750   2.076
  305    H    GLN  39           H        GLN  39   6.075   9.423  -0.180
  306    HA   GLN  39           HA       GLN  39   3.382   9.794   0.530
  307    HB2  GLN  39           1HB      GLN  39   5.647  11.500  -0.245
  308    HB3  GLN  39           2HB      GLN  39   4.068  12.173  -0.629
  309    HG2  GLN  39           1HG      GLN  39   5.035  11.285   2.078
  310    HG3  GLN  39           2HG      GLN  39   4.784  12.942   1.534
  311   HE21  GLN  39          2HE2      GLN  39   3.599  11.394   3.758
  312   HE22  GLN  39          1HE2      GLN  39   1.890  11.509   3.534
  313    H    LEU  40           H        LEU  40   5.007  10.294  -2.602
  314    HA   LEU  40           HA       LEU  40   2.678  10.944  -4.039
  315    HB2  LEU  40           1HB      LEU  40   5.336  10.938  -4.581
  316    HB3  LEU  40           2HB      LEU  40   4.800   9.544  -5.517
  317    HG   LEU  40           HG       LEU  40   3.849  12.391  -5.802
  318   HD11  LEU  40          1HD1      LEU  40   5.046  12.490  -7.768
  319   HD12  LEU  40          2HD1      LEU  40   5.116  10.736  -7.940
  320   HD13  LEU  40          3HD1      LEU  40   6.124  11.545  -6.740
  321   HD21  LEU  40          3HD2      LEU  40   2.728   9.822  -6.744
  322   HD22  LEU  40          1HD2      LEU  40   2.794  11.138  -7.915
  323   HD23  LEU  40          2HD2      LEU  40   1.925  11.354  -6.396
  324    H    ILE  41           H        ILE  41   4.456   7.868  -3.801
  325    HA   ILE  41           HA       ILE  41   2.728   6.347  -5.391
  326    HB   ILE  41           HB       ILE  41   4.538   5.531  -3.124
  327   HG12  ILE  41          1HG1      ILE  41   5.592   6.434  -5.183
  328   HG13  ILE  41          2HG1      ILE  41   6.000   4.746  -4.894
  329   HG21  ILE  41          1HG2      ILE  41   2.869   3.824  -4.954
  330   HG22  ILE  41          2HG2      ILE  41   4.268   3.211  -4.072
  331   HG23  ILE  41          3HG2      ILE  41   2.877   3.843  -3.190
  332   HD11  ILE  41          3HD1      ILE  41   3.648   5.005  -6.551
  333   HD12  ILE  41          1HD1      ILE  41   5.037   5.845  -7.240
  334   HD13  ILE  41          2HD1      ILE  41   5.149   4.129  -6.845
  335    H    PHE  42           H        PHE  42   2.554   7.268  -2.020
  336    HA   PHE  42           HA       PHE  42   0.605   5.435  -1.169
  337    HB2  PHE  42           1HB      PHE  42   1.776   6.650   0.503
  338    HB3  PHE  42           2HB      PHE  42   1.343   8.199  -0.215
  339    HD1  PHE  42           HD1      PHE  42  -0.746   5.238   0.642
  340    HD2  PHE  42           HD2      PHE  42   0.104   9.348   1.351
  341    HE1  PHE  42           HE1      PHE  42  -2.697   5.380   2.134
  342    HE2  PHE  42           HE2      PHE  42  -1.846   9.497   2.844
  343    HZ   PHE  42           HZ       PHE  42  -3.248   7.510   3.238
  344    H    LYS  43           H        LYS  43   0.231   8.802  -2.275
  345    HA   LYS  43           HA       LYS  43  -2.613   8.706  -2.270
  346    HB2  LYS  43           1HB      LYS  43  -0.760  10.708  -2.400
  347    HB3  LYS  43           2HB      LYS  43  -1.334  10.661  -4.063
  348    HG2  LYS  43           1HG      LYS  43  -3.604  11.017  -3.339
  349    HG3  LYS  43           2HG      LYS  43  -3.111  10.929  -1.647
  350    HD2  LYS  43           1HD      LYS  43  -2.788  13.129  -1.687
  351    HD3  LYS  43           2HD      LYS  43  -1.463  12.868  -2.823
  352    HE2  LYS  43           1HE      LYS  43  -3.323  12.812  -4.617
  353    HE3  LYS  43           2HE      LYS  43  -4.320  13.579  -3.381
  354    HZ1  LYS  43           3HZ      LYS  43  -2.937  15.001  -5.057
  355    HZ2  LYS  43           1HZ      LYS  43  -1.682  14.719  -3.958
  356    HZ3  LYS  43           2HZ      LYS  43  -3.098  15.488  -3.445
  357    H    SER  44           H        SER  44  -0.152   7.925  -4.603
  358    HA   SER  44           HA       SER  44  -1.837   7.945  -6.899
  359    HB2  SER  44           1HB      SER  44   0.909   6.953  -6.274
  360    HB3  SER  44           2HB      SER  44   0.113   6.343  -7.724
  361    HG   SER  44           HG       SER  44   0.132   9.103  -7.223
  362    H    ILE  45           H        ILE  45  -0.569   5.325  -4.850
  363    HA   ILE  45           HA       ILE  45  -1.957   3.249  -6.175
  364    HB   ILE  45           HB       ILE  45  -0.801   3.390  -3.393
  365   HG12  ILE  45          1HG1      ILE  45   0.153   2.084  -5.951
  366   HG13  ILE  45          2HG1      ILE  45   0.846   3.513  -5.189
  367   HG21  ILE  45          1HG2      ILE  45  -1.011   0.918  -3.385
  368   HG22  ILE  45          2HG2      ILE  45  -2.562   1.755  -3.357
  369   HG23  ILE  45          3HG2      ILE  45  -1.977   1.033  -4.856
  370   HD11  ILE  45          3HD1      ILE  45   0.884   0.685  -4.179
  371   HD12  ILE  45          1HD1      ILE  45   2.251   1.683  -4.673
  372   HD13  ILE  45          2HD1      ILE  45   1.360   2.074  -3.202
  373    H    ASP  46           H        ASP  46  -2.719   5.212  -3.335
  374    HA   ASP  46           HA       ASP  46  -5.121   3.816  -2.695
  375    HB2  ASP  46           1HB      ASP  46  -3.605   5.475  -1.275
  376    HB3  ASP  46           2HB      ASP  46  -4.747   6.665  -1.894
  377    H    ALA  47           H        ALA  47  -6.980   3.883  -3.750
  378    HA   ALA  47           HA       ALA  47  -7.461   5.573  -5.954
  379    HB1  ALA  47           3HB      ALA  47  -9.428   4.420  -6.241
  380    HB2  ALA  47           1HB      ALA  47  -8.492   3.261  -5.298
  381    HB3  ALA  47           2HB      ALA  47  -9.714   4.258  -4.508
  382    H    ASP  48           H        ASP  48  -8.559   5.684  -2.593
  383    HA   ASP  48           HA       ASP  48  -9.776   8.311  -3.128
  384    HB2  ASP  48           1HB      ASP  48 -11.022   7.955  -1.011
  385    HB3  ASP  48           2HB      ASP  48 -11.359   6.716  -2.215
  386    H    GLY  49           H        GLY  49  -7.174   6.735  -1.596
  387    HA2  GLY  49           1HA      GLY  49  -5.468   7.486  -0.257
  388    HA3  GLY  49           2HA      GLY  49  -5.868   9.088  -0.858
  389    H    ASN  50           H        ASN  50  -8.072   7.061   0.975
  390    HA   ASN  50           HA       ASN  50  -8.364   9.162   2.942
  391    HB2  ASN  50           1HB      ASN  50 -10.170   7.740   3.850
  392    HB3  ASN  50           2HB      ASN  50 -10.363   8.032   2.124
  393   HD21  ASN  50          2HD2      ASN  50 -11.588   5.939   3.515
  394   HD22  ASN  50          1HD2      ASN  50 -10.956   4.445   2.919
  395    H    GLY  51           H        GLY  51  -6.194   9.002   3.821
  396    HA2  GLY  51           1HA      GLY  51  -4.809   8.432   5.566
  397    HA3  GLY  51           2HA      GLY  51  -6.120   7.444   6.194
  398    H    GLU  52           H        GLU  52  -6.447   5.633   4.120
  399    HA   GLU  52           HA       GLU  52  -3.865   4.427   3.574
  400    HB2  GLU  52           1HB      GLU  52  -4.722   2.215   4.554
  401    HB3  GLU  52           2HB      GLU  52  -4.136   3.432   5.678
  402    HG2  GLU  52           1HG      GLU  52  -6.240   2.270   6.358
  403    HG3  GLU  52           2HG      GLU  52  -6.329   4.030   6.323
  404    H    ILE  53           H        ILE  53  -4.110   2.414   2.253
  405    HA   ILE  53           HA       ILE  53  -6.281   2.809   0.336
  406    HB   ILE  53           HB       ILE  53  -3.992   0.894  -0.014
  407   HG12  ILE  53          1HG1      ILE  53  -3.400   3.259  -1.414
  408   HG13  ILE  53          2HG1      ILE  53  -3.848   3.771   0.209
  409   HG21  ILE  53          1HG2      ILE  53  -6.038   2.175  -1.747
  410   HG22  ILE  53          2HG2      ILE  53  -4.459   1.817  -2.443
  411   HG23  ILE  53          3HG2      ILE  53  -5.431   0.520  -1.749
  412   HD11  ILE  53          3HD1      ILE  53  -1.456   2.417  -0.735
  413   HD12  ILE  53          1HD1      ILE  53  -1.726   3.361   0.730
  414   HD13  ILE  53          2HD1      ILE  53  -2.174   1.656   0.686
  415    H    ASP  54           H        ASP  54  -7.985   1.509   0.259
  416    HA   ASP  54           HA       ASP  54  -8.186  -0.754   2.012
  417    HB2  ASP  54           1HB      ASP  54 -10.176  -0.073  -0.139
  418    HB3  ASP  54           2HB      ASP  54 -10.461  -0.829   1.426
  419    H    GLN  55           H        GLN  55  -8.852  -2.904   1.290
  420    HA   GLN  55           HA       GLN  55  -7.066  -4.048  -0.502
  421    HB2  GLN  55           1HB      GLN  55  -8.540  -6.049  -0.409
  422    HB3  GLN  55           2HB      GLN  55  -8.156  -5.391   1.175
  423    HG2  GLN  55           1HG      GLN  55 -10.359  -4.215   1.130
  424    HG3  GLN  55           2HG      GLN  55 -10.732  -5.104  -0.347
  425   HE21  GLN  55          2HE2      GLN  55 -10.378  -5.262   3.082
  426   HE22  GLN  55          1HE2      GLN  55 -10.986  -6.866   3.287
  427    H    ASN  56           H        ASN  56 -10.431  -3.062  -1.005
  428    HA   ASN  56           HA       ASN  56 -10.759  -4.036  -3.598
  429    HB2  ASN  56           1HB      ASN  56 -12.386  -2.778  -1.868
  430    HB3  ASN  56           2HB      ASN  56 -12.026  -1.431  -2.944
  431   HD21  ASN  56          2HD2      ASN  56 -13.066  -1.292  -4.825
  432   HD22  ASN  56          1HD2      ASN  56 -14.121  -2.500  -5.467
  433    H    GLU  57           H        GLU  57  -9.696  -0.811  -2.527
  434    HA   GLU  57           HA       GLU  57  -9.304   0.295  -5.063
  435    HB2  GLU  57           1HB      GLU  57  -7.780   0.904  -2.523
  436    HB3  GLU  57           2HB      GLU  57  -7.867   1.934  -3.945
  437    HG2  GLU  57           1HG      GLU  57 -10.049   2.547  -3.537
  438    HG3  GLU  57           2HG      GLU  57 -10.378   1.117  -2.560
  439    H    PHE  58           H        PHE  58  -7.079  -1.498  -2.969
  440    HA   PHE  58           HA       PHE  58  -4.783  -1.227  -4.557
  441    HB2  PHE  58           1HB      PHE  58  -5.015  -2.130  -2.149
  442    HB3  PHE  58           2HB      PHE  58  -5.363  -3.678  -2.911
  443    HD1  PHE  58           HD1      PHE  58  -3.623  -4.473  -4.686
  444    HD2  PHE  58           HD2      PHE  58  -2.834  -1.573  -1.673
  445    HE1  PHE  58           HE1      PHE  58  -1.211  -4.911  -4.902
  446    HE2  PHE  58           HE2      PHE  58  -0.421  -2.004  -1.885
  447    HZ   PHE  58           HZ       PHE  58   0.394  -3.674  -3.502
  448    H    ALA  59           H        ALA  59  -7.282  -3.743  -4.503
  449    HA   ALA  59           HA       ALA  59  -6.159  -5.453  -6.406
  450    HB1  ALA  59           3HB      ALA  59  -7.940  -6.320  -5.163
  451    HB2  ALA  59           1HB      ALA  59  -8.991  -4.956  -5.546
  452    HB3  ALA  59           2HB      ALA  59  -8.594  -6.140  -6.791
  453    H    LYS  60           H        LYS  60  -8.530  -2.832  -6.843
  454    HA   LYS  60           HA       LYS  60  -8.765  -3.078  -9.632
  455    HB2  LYS  60           1HB      LYS  60  -9.538  -1.128  -7.580
  456    HB3  LYS  60           2HB      LYS  60  -9.244  -0.417  -9.161
  457    HG2  LYS  60           1HG      LYS  60 -11.590  -0.990  -8.864
  458    HG3  LYS  60           2HG      LYS  60 -10.859  -1.936 -10.164
  459    HD2  LYS  60           1HD      LYS  60 -10.588  -3.301  -7.642
  460    HD3  LYS  60           2HD      LYS  60 -12.277  -2.894  -7.947
  461    HE2  LYS  60           1HE      LYS  60 -11.776  -3.833 -10.330
  462    HE3  LYS  60           2HE      LYS  60 -10.425  -4.631  -9.525
  463    HZ1  LYS  60           3HZ      LYS  60 -12.903  -5.638  -9.685
  464    HZ2  LYS  60           1HZ      LYS  60 -12.965  -4.890  -8.169
  465    HZ3  LYS  60           2HZ      LYS  60 -11.784  -6.057  -8.487
  466    H    PHE  61           H        PHE  61  -6.387  -1.531  -7.622
  467    HA   PHE  61           HA       PHE  61  -5.250   0.081  -9.699
  468    HB2  PHE  61           1HB      PHE  61  -4.835   0.934  -7.567
  469    HB3  PHE  61           2HB      PHE  61  -4.442  -0.649  -6.904
  470    HD1  PHE  61           HD1      PHE  61  -3.176   1.507  -9.680
  471    HD2  PHE  61           HD2      PHE  61  -2.256  -0.889  -6.285
  472    HE1  PHE  61           HE1      PHE  61  -0.782   1.972 -10.005
  473    HE2  PHE  61           HE2      PHE  61   0.139  -0.428  -6.604
  474    HZ   PHE  61           HZ       PHE  61   0.880   1.006  -8.465
  475    H    TYR  62           H        TYR  62  -4.639  -3.104  -8.355
  476    HA   TYR  62           HA       TYR  62  -2.138  -3.582  -9.536
  477    HB2  TYR  62           1HB      TYR  62  -2.934  -5.023  -7.778
  478    HB3  TYR  62           2HB      TYR  62  -4.340  -5.489  -8.728
  479    HD1  TYR  62           HD2      TYR  62  -0.734  -5.948  -8.266
  480    HD2  TYR  62           HD1      TYR  62  -4.148  -7.105 -10.526
  481    HE1  TYR  62           HE2      TYR  62   0.519  -7.862  -9.169
  482    HE2  TYR  62           HE1      TYR  62  -2.905  -9.023 -11.435
  483    HH   TYR  62           HH       TYR  62  -0.792  -9.884 -11.710
  484    H    GLY  63           H        GLY  63  -1.618  -3.683 -11.612
  485    HA2  GLY  63           1HA      GLY  63  -1.701  -4.460 -13.806
  486    HA3  GLY  63           2HA      GLY  63  -3.282  -5.150 -13.475
  487    H    SER  64           H        SER  64  -3.310  -2.024 -12.392
  488    HA   SER  64           HA       SER  64  -4.788  -1.160 -14.756
  489    HB2  SER  64           1HB      SER  64  -5.862  -0.897 -12.557
  490    HB3  SER  64           2HB      SER  64  -4.531   0.132 -12.029
  491    HG   SER  64           HG       SER  64  -5.194   1.707 -13.379
  492    H    ILE  65           H        ILE  65  -1.804  -1.305 -14.592
  493    HA   ILE  65           HA       ILE  65  -1.029   1.500 -14.761
  494    HB   ILE  65           HB       ILE  65   0.802  -0.822 -15.284
  495   HG12  ILE  65          1HG1      ILE  65   1.268  -0.189 -12.666
  496   HG13  ILE  65          2HG1      ILE  65  -0.483  -0.038 -12.751
  497   HG21  ILE  65          1HG2      ILE  65   1.092   2.052 -14.538
  498   HG22  ILE  65          2HG2      ILE  65   2.347   0.903 -14.076
  499   HG23  ILE  65          3HG2      ILE  65   1.933   1.120 -15.777
  500   HD11  ILE  65          3HD1      ILE  65   0.381  -2.442 -14.061
  501   HD12  ILE  65          1HD1      ILE  65   1.007  -2.365 -12.414
  502   HD13  ILE  65          2HD1      ILE  65  -0.728  -2.234 -12.705
  503    H    GLN  66           H        GLN  66  -2.711  -0.132 -16.772
  504    HA   GLN  66           HA       GLN  66  -1.321  -0.479 -19.151
  505    HB2  GLN  66           1HB      GLN  66  -4.177   0.461 -18.839
  506    HB3  GLN  66           2HB      GLN  66  -3.482  -0.280 -20.273
  507    HG2  GLN  66           1HG      GLN  66  -3.446  -2.376 -19.345
  508    HG3  GLN  66           2HG      GLN  66  -3.387  -1.761 -17.694
  509   HE21  GLN  66          2HE2      GLN  66  -5.158  -2.158 -16.600
  510   HE22  GLN  66          1HE2      GLN  66  -6.764  -2.210 -17.232
  Start of MODEL    8
    1    H1   MET   1           H        MET   1  -2.113 -15.417  -6.910
    2    HA   MET   1           HA       MET   1  -1.153 -14.649  -4.455
    3    HB2  MET   1           1HB      MET   1   0.963 -15.886  -6.192
    4    HB3  MET   1           2HB      MET   1   1.370 -14.618  -5.043
    5    HG2  MET   1           1HG      MET   1   1.458 -16.095  -3.407
    6    HG3  MET   1           2HG      MET   1  -0.213 -16.564  -3.710
    7    HE1  MET   1           3HE      MET   1  -0.026 -19.700  -3.683
    8    HE2  MET   1           1HE      MET   1  -0.997 -18.381  -4.337
    9    HE3  MET   1           2HE      MET   1  -0.345 -19.614  -5.416
   10    H    ALA   2           H        ALA   2  -2.618 -13.256  -6.063
   11    HA   ALA   2           HA       ALA   2  -0.855 -11.368  -7.478
   12    HB1  ALA   2           3HB      ALA   2  -2.310 -11.850  -9.130
   13    HB2  ALA   2           1HB      ALA   2  -3.567 -12.383  -8.013
   14    HB3  ALA   2           2HB      ALA   2  -3.321 -10.661  -8.309
   15    H    GLU   3           H        GLU   3  -4.059 -11.145  -5.926
   16    HA   GLU   3           HA       GLU   3  -3.273  -8.556  -4.815
   17    HB2  GLU   3           1HB      GLU   3  -6.015  -9.808  -4.736
   18    HB3  GLU   3           2HB      GLU   3  -5.596  -8.117  -4.502
   19    HG2  GLU   3           1HG      GLU   3  -6.246  -7.911  -6.631
   20    HG3  GLU   3           2HG      GLU   3  -4.629  -8.518  -6.987
   21    H    ALA   4           H        ALA   4  -3.887 -11.814  -3.890
   22    HA   ALA   4           HA       ALA   4  -4.680 -11.590  -1.250
   23    HB1  ALA   4           3HB      ALA   4  -3.688 -13.785  -0.902
   24    HB2  ALA   4           1HB      ALA   4  -4.528 -13.718  -2.452
   25    HB3  ALA   4           2HB      ALA   4  -2.768 -13.621  -2.397
   26    H    LEU   5           H        LEU   5  -1.610 -10.872  -2.683
   27    HA   LEU   5           HA       LEU   5   0.040 -11.053  -0.417
   28    HB2  LEU   5           1HB      LEU   5   0.444  -8.966  -2.521
   29    HB3  LEU   5           2HB      LEU   5   1.647  -9.909  -1.644
   30    HG   LEU   5           HG       LEU   5  -0.112 -10.838  -3.909
   31   HD11  LEU   5          1HD1      LEU   5   1.605 -10.282  -5.190
   32   HD12  LEU   5          2HD1      LEU   5   2.647 -11.367  -4.269
   33   HD13  LEU   5          3HD1      LEU   5   2.479  -9.681  -3.781
   34   HD21  LEU   5          3HD2      LEU   5   1.405 -12.937  -3.586
   35   HD22  LEU   5          1HD2      LEU   5  -0.057 -12.743  -2.618
   36   HD23  LEU   5          2HD2      LEU   5   1.518 -12.359  -1.923
   37    H    PHE   6           H        PHE   6  -1.977  -8.430  -1.649
   38    HA   PHE   6           HA       PHE   6  -1.115  -6.411   0.091
   39    HB2  PHE   6           1HB      PHE   6  -2.419  -5.667  -1.701
   40    HB3  PHE   6           2HB      PHE   6  -3.657  -6.889  -1.432
   41    HD1  PHE   6           HD1      PHE   6  -5.191  -6.655   0.533
   42    HD2  PHE   6           HD2      PHE   6  -2.563  -3.545  -0.707
   43    HE1  PHE   6           HE1      PHE   6  -6.525  -5.025   1.805
   44    HE2  PHE   6           HE2      PHE   6  -3.892  -1.911   0.564
   45    HZ   PHE   6           HZ       PHE   6  -5.876  -2.650   1.822
   46    H    LYS   7           H        LYS   7  -3.790  -8.726   0.402
   47    HA   LYS   7           HA       LYS   7  -4.542  -7.803   3.003
   48    HB2  LYS   7           1HB      LYS   7  -5.261 -10.270   1.421
   49    HB3  LYS   7           2HB      LYS   7  -5.913  -9.935   3.019
   50    HG2  LYS   7           1HG      LYS   7  -6.792  -7.776   2.116
   51    HG3  LYS   7           2HG      LYS   7  -6.297  -8.319   0.512
   52    HD2  LYS   7           1HD      LYS   7  -7.924  -9.927   0.404
   53    HD3  LYS   7           2HD      LYS   7  -7.974 -10.145   2.155
   54    HE2  LYS   7           1HE      LYS   7  -8.851  -7.608   1.973
   55    HE3  LYS   7           2HE      LYS   7  -9.427  -8.237   0.431
   56    HZ1  LYS   7           3HZ      LYS   7 -11.121  -8.554   2.057
   57    HZ2  LYS   7           1HZ      LYS   7 -10.047  -9.296   3.132
   58    HZ3  LYS   7           2HZ      LYS   7 -10.475 -10.075   1.694
   59    H    GLU   8           H        GLU   8  -2.304 -10.144   1.761
   60    HA   GLU   8           HA       GLU   8  -2.023 -11.735   4.079
   61    HB2  GLU   8           1HB      GLU   8  -1.226 -12.345   1.780
   62    HB3  GLU   8           2HB      GLU   8   0.079 -11.184   1.980
   63    HG2  GLU   8           1HG      GLU   8   1.258 -12.893   2.768
   64    HG3  GLU   8           2HG      GLU   8   0.303 -12.712   4.238
   65    H    ILE   9           H        ILE   9  -0.357  -8.829   2.950
   66    HA   ILE   9           HA       ILE   9   1.564  -8.758   5.037
   67    HB   ILE   9           HB       ILE   9   0.527  -6.542   3.268
   68   HG12  ILE   9          1HG1      ILE   9   1.679  -8.405   2.104
   69   HG13  ILE   9          2HG1      ILE   9   2.569  -6.891   1.996
   70   HG21  ILE   9          1HG2      ILE   9   1.431  -5.487   5.183
   71   HG22  ILE   9          2HG2      ILE   9   2.798  -6.600   5.238
   72   HG23  ILE   9          3HG2      ILE   9   2.682  -5.409   3.941
   73   HD11  ILE   9          3HD1      ILE   9   4.096  -7.630   3.714
   74   HD12  ILE   9          1HD1      ILE   9   3.172  -9.118   3.926
   75   HD13  ILE   9          2HD1      ILE   9   4.024  -8.815   2.411
   76    H    ASP  10           H        ASP  10  -1.752  -7.844   4.840
   77    HA   ASP  10           HA       ASP  10  -1.673  -6.032   7.083
   78    HB2  ASP  10           1HB      ASP  10  -3.683  -6.966   5.150
   79    HB3  ASP  10           2HB      ASP  10  -4.315  -6.671   6.768
   80    H    VAL  11           H        VAL  11  -0.624  -7.528   8.571
   81    HA   VAL  11           HA       VAL  11  -1.739  -9.955   9.414
   82    HB   VAL  11           HB       VAL  11  -0.169  -8.058  11.159
   83   HG11  VAL  11          1HG1      VAL  11   0.656 -10.557  11.780
   84   HG12  VAL  11          2HG1      VAL  11  -0.639  -9.704  12.623
   85   HG13  VAL  11          3HG1      VAL  11  -1.026 -10.866  11.353
   86   HG21  VAL  11          3HG2      VAL  11   0.670  -9.768   8.874
   87   HG22  VAL  11          1HG2      VAL  11   1.281  -8.198   9.397
   88   HG23  VAL  11          2HG2      VAL  11   1.738  -9.658  10.273
   89    H    ASN  12           H        ASN  12  -2.757  -6.735   9.947
   90    HA   ASN  12           HA       ASN  12  -4.196  -7.283  12.391
   91    HB2  ASN  12           1HB      ASN  12  -5.164  -4.948  11.881
   92    HB3  ASN  12           2HB      ASN  12  -3.447  -5.062  12.258
   93   HD21  ASN  12          2HD2      ASN  12  -3.127  -3.077  11.189
   94   HD22  ASN  12          1HD2      ASN  12  -3.077  -2.990   9.464
   95    H    GLY  13           H        GLY  13  -4.699  -8.150   9.275
   96    HA2  GLY  13           1HA      GLY  13  -6.535  -8.761   8.034
   97    HA3  GLY  13           2HA      GLY  13  -7.236  -9.165   9.594
   98    H    ASP  14           H        ASP  14  -6.369  -6.019   8.187
   99    HA   ASP  14           HA       ASP  14  -9.131  -5.145   8.690
  100    HB2  ASP  14           1HB      ASP  14  -8.168  -2.833   8.570
  101    HB3  ASP  14           2HB      ASP  14  -7.533  -3.809   9.891
  102    H    GLY  15           H        GLY  15  -6.916  -5.887   6.219
  103    HA2  GLY  15           1HA      GLY  15  -7.170  -5.891   3.931
  104    HA3  GLY  15           2HA      GLY  15  -8.830  -5.367   4.176
  105    H    ALA  16           H        ALA  16  -6.530  -3.380   5.692
  106    HA   ALA  16           HA       ALA  16  -6.424  -1.553   3.396
  107    HB1  ALA  16           3HB      ALA  16  -6.728   0.253   5.334
  108    HB2  ALA  16           1HB      ALA  16  -8.089  -0.426   4.442
  109    HB3  ALA  16           2HB      ALA  16  -7.672  -1.061   6.034
  110    H    VAL  17           H        VAL  17  -4.521  -0.514   3.139
  111    HA   VAL  17           HA       VAL  17  -2.528  -0.768   5.298
  112    HB   VAL  17           HB       VAL  17  -0.777  -1.000   3.605
  113   HG11  VAL  17          1HG1      VAL  17  -1.070  -3.259   3.243
  114   HG12  VAL  17          2HG1      VAL  17  -2.206  -2.961   4.562
  115   HG13  VAL  17          3HG1      VAL  17  -2.792  -3.090   2.902
  116   HG21  VAL  17          3HG2      VAL  17  -3.019  -0.425   1.796
  117   HG22  VAL  17          1HG2      VAL  17  -1.295  -0.115   1.603
  118   HG23  VAL  17          2HG2      VAL  17  -1.946  -1.718   1.262
  119    H    SER  18           H        SER  18  -1.824   1.118   6.026
  120    HA   SER  18           HA       SER  18  -2.376   3.546   4.534
  121    HB2  SER  18           1HB      SER  18  -1.019   4.314   6.814
  122    HB3  SER  18           2HB      SER  18  -2.772   4.197   6.655
  123    HG   SER  18           HG       SER  18  -2.682   2.127   7.511
  124    H    TYR  19           H        TYR  19  -0.534   5.291   4.828
  125    HA   TYR  19           HA       TYR  19   1.484   4.741   3.060
  126    HB2  TYR  19           1HB      TYR  19   2.556   6.758   3.791
  127    HB3  TYR  19           2HB      TYR  19   0.818   7.007   3.911
  128    HD1  TYR  19           HD1      TYR  19  -0.279   7.006   6.137
  129    HD2  TYR  19           HD2      TYR  19   3.952   6.817   5.726
  130    HE1  TYR  19           HE1      TYR  19  -0.027   7.657   8.495
  131    HE2  TYR  19           HE2      TYR  19   4.216   7.466   8.084
  132    HH   TYR  19           HH       TYR  19   3.181   7.918   9.996
  133    H    GLU  20           H        GLU  20   1.482   4.276   6.552
  134    HA   GLU  20           HA       GLU  20   4.240   3.604   6.756
  135    HB2  GLU  20           1HB      GLU  20   1.928   3.733   8.526
  136    HB3  GLU  20           2HB      GLU  20   2.977   2.372   8.895
  137    HG2  GLU  20           1HG      GLU  20   4.808   4.327   8.624
  138    HG3  GLU  20           2HG      GLU  20   3.433   5.256   9.218
  139    H    GLU  21           H        GLU  21   1.271   1.730   6.373
  140    HA   GLU  21           HA       GLU  21   2.398  -0.825   6.704
  141    HB2  GLU  21           1HB      GLU  21  -0.047   0.144   5.233
  142    HB3  GLU  21           2HB      GLU  21   0.388  -1.558   5.304
  143    HG2  GLU  21           1HG      GLU  21   0.503  -0.915   7.921
  144    HG3  GLU  21           2HG      GLU  21  -0.752   0.192   7.368
  145    H    VAL  22           H        VAL  22   1.731   1.045   3.749
  146    HA   VAL  22           HA       VAL  22   2.733  -0.828   1.921
  147    HB   VAL  22           HB       VAL  22   1.387   1.005   1.136
  148   HG11  VAL  22          1HG1      VAL  22   2.117   2.658   2.818
  149   HG12  VAL  22          2HG1      VAL  22   3.638   2.844   1.944
  150   HG13  VAL  22          3HG1      VAL  22   2.118   3.309   1.179
  151   HG21  VAL  22          3HG2      VAL  22   3.800   0.207  -0.030
  152   HG22  VAL  22          1HG2      VAL  22   2.415   0.947  -0.833
  153   HG23  VAL  22          2HG2      VAL  22   3.732   1.957  -0.236
  154    H    LYS  23           H        LYS  23   4.324   1.834   3.627
  155    HA   LYS  23           HA       LYS  23   6.808   1.698   2.344
  156    HB2  LYS  23           1HB      LYS  23   5.746   3.318   4.225
  157    HB3  LYS  23           2HB      LYS  23   6.804   2.342   5.236
  158    HG2  LYS  23           1HG      LYS  23   7.785   3.692   2.742
  159    HG3  LYS  23           2HG      LYS  23   7.749   4.507   4.308
  160    HD2  LYS  23           1HD      LYS  23   9.073   1.835   3.966
  161    HD3  LYS  23           2HD      LYS  23   9.925   3.337   3.599
  162    HE2  LYS  23           1HE      LYS  23   8.537   2.962   6.227
  163    HE3  LYS  23           2HE      LYS  23  10.152   2.307   5.960
  164    HZ1  LYS  23           3HZ      LYS  23   9.412   4.948   6.575
  165    HZ2  LYS  23           1HZ      LYS  23  10.159   4.940   5.057
  166    HZ3  LYS  23           2HZ      LYS  23  10.965   4.302   6.401
  167    H    ALA  24           H        ALA  24   5.663   0.090   5.299
  168    HA   ALA  24           HA       ALA  24   8.063  -1.268   5.875
  169    HB1  ALA  24           3HB      ALA  24   6.284  -2.883   7.023
  170    HB2  ALA  24           1HB      ALA  24   6.711  -1.309   7.696
  171    HB3  ALA  24           2HB      ALA  24   5.240  -1.490   6.740
  172    H    PHE  25           H        PHE  25   5.261  -2.135   3.912
  173    HA   PHE  25           HA       PHE  25   5.743  -4.811   3.460
  174    HB2  PHE  25           1HB      PHE  25   3.759  -3.528   2.652
  175    HB3  PHE  25           2HB      PHE  25   4.769  -2.839   1.386
  176    HD1  PHE  25           HD1      PHE  25   5.701  -6.174   2.112
  177    HD2  PHE  25           HD2      PHE  25   2.858  -3.840  -0.029
  178    HE1  PHE  25           HE1      PHE  25   5.205  -8.105   0.671
  179    HE2  PHE  25           HE2      PHE  25   2.357  -5.768  -1.473
  180    HZ   PHE  25           HZ       PHE  25   3.531  -7.904  -1.123
  181    H    VAL  26           H        VAL  26   6.978  -2.061   1.565
  182    HA   VAL  26           HA       VAL  26   8.593  -3.669  -0.138
  183    HB   VAL  26           HB       VAL  26   7.742  -1.125  -0.308
  184   HG11  VAL  26          1HG1      VAL  26  10.654  -0.825   0.399
  185   HG12  VAL  26          2HG1      VAL  26   9.494   0.450   0.022
  186   HG13  VAL  26          3HG1      VAL  26   9.338  -0.471   1.518
  187   HG21  VAL  26          3HG2      VAL  26   8.795  -2.697  -2.033
  188   HG22  VAL  26          1HG2      VAL  26   8.990  -0.963  -2.282
  189   HG23  VAL  26          2HG2      VAL  26  10.322  -1.914  -1.626
  190    H    SER  27           H        SER  27   9.081  -2.156   2.963
  191    HA   SER  27           HA       SER  27  11.894  -2.152   3.017
  192    HB2  SER  27           1HB      SER  27   9.728  -2.014   5.056
  193    HB3  SER  27           2HB      SER  27  11.349  -2.421   5.620
  194    HG   SER  27           HG       SER  27  10.354  -0.032   4.815
  195    H    LYS  28           H        LYS  28   9.595  -4.694   3.292
  196    HA   LYS  28           HA       LYS  28  11.225  -6.544   4.727
  197    HB2  LYS  28           1HB      LYS  28   8.693  -6.715   3.147
  198    HB3  LYS  28           2HB      LYS  28   9.546  -8.200   3.547
  199    HG2  LYS  28           1HG      LYS  28   9.358  -7.742   5.894
  200    HG3  LYS  28           2HG      LYS  28   8.668  -6.151   5.569
  201    HD2  LYS  28           1HD      LYS  28   6.752  -7.262   4.454
  202    HD3  LYS  28           2HD      LYS  28   7.431  -8.825   4.916
  203    HE2  LYS  28           1HE      LYS  28   7.408  -7.448   7.290
  204    HE3  LYS  28           2HE      LYS  28   5.937  -6.881   6.503
  205    HZ1  LYS  28           3HZ      LYS  28   6.295  -9.261   7.855
  206    HZ2  LYS  28           1HZ      LYS  28   6.195  -9.688   6.221
  207    HZ3  LYS  28           2HZ      LYS  28   4.948  -8.800   6.941
  208    H    LYS  29           H        LYS  29  11.465  -5.291   1.646
  209    HA   LYS  29           HA       LYS  29  12.801  -7.694   0.603
  210    HB2  LYS  29           1HB      LYS  29  12.085  -5.263  -1.020
  211    HB3  LYS  29           2HB      LYS  29  12.420  -6.894  -1.586
  212    HG2  LYS  29           1HG      LYS  29   9.981  -5.955  -0.096
  213    HG3  LYS  29           2HG      LYS  29  10.075  -6.475  -1.781
  214    HD2  LYS  29           1HD      LYS  29  10.611  -8.209   0.632
  215    HD3  LYS  29           2HD      LYS  29   9.139  -8.226  -0.343
  216    HE2  LYS  29           1HE      LYS  29  10.874  -8.623  -2.299
  217    HE3  LYS  29           2HE      LYS  29  11.861  -9.245  -0.978
  218    HZ1  LYS  29           3HZ      LYS  29  10.754 -11.138  -1.211
  219    HZ2  LYS  29           1HZ      LYS  29   9.639 -10.449  -2.282
  220    HZ3  LYS  29           2HZ      LYS  29   9.377 -10.358  -0.613
  221    H    ARG  30           H        ARG  30  13.300  -4.471   1.692
  222    HA   ARG  30           HA       ARG  30  16.091  -4.724   1.799
  223    HB2  ARG  30           1HB      ARG  30  16.692  -2.986   0.093
  224    HB3  ARG  30           2HB      ARG  30  16.131  -4.509  -0.582
  225    HG2  ARG  30           1HG      ARG  30  13.823  -3.006  -0.348
  226    HG3  ARG  30           2HG      ARG  30  15.045  -1.841  -0.866
  227    HD2  ARG  30           1HD      ARG  30  14.195  -4.385  -2.226
  228    HD3  ARG  30           2HD      ARG  30  14.102  -2.735  -2.841
  229    HE   ARG  30           HE       ARG  30  16.753  -3.097  -2.462
  230   HH11  ARG  30          1HH1      ARG  30  14.307  -4.931  -4.128
  231   HH12  ARG  30          2HH1      ARG  30  15.403  -5.566  -5.311
  232   HH21  ARG  30          1HH2      ARG  30  18.206  -3.926  -4.013
  233   HH22  ARG  30          2HH2      ARG  30  17.621  -4.994  -5.243
  234    H    ALA  31           H        ALA  31  17.030  -2.232   1.829
  235    HA   ALA  31           HA       ALA  31  15.243  -0.816   3.698
  236    HB1  ALA  31           3HB      ALA  31  17.088  -1.570   4.946
  237    HB2  ALA  31           1HB      ALA  31  18.233  -1.113   3.685
  238    HB3  ALA  31           2HB      ALA  31  17.411   0.133   4.624
  239    H    ILE  32           H        ILE  32  14.270   0.581   2.265
  240    HA   ILE  32           HA       ILE  32  16.039   2.629   1.120
  241    HB   ILE  32           HB       ILE  32  15.434   1.315  -0.775
  242   HG12  ILE  32          1HG1      ILE  32  14.167   2.916  -2.119
  243   HG13  ILE  32          2HG1      ILE  32  13.564   3.692  -0.659
  244   HG21  ILE  32          1HG2      ILE  32  13.645   0.003  -0.639
  245   HG22  ILE  32          2HG2      ILE  32  12.966   0.962   0.674
  246   HG23  ILE  32          3HG2      ILE  32  12.661   1.421  -1.000
  247   HD11  ILE  32          3HD1      ILE  32  15.736   4.486  -2.095
  248   HD12  ILE  32          1HD1      ILE  32  15.413   4.909  -0.414
  249   HD13  ILE  32          2HD1      ILE  32  16.473   3.551  -0.793
  250    H    LYS  33           H        LYS  33  15.590   4.283   2.462
  251    HA   LYS  33           HA       LYS  33  12.900   4.808   3.373
  252    HB2  LYS  33           1HB      LYS  33  13.968   6.785   4.485
  253    HB3  LYS  33           2HB      LYS  33  14.660   5.232   4.938
  254    HG2  LYS  33           1HG      LYS  33  16.141   6.138   2.731
  255    HG3  LYS  33           2HG      LYS  33  15.940   7.524   3.805
  256    HD2  LYS  33           1HD      LYS  33  16.556   5.631   5.611
  257    HD3  LYS  33           2HD      LYS  33  17.425   5.001   4.210
  258    HE2  LYS  33           1HE      LYS  33  18.288   7.444   3.985
  259    HE3  LYS  33           2HE      LYS  33  17.797   7.585   5.673
  260    HZ1  LYS  33           3HZ      LYS  33  19.824   5.765   4.513
  261    HZ2  LYS  33           1HZ      LYS  33  19.187   5.538   6.064
  262    HZ3  LYS  33           2HZ      LYS  33  20.042   6.951   5.699
  263    H    ASN  34           H        ASN  34  11.527   5.596   1.896
  264    HA   ASN  34           HA       ASN  34  12.409   7.924   0.319
  265    HB2  ASN  34           1HB      ASN  34  10.843   5.511  -0.488
  266    HB3  ASN  34           2HB      ASN  34  10.469   7.050  -1.256
  267   HD21  ASN  34          2HD2      ASN  34  12.855   8.234  -1.540
  268   HD22  ASN  34          1HD2      ASN  34  13.888   7.297  -2.559
  269    H    GLU  35           H        GLU  35  11.576   9.556   1.523
  270    HA   GLU  35           HA       GLU  35   8.982   9.418   2.732
  271    HB2  GLU  35           1HB      GLU  35  11.267  11.079   2.942
  272    HB3  GLU  35           2HB      GLU  35   9.921  12.117   2.494
  273    HG2  GLU  35           1HG      GLU  35  10.159  10.339   4.900
  274    HG3  GLU  35           2HG      GLU  35  10.023  12.095   4.852
  275    H    GLN  36           H        GLN  36  10.358  11.056  -0.093
  276    HA   GLN  36           HA       GLN  36   7.904  12.334  -0.814
  277    HB2  GLN  36           1HB      GLN  36  10.442  12.846  -1.454
  278    HB3  GLN  36           2HB      GLN  36  10.022  11.860  -2.848
  279    HG2  GLN  36           1HG      GLN  36   7.937  13.738  -2.436
  280    HG3  GLN  36           2HG      GLN  36   9.476  14.597  -2.386
  281   HE21  GLN  36          2HE2      GLN  36   9.555  15.576  -4.303
  282   HE22  GLN  36          1HE2      GLN  36   9.436  14.781  -5.832
  283    H    LEU  37           H        LEU  37   9.724   9.585  -2.160
  284    HA   LEU  37           HA       LEU  37   7.946   8.895  -4.182
  285    HB2  LEU  37           1HB      LEU  37  10.319   7.939  -3.317
  286    HB3  LEU  37           2HB      LEU  37   9.242   6.657  -2.767
  287    HG   LEU  37           HG       LEU  37   8.424   6.427  -5.109
  288   HD11  LEU  37          1HD1      LEU  37   9.279   7.607  -6.870
  289   HD12  LEU  37          2HD1      LEU  37  10.800   7.951  -6.048
  290   HD13  LEU  37          3HD1      LEU  37   9.342   8.841  -5.611
  291   HD21  LEU  37          3HD2      LEU  37   9.945   4.786  -4.572
  292   HD22  LEU  37          1HD2      LEU  37  11.257   5.935  -4.312
  293   HD23  LEU  37          2HD2      LEU  37  10.736   5.548  -5.952
  294    H    LEU  38           H        LEU  38   8.108   7.646  -0.852
  295    HA   LEU  38           HA       LEU  38   5.930   5.904  -1.018
  296    HB2  LEU  38           1HB      LEU  38   7.646   6.065   0.821
  297    HB3  LEU  38           2HB      LEU  38   6.743   7.449   1.433
  298    HG   LEU  38           HG       LEU  38   6.317   5.267   2.603
  299   HD11  LEU  38          1HD1      LEU  38   4.341   6.098   3.203
  300   HD12  LEU  38          2HD1      LEU  38   3.675   5.909   1.581
  301   HD13  LEU  38          3HD1      LEU  38   4.616   7.345   1.986
  302   HD21  LEU  38          3HD2      LEU  38   5.511   3.457   1.553
  303   HD22  LEU  38          1HD2      LEU  38   6.151   4.221   0.098
  304   HD23  LEU  38          2HD2      LEU  38   4.448   4.407   0.515
  305    H    GLN  39           H        GLN  39   6.075   9.332  -0.155
  306    HA   GLN  39           HA       GLN  39   3.388   9.635   0.600
  307    HB2  GLN  39           1HB      GLN  39   5.612  11.424  -0.152
  308    HB3  GLN  39           2HB      GLN  39   4.001  12.088  -0.386
  309    HG2  GLN  39           1HG      GLN  39   4.964  10.891   2.198
  310    HG3  GLN  39           2HG      GLN  39   5.041  12.610   1.814
  311   HE21  GLN  39          2HE2      GLN  39   3.367  10.491   3.534
  312   HE22  GLN  39          1HE2      GLN  39   1.791  11.197   3.486
  313    H    LEU  40           H        LEU  40   4.973  10.317  -2.518
  314    HA   LEU  40           HA       LEU  40   2.622  11.033  -3.890
  315    HB2  LEU  40           1HB      LEU  40   5.270  11.081  -4.464
  316    HB3  LEU  40           2HB      LEU  40   4.740   9.727  -5.461
  317    HG   LEU  40           HG       LEU  40   3.770  12.579  -5.600
  318   HD11  LEU  40          1HD1      LEU  40   5.611  12.709  -6.880
  319   HD12  LEU  40          2HD1      LEU  40   4.607  11.890  -8.077
  320   HD13  LEU  40          3HD1      LEU  40   5.726  10.960  -7.080
  321   HD21  LEU  40          3HD2      LEU  40   2.594  11.556  -7.693
  322   HD22  LEU  40          1HD2      LEU  40   1.838  11.433  -6.104
  323   HD23  LEU  40          2HD2      LEU  40   2.703  10.051  -6.778
  324    H    ILE  41           H        ILE  41   4.421   7.959  -3.845
  325    HA   ILE  41           HA       ILE  41   2.678   6.519  -5.494
  326    HB   ILE  41           HB       ILE  41   4.737   5.771  -3.480
  327   HG12  ILE  41          1HG1      ILE  41   5.683   4.579  -5.397
  328   HG13  ILE  41          2HG1      ILE  41   4.245   4.935  -6.347
  329   HG21  ILE  41          1HG2      ILE  41   2.565   3.954  -4.459
  330   HG22  ILE  41          2HG2      ILE  41   4.162   3.328  -4.047
  331   HG23  ILE  41          3HG2      ILE  41   3.196   4.154  -2.824
  332   HD11  ILE  41          3HD1      ILE  41   4.765   7.338  -6.157
  333   HD12  ILE  41          1HD1      ILE  41   6.253   6.917  -5.309
  334   HD13  ILE  41          2HD1      ILE  41   6.019   6.415  -6.984
  335    H    PHE  42           H        PHE  42   2.548   7.252  -2.075
  336    HA   PHE  42           HA       PHE  42   0.623   5.359  -1.300
  337    HB2  PHE  42           1HB      PHE  42   1.809   6.487   0.421
  338    HB3  PHE  42           2HB      PHE  42   1.361   8.070  -0.204
  339    HD1  PHE  42           HD2      PHE  42  -0.217   4.970   1.137
  340    HD2  PHE  42           HD1      PHE  42  -0.347   9.213   0.819
  341    HE1  PHE  42           HE2      PHE  42  -2.147   5.022   2.662
  342    HE2  PHE  42           HE1      PHE  42  -2.277   9.271   2.345
  343    HZ   PHE  42           HZ       PHE  42  -3.180   7.173   3.267
  344    H    LYS  43           H        LYS  43   0.229   8.761  -2.273
  345    HA   LYS  43           HA       LYS  43  -2.615   8.676  -2.197
  346    HB2  LYS  43           1HB      LYS  43  -0.799  10.683  -2.265
  347    HB3  LYS  43           2HB      LYS  43  -1.311  10.672  -3.948
  348    HG2  LYS  43           1HG      LYS  43  -3.711  10.640  -2.851
  349    HG3  LYS  43           2HG      LYS  43  -2.838  11.367  -1.501
  350    HD2  LYS  43           1HD      LYS  43  -1.851  12.884  -3.435
  351    HD3  LYS  43           2HD      LYS  43  -3.361  12.433  -4.228
  352    HE2  LYS  43           1HE      LYS  43  -4.577  13.755  -2.895
  353    HE3  LYS  43           2HE      LYS  43  -3.724  13.221  -1.448
  354    HZ1  LYS  43           3HZ      LYS  43  -2.052  14.855  -3.053
  355    HZ2  LYS  43           1HZ      LYS  43  -2.534  15.074  -1.446
  356    HZ3  LYS  43           2HZ      LYS  43  -3.497  15.663  -2.705
  357    H    SER  44           H        SER  44  -0.216   7.956  -4.613
  358    HA   SER  44           HA       SER  44  -1.971   8.042  -6.859
  359    HB2  SER  44           1HB      SER  44   0.759   6.841  -6.408
  360    HB3  SER  44           2HB      SER  44  -0.097   6.664  -7.939
  361    HG   SER  44           HG       SER  44   0.118   9.227  -6.859
  362    H    ILE  45           H        ILE  45  -0.626   5.382  -4.915
  363    HA   ILE  45           HA       ILE  45  -2.012   3.323  -6.269
  364    HB   ILE  45           HB       ILE  45  -0.803   3.412  -3.507
  365   HG12  ILE  45          1HG1      ILE  45   0.105   2.173  -6.114
  366   HG13  ILE  45          2HG1      ILE  45   0.806   3.586  -5.332
  367   HG21  ILE  45          1HG2      ILE  45  -0.991   0.937  -3.551
  368   HG22  ILE  45          2HG2      ILE  45  -2.547   1.761  -3.466
  369   HG23  ILE  45          3HG2      ILE  45  -1.995   1.078  -4.994
  370   HD11  ILE  45          3HD1      ILE  45   1.217   1.975  -3.352
  371   HD12  ILE  45          1HD1      ILE  45   0.994   0.712  -4.561
  372   HD13  ILE  45          2HD1      ILE  45   2.274   1.908  -4.760
  373    H    ASP  46           H        ASP  46  -2.751   5.213  -3.374
  374    HA   ASP  46           HA       ASP  46  -5.131   3.768  -2.742
  375    HB2  ASP  46           1HB      ASP  46  -3.603   5.369  -1.276
  376    HB3  ASP  46           2HB      ASP  46  -4.751   6.584  -1.832
  377    H    ALA  47           H        ALA  47  -7.009   3.869  -3.763
  378    HA   ALA  47           HA       ALA  47  -7.533   5.628  -5.896
  379    HB1  ALA  47           3HB      ALA  47  -9.748   4.268  -4.427
  380    HB2  ALA  47           1HB      ALA  47  -9.530   4.509  -6.161
  381    HB3  ALA  47           2HB      ALA  47  -8.561   3.308  -5.308
  382    H    ASP  48           H        ASP  48  -8.576   5.643  -2.514
  383    HA   ASP  48           HA       ASP  48  -9.774   8.296  -2.947
  384    HB2  ASP  48           1HB      ASP  48 -10.993   7.885  -0.823
  385    HB3  ASP  48           2HB      ASP  48 -11.360   6.688  -2.063
  386    H    GLY  49           H        GLY  49  -7.168   6.647  -1.500
  387    HA2  GLY  49           1HA      GLY  49  -5.435   7.339  -0.164
  388    HA3  GLY  49           2HA      GLY  49  -5.829   8.963  -0.705
  389    H    ASN  50           H        ASN  50  -8.025   6.895   1.092
  390    HA   ASN  50           HA       ASN  50  -8.269   8.933   3.132
  391    HB2  ASN  50           1HB      ASN  50 -10.077   7.501   4.017
  392    HB3  ASN  50           2HB      ASN  50 -10.291   7.850   2.304
  393   HD21  ASN  50          2HD2      ASN  50 -11.503   5.719   3.672
  394   HD22  ASN  50          1HD2      ASN  50 -10.899   4.241   3.010
  395    H    GLY  51           H        GLY  51  -6.087   8.723   3.970
  396    HA2  GLY  51           1HA      GLY  51  -4.683   8.083   5.675
  397    HA3  GLY  51           2HA      GLY  51  -5.995   7.090   6.292
  398    H    GLU  52           H        GLU  52  -6.374   5.350   4.164
  399    HA   GLU  52           HA       GLU  52  -3.813   4.133   3.545
  400    HB2  GLU  52           1HB      GLU  52  -4.687   1.900   4.461
  401    HB3  GLU  52           2HB      GLU  52  -4.072   3.072   5.618
  402    HG2  GLU  52           1HG      GLU  52  -6.185   1.911   6.280
  403    HG3  GLU  52           2HG      GLU  52  -6.247   3.672   6.313
  404    H    ILE  53           H        ILE  53  -4.103   2.162   2.165
  405    HA   ILE  53           HA       ILE  53  -6.299   2.644   0.294
  406    HB   ILE  53           HB       ILE  53  -4.029   0.732  -0.171
  407   HG12  ILE  53          1HG1      ILE  53  -3.445   3.159  -1.474
  408   HG13  ILE  53          2HG1      ILE  53  -3.848   3.590   0.184
  409   HG21  ILE  53          1HG2      ILE  53  -6.056   2.149  -1.837
  410   HG22  ILE  53          2HG2      ILE  53  -4.506   1.708  -2.551
  411   HG23  ILE  53          3HG2      ILE  53  -5.549   0.460  -1.873
  412   HD11  ILE  53          3HD1      ILE  53  -2.078   1.301   0.041
  413   HD12  ILE  53          1HD1      ILE  53  -1.403   2.731  -0.738
  414   HD13  ILE  53          2HD1      ILE  53  -1.918   2.806   0.947
  415    H    ASP  54           H        ASP  54  -8.010   1.355   0.202
  416    HA   ASP  54           HA       ASP  54  -8.189  -0.972   1.870
  417    HB2  ASP  54           1HB      ASP  54 -10.219  -0.227  -0.217
  418    HB3  ASP  54           2HB      ASP  54 -10.472  -1.006   1.343
  419    H    GLN  55           H        GLN  55  -8.872  -3.092   1.082
  420    HA   GLN  55           HA       GLN  55  -7.123  -4.173  -0.781
  421    HB2  GLN  55           1HB      GLN  55  -8.595  -6.174  -0.736
  422    HB3  GLN  55           2HB      GLN  55  -8.197  -5.569   0.867
  423    HG2  GLN  55           1HG      GLN  55 -10.396  -5.827   1.215
  424    HG3  GLN  55           2HG      GLN  55 -10.494  -4.250   0.436
  425   HE21  GLN  55          2HE2      GLN  55 -12.420  -4.409  -0.554
  426   HE22  GLN  55          1HE2      GLN  55 -12.811  -5.586  -1.757
  427    H    ASN  56           H        ASN  56 -10.488  -3.147  -1.192
  428    HA   ASN  56           HA       ASN  56 -10.870  -4.027  -3.812
  429    HB2  ASN  56           1HB      ASN  56 -12.412  -2.729  -1.977
  430    HB3  ASN  56           2HB      ASN  56 -12.120  -1.440  -3.142
  431   HD21  ASN  56          2HD2      ASN  56 -14.462  -3.260  -2.369
  432   HD22  ASN  56          1HD2      ASN  56 -15.074  -3.790  -3.896
  433    H    GLU  57           H        GLU  57  -9.742  -0.858  -2.646
  434    HA   GLU  57           HA       GLU  57  -9.381   0.327  -5.155
  435    HB2  GLU  57           1HB      GLU  57  -7.815   0.852  -2.623
  436    HB3  GLU  57           2HB      GLU  57  -7.932   1.928  -4.007
  437    HG2  GLU  57           1HG      GLU  57 -10.107   2.523  -3.536
  438    HG3  GLU  57           2HG      GLU  57 -10.411   1.065  -2.592
  439    H    PHE  58           H        PHE  58  -7.141  -1.536  -3.140
  440    HA   PHE  58           HA       PHE  58  -4.865  -1.236  -4.752
  441    HB2  PHE  58           1HB      PHE  58  -5.065  -2.194  -2.365
  442    HB3  PHE  58           2HB      PHE  58  -5.438  -3.722  -3.157
  443    HD1  PHE  58           HD2      PHE  58  -2.855  -1.210  -2.525
  444    HD2  PHE  58           HD1      PHE  58  -3.750  -4.944  -4.364
  445    HE1  PHE  58           HE2      PHE  58  -0.449  -1.654  -2.787
  446    HE2  PHE  58           HE1      PHE  58  -1.345  -5.394  -4.628
  447    HZ   PHE  58           HZ       PHE  58   0.308  -3.748  -3.840
  448    H    ALA  59           H        ALA  59  -7.376  -3.743  -4.722
  449    HA   ALA  59           HA       ALA  59  -6.291  -5.411  -6.683
  450    HB1  ALA  59           3HB      ALA  59  -8.025  -6.448  -5.648
  451    HB2  ALA  59           1HB      ALA  59  -8.992  -4.976  -5.546
  452    HB3  ALA  59           2HB      ALA  59  -8.885  -5.858  -7.070
  453    H    LYS  60           H        LYS  60  -8.628  -2.748  -7.020
  454    HA   LYS  60           HA       LYS  60  -8.913  -2.930  -9.812
  455    HB2  LYS  60           1HB      LYS  60  -9.270  -0.578  -7.947
  456    HB3  LYS  60           2HB      LYS  60  -9.746  -0.572  -9.641
  457    HG2  LYS  60           1HG      LYS  60 -10.792  -2.613  -7.708
  458    HG3  LYS  60           2HG      LYS  60 -11.553  -1.035  -7.913
  459    HD2  LYS  60           1HD      LYS  60 -11.009  -2.886 -10.221
  460    HD3  LYS  60           2HD      LYS  60 -12.506  -2.944  -9.289
  461    HE2  LYS  60           1HE      LYS  60 -12.201  -0.261  -9.874
  462    HE3  LYS  60           2HE      LYS  60 -11.654  -1.069 -11.342
  463    HZ1  LYS  60           3HZ      LYS  60 -14.159  -0.513 -10.999
  464    HZ2  LYS  60           1HZ      LYS  60 -14.162  -1.941 -10.090
  465    HZ3  LYS  60           2HZ      LYS  60 -13.706  -1.976 -11.718
  466    H    PHE  61           H        PHE  61  -6.488  -1.454  -7.802
  467    HA   PHE  61           HA       PHE  61  -5.360   0.185  -9.865
  468    HB2  PHE  61           1HB      PHE  61  -4.912   0.988  -7.718
  469    HB3  PHE  61           2HB      PHE  61  -4.515  -0.611  -7.098
  470    HD1  PHE  61           HD1      PHE  61  -3.274   1.454  -9.950
  471    HD2  PHE  61           HD2      PHE  61  -2.333  -0.726  -6.417
  472    HE1  PHE  61           HE1      PHE  61  -0.883   1.915 -10.305
  473    HE2  PHE  61           HE2      PHE  61   0.059  -0.267  -6.766
  474    HZ   PHE  61           HZ       PHE  61   0.786   1.056  -8.712
  475    H    TYR  62           H        TYR  62  -4.769  -3.032  -8.590
  476    HA   TYR  62           HA       TYR  62  -2.286  -3.534  -9.778
  477    HB2  TYR  62           1HB      TYR  62  -3.144  -5.025  -8.092
  478    HB3  TYR  62           2HB      TYR  62  -4.547  -5.414  -9.079
  479    HD1  TYR  62           HD2      TYR  62  -0.898  -5.863  -8.752
  480    HD2  TYR  62           HD1      TYR  62  -4.436  -7.080 -10.779
  481    HE1  TYR  62           HE2      TYR  62   0.319  -7.770  -9.720
  482    HE2  TYR  62           HE1      TYR  62  -3.230  -8.990 -11.752
  483    HH   TYR  62           HH       TYR  62  -1.115 -10.382 -11.047
  484    H    GLY  63           H        GLY  63  -1.743  -3.552 -11.849
  485    HA2  GLY  63           1HA      GLY  63  -1.809  -4.208 -14.080
  486    HA3  GLY  63           2HA      GLY  63  -3.392  -4.917 -13.796
  487    H    SER  64           H        SER  64  -3.437  -1.843 -12.571
  488    HA   SER  64           HA       SER  64  -4.897  -0.875 -14.905
  489    HB2  SER  64           1HB      SER  64  -5.995  -0.709 -12.715
  490    HB3  SER  64           2HB      SER  64  -4.665   0.283 -12.117
  491    HG   SER  64           HG       SER  64  -5.282   1.922 -13.435
  492    H    ILE  65           H        ILE  65  -1.909  -1.023 -14.710
  493    HA   ILE  65           HA       ILE  65  -1.144   1.791 -14.760
  494    HB   ILE  65           HB       ILE  65   0.272  -0.018 -13.663
  495   HG12  ILE  65          1HG1      ILE  65   1.978   1.321 -15.690
  496   HG13  ILE  65          2HG1      ILE  65   0.942   2.362 -14.722
  497   HG21  ILE  65          1HG2      ILE  65  -0.044  -1.465 -15.828
  498   HG22  ILE  65          2HG2      ILE  65   1.377  -0.578 -16.373
  499   HG23  ILE  65          3HG2      ILE  65   1.454  -1.547 -14.902
  500   HD11  ILE  65          3HD1      ILE  65   2.403   0.386 -13.156
  501   HD12  ILE  65          1HD1      ILE  65   3.437   1.519 -14.027
  502   HD13  ILE  65          2HD1      ILE  65   2.212   2.122 -12.909
  503    H    GLN  66           H        GLN  66  -2.791   0.230 -16.855
  504    HA   GLN  66           HA       GLN  66  -1.345   0.001 -19.226
  505    HB2  GLN  66           1HB      GLN  66  -4.241   0.798 -18.875
  506    HB3  GLN  66           2HB      GLN  66  -3.515   0.222 -20.370
  507    HG2  GLN  66           1HG      GLN  66  -2.977  -1.911 -19.218
  508    HG3  GLN  66           2HG      GLN  66  -3.874  -1.326 -17.818
  509   HE21  GLN  66          2HE2      GLN  66  -6.053  -0.184 -18.853
  510   HE22  GLN  66          1HE2      GLN  66  -6.998  -1.331 -19.736
  Start of MODEL    9
    1    H1   MET   1           H        MET   1  -2.401 -16.105  -6.928
    2    HA   MET   1           HA       MET   1  -1.049 -15.032  -4.539
    3    HB2  MET   1           1HB      MET   1  -0.118 -17.173  -5.633
    4    HB3  MET   1           2HB      MET   1   0.405 -16.118  -6.939
    5    HG2  MET   1           1HG      MET   1   2.245 -15.693  -5.797
    6    HG3  MET   1           2HG      MET   1   1.260 -14.889  -4.577
    7    HE1  MET   1           3HE      MET   1   3.818 -16.859  -5.259
    8    HE2  MET   1           1HE      MET   1   4.223 -16.977  -3.546
    9    HE3  MET   1           2HE      MET   1   3.769 -18.424  -4.446
   10    H    ALA   2           H        ALA   2  -2.509 -13.189  -5.564
   11    HA   ALA   2           HA       ALA   2  -0.654 -11.508  -7.088
   12    HB1  ALA   2           3HB      ALA   2  -2.023 -12.193  -8.845
   13    HB2  ALA   2           1HB      ALA   2  -3.479 -12.155  -7.851
   14    HB3  ALA   2           2HB      ALA   2  -2.717 -10.646  -8.356
   15    H    GLU   3           H        GLU   3  -3.980 -11.299  -5.806
   16    HA   GLU   3           HA       GLU   3  -3.348  -8.688  -4.673
   17    HB2  GLU   3           1HB      GLU   3  -5.706  -8.406  -4.365
   18    HB3  GLU   3           2HB      GLU   3  -5.452  -9.070  -5.973
   19    HG2  GLU   3           1HG      GLU   3  -5.775 -11.317  -4.433
   20    HG3  GLU   3           2HG      GLU   3  -6.895 -10.170  -3.701
   21    H    ALA   4           H        ALA   4  -3.812 -11.966  -3.698
   22    HA   ALA   4           HA       ALA   4  -4.622 -11.736  -1.067
   23    HB1  ALA   4           3HB      ALA   4  -4.495 -13.930  -1.501
   24    HB2  ALA   4           1HB      ALA   4  -3.178 -13.725  -2.656
   25    HB3  ALA   4           2HB      ALA   4  -2.835 -13.790  -0.927
   26    H    LEU   5           H        LEU   5  -1.575 -10.913  -2.499
   27    HA   LEU   5           HA       LEU   5   0.062 -10.972  -0.219
   28    HB2  LEU   5           1HB      LEU   5   0.408  -8.909  -2.352
   29    HB3  LEU   5           2HB      LEU   5   1.634  -9.812  -1.463
   30    HG   LEU   5           HG       LEU   5  -0.089 -10.800  -3.730
   31   HD11  LEU   5          1HD1      LEU   5   2.048  -9.381  -4.070
   32   HD12  LEU   5          2HD1      LEU   5   1.847 -10.867  -4.997
   33   HD13  LEU   5          3HD1      LEU   5   2.898 -10.846  -3.583
   34   HD21  LEU   5          3HD2      LEU   5   1.660 -12.290  -1.799
   35   HD22  LEU   5          1HD2      LEU   5   1.341 -12.897  -3.425
   36   HD23  LEU   5          2HD2      LEU   5   0.006 -12.648  -2.299
   37    H    PHE   6           H        PHE   6  -2.097  -8.499  -1.496
   38    HA   PHE   6           HA       PHE   6  -1.325  -6.382   0.172
   39    HB2  PHE   6           1HB      PHE   6  -2.693  -5.783  -1.635
   40    HB3  PHE   6           2HB      PHE   6  -3.869  -7.045  -1.284
   41    HD1  PHE   6           HD2      PHE   6  -5.360  -6.795   0.716
   42    HD2  PHE   6           HD1      PHE   6  -2.914  -3.628  -0.736
   43    HE1  PHE   6           HE2      PHE   6  -6.735  -5.171   1.951
   44    HE2  PHE   6           HE1      PHE   6  -4.285  -1.999   0.498
   45    HZ   PHE   6           HZ       PHE   6  -6.199  -2.769   1.842
   46    H    LYS   7           H        LYS   7  -3.894  -8.806   0.579
   47    HA   LYS   7           HA       LYS   7  -4.624  -7.857   3.180
   48    HB2  LYS   7           1HB      LYS   7  -6.451  -9.001   2.586
   49    HB3  LYS   7           2HB      LYS   7  -5.588  -9.808   1.283
   50    HG2  LYS   7           1HG      LYS   7  -4.764 -11.479   2.875
   51    HG3  LYS   7           2HG      LYS   7  -5.658 -10.675   4.167
   52    HD2  LYS   7           1HD      LYS   7  -7.114 -11.521   1.704
   53    HD3  LYS   7           2HD      LYS   7  -6.678 -12.740   2.904
   54    HE2  LYS   7           1HE      LYS   7  -8.113 -10.203   3.638
   55    HE3  LYS   7           2HE      LYS   7  -8.974 -11.652   3.124
   56    HZ1  LYS   7           3HZ      LYS   7  -8.928 -11.834   5.415
   57    HZ2  LYS   7           1HZ      LYS   7  -7.353 -11.232   5.551
   58    HZ3  LYS   7           2HZ      LYS   7  -7.613 -12.793   4.955
   59    H    GLU   8           H        GLU   8  -2.343 -10.149   1.926
   60    HA   GLU   8           HA       GLU   8  -1.969 -11.709   4.247
   61    HB2  GLU   8           1HB      GLU   8  -1.176 -12.313   1.955
   62    HB3  GLU   8           2HB      GLU   8   0.073 -11.085   2.110
   63    HG2  GLU   8           1HG      GLU   8   1.353 -12.723   2.894
   64    HG3  GLU   8           2HG      GLU   8   0.424 -12.563   4.383
   65    H    ILE   9           H        ILE   9  -0.382  -8.771   3.073
   66    HA   ILE   9           HA       ILE   9   1.527  -8.619   5.165
   67    HB   ILE   9           HB       ILE   9   0.451  -6.476   3.332
   68   HG12  ILE   9          1HG1      ILE   9   1.666  -8.244   2.173
   69   HG13  ILE   9          2HG1      ILE   9   2.621  -6.766   2.184
   70   HG21  ILE   9          1HG2      ILE   9   2.726  -6.390   5.304
   71   HG22  ILE   9          2HG2      ILE   9   2.493  -5.208   4.016
   72   HG23  ILE   9          3HG2      ILE   9   1.280  -5.379   5.283
   73   HD11  ILE   9          3HD1      ILE   9   3.028  -9.254   3.807
   74   HD12  ILE   9          1HD1      ILE   9   4.120  -8.511   2.639
   75   HD13  ILE   9          2HD1      ILE   9   3.822  -7.727   4.191
   76    H    ASP  10           H        ASP  10  -1.805  -7.760   4.929
   77    HA   ASP  10           HA       ASP  10  -1.768  -5.922   7.152
   78    HB2  ASP  10           1HB      ASP  10  -3.711  -6.839   5.171
   79    HB3  ASP  10           2HB      ASP  10  -4.406  -6.665   6.780
   80    H    VAL  11           H        VAL  11  -0.713  -7.402   8.657
   81    HA   VAL  11           HA       VAL  11  -1.880  -9.815   9.520
   82    HB   VAL  11           HB       VAL  11  -0.172  -7.975  11.197
   83   HG11  VAL  11          1HG1      VAL  11  -1.063 -10.797  11.399
   84   HG12  VAL  11          2HG1      VAL  11   0.584 -10.421  11.909
   85   HG13  VAL  11          3HG1      VAL  11  -0.785  -9.603  12.665
   86   HG21  VAL  11          3HG2      VAL  11   1.670  -9.569  10.295
   87   HG22  VAL  11          1HG2      VAL  11   0.540  -9.838   8.967
   88   HG23  VAL  11          2HG2      VAL  11   1.139  -8.213   9.302
   89    H    ASN  12           H        ASN  12  -2.799  -6.578  10.017
   90    HA   ASN  12           HA       ASN  12  -4.143  -7.022  12.536
   91    HB2  ASN  12           1HB      ASN  12  -5.088  -4.682  11.990
   92    HB3  ASN  12           2HB      ASN  12  -3.361  -4.822  12.312
   93   HD21  ASN  12          2HD2      ASN  12  -3.020  -2.885  11.173
   94   HD22  ASN  12          1HD2      ASN  12  -3.034  -2.847   9.447
   95    H    GLY  13           H        GLY  13  -4.792  -7.966   9.470
   96    HA2  GLY  13           1HA      GLY  13  -6.691  -8.574   8.322
   97    HA3  GLY  13           2HA      GLY  13  -7.334  -8.919   9.920
   98    H    ASP  14           H        ASP  14  -6.462  -5.830   8.397
   99    HA   ASP  14           HA       ASP  14  -9.174  -4.875   9.002
  100    HB2  ASP  14           1HB      ASP  14  -8.165  -2.594   8.724
  101    HB3  ASP  14           2HB      ASP  14  -7.487  -3.529  10.054
  102    H    GLY  15           H        GLY  15  -7.133  -5.780   6.441
  103    HA2  GLY  15           1HA      GLY  15  -7.544  -5.888   4.177
  104    HA3  GLY  15           2HA      GLY  15  -9.153  -5.257   4.495
  105    H    ALA  16           H        ALA  16  -6.711  -3.315   5.802
  106    HA   ALA  16           HA       ALA  16  -6.605  -1.618   3.407
  107    HB1  ALA  16           3HB      ALA  16  -7.701  -0.921   6.072
  108    HB2  ALA  16           1HB      ALA  16  -6.752   0.306   5.233
  109    HB3  ALA  16           2HB      ALA  16  -8.187  -0.376   4.466
  110    H    VAL  17           H        VAL  17  -4.701  -0.550   3.085
  111    HA   VAL  17           HA       VAL  17  -2.611  -0.911   5.133
  112    HB   VAL  17           HB       VAL  17  -0.957  -1.107   3.315
  113   HG11  VAL  17          1HG1      VAL  17  -1.197  -3.346   3.211
  114   HG12  VAL  17          2HG1      VAL  17  -2.527  -3.050   4.333
  115   HG13  VAL  17          3HG1      VAL  17  -2.853  -3.248   2.611
  116   HG21  VAL  17          3HG2      VAL  17  -3.336  -0.556   1.679
  117   HG22  VAL  17          1HG2      VAL  17  -1.633  -0.229   1.356
  118   HG23  VAL  17          2HG2      VAL  17  -2.291  -1.841   1.071
  119    H    SER  18           H        SER  18  -1.983   0.976   5.927
  120    HA   SER  18           HA       SER  18  -2.454   3.430   4.462
  121    HB2  SER  18           1HB      SER  18  -1.074   4.111   6.770
  122    HB3  SER  18           2HB      SER  18  -2.828   4.083   6.584
  123    HG   SER  18           HG       SER  18  -2.833   2.533   7.985
  124    H    TYR  19           H        TYR  19  -0.564   5.131   4.833
  125    HA   TYR  19           HA       TYR  19   1.429   4.620   3.036
  126    HB2  TYR  19           1HB      TYR  19   2.640   6.514   3.987
  127    HB3  TYR  19           2HB      TYR  19   0.915   6.859   3.930
  128    HD1  TYR  19           HD1      TYR  19  -0.417   6.852   6.016
  129    HD2  TYR  19           HD2      TYR  19   3.812   6.395   6.067
  130    HE1  TYR  19           HE1      TYR  19  -0.394   7.392   8.416
  131    HE2  TYR  19           HE2      TYR  19   3.848   6.934   8.466
  132    HH   TYR  19           HH       TYR  19   1.639   8.445  10.043
  133    H    GLU  20           H        GLU  20   1.486   4.016   6.518
  134    HA   GLU  20           HA       GLU  20   4.187   3.262   6.718
  135    HB2  GLU  20           1HB      GLU  20   1.804   3.145   8.394
  136    HB3  GLU  20           2HB      GLU  20   2.864   1.765   8.641
  137    HG2  GLU  20           1HG      GLU  20   4.693   3.695   8.724
  138    HG3  GLU  20           2HG      GLU  20   3.292   4.624   9.255
  139    H    GLU  21           H        GLU  21   1.255   1.292   6.288
  140    HA   GLU  21           HA       GLU  21   2.445  -1.216   6.256
  141    HB2  GLU  21           1HB      GLU  21   0.011  -0.175   4.809
  142    HB3  GLU  21           2HB      GLU  21   0.477  -1.870   4.793
  143    HG2  GLU  21           1HG      GLU  21   0.417  -0.847   7.484
  144    HG3  GLU  21           2HG      GLU  21  -1.121  -0.573   6.665
  145    H    VAL  22           H        VAL  22   1.976   1.083   3.606
  146    HA   VAL  22           HA       VAL  22   2.890  -0.546   1.515
  147    HB   VAL  22           HB       VAL  22   2.970   2.456   1.818
  148   HG11  VAL  22          1HG1      VAL  22   4.578   2.121   0.190
  149   HG12  VAL  22          2HG1      VAL  22   3.779   0.684  -0.451
  150   HG13  VAL  22          3HG1      VAL  22   3.107   2.284  -0.768
  151   HG21  VAL  22          3HG2      VAL  22   0.829   0.758   1.493
  152   HG22  VAL  22          1HG2      VAL  22   0.854   2.476   1.097
  153   HG23  VAL  22          2HG2      VAL  22   1.179   1.278  -0.155
  154    H    LYS  23           H        LYS  23   4.657   1.938   3.367
  155    HA   LYS  23           HA       LYS  23   7.156   1.562   2.209
  156    HB2  LYS  23           1HB      LYS  23   6.384   2.446   4.990
  157    HB3  LYS  23           2HB      LYS  23   8.042   2.471   4.405
  158    HG2  LYS  23           1HG      LYS  23   6.336   3.779   2.514
  159    HG3  LYS  23           2HG      LYS  23   6.081   4.455   4.124
  160    HD2  LYS  23           1HD      LYS  23   7.825   5.732   3.206
  161    HD3  LYS  23           2HD      LYS  23   8.627   4.587   4.284
  162    HE2  LYS  23           1HE      LYS  23   8.272   3.632   1.535
  163    HE3  LYS  23           2HE      LYS  23   9.319   5.041   1.688
  164    HZ1  LYS  23           3HZ      LYS  23  10.834   3.408   2.029
  165    HZ2  LYS  23           1HZ      LYS  23   9.710   2.320   2.674
  166    HZ3  LYS  23           2HZ      LYS  23  10.310   3.581   3.628
  167    H    ALA  24           H        ALA  24   5.543  -0.236   4.748
  168    HA   ALA  24           HA       ALA  24   7.804  -1.708   5.625
  169    HB1  ALA  24           3HB      ALA  24   5.898  -1.548   7.059
  170    HB2  ALA  24           1HB      ALA  24   4.853  -2.275   5.837
  171    HB3  ALA  24           2HB      ALA  24   6.105  -3.244   6.615
  172    H    PHE  25           H        PHE  25   5.232  -2.395   3.280
  173    HA   PHE  25           HA       PHE  25   5.830  -5.008   2.644
  174    HB2  PHE  25           1HB      PHE  25   4.019  -3.278   1.725
  175    HB3  PHE  25           2HB      PHE  25   5.163  -3.180   0.390
  176    HD1  PHE  25           HD1      PHE  25   6.052  -6.162   0.792
  177    HD2  PHE  25           HD2      PHE  25   2.292  -4.223   0.322
  178    HE1  PHE  25           HE1      PHE  25   5.112  -8.225  -0.164
  179    HE2  PHE  25           HE2      PHE  25   1.345  -6.282  -0.635
  180    HZ   PHE  25           HZ       PHE  25   2.755  -8.288  -0.878
  181    H    VAL  26           H        VAL  26   7.141  -2.085   1.087
  182    HA   VAL  26           HA       VAL  26   8.957  -3.505  -0.573
  183    HB   VAL  26           HB       VAL  26   8.049  -0.997  -0.656
  184   HG11  VAL  26          1HG1      VAL  26  10.827  -0.625   0.443
  185   HG12  VAL  26          2HG1      VAL  26   9.644   0.619   0.036
  186   HG13  VAL  26          3HG1      VAL  26   9.368  -0.442   1.417
  187   HG21  VAL  26          3HG2      VAL  26  10.185  -2.474  -1.921
  188   HG22  VAL  26          1HG2      VAL  26   9.035  -1.336  -2.622
  189   HG23  VAL  26          2HG2      VAL  26  10.530  -0.745  -1.898
  190    H    SER  27           H        SER  27   9.116  -2.251   2.673
  191    HA   SER  27           HA       SER  27  11.923  -2.220   2.972
  192    HB2  SER  27           1HB      SER  27   9.579  -2.180   4.802
  193    HB3  SER  27           2HB      SER  27  11.129  -2.650   5.498
  194    HG   SER  27           HG       SER  27  10.420  -0.223   4.241
  195    H    LYS  28           H        LYS  28   9.637  -4.778   2.859
  196    HA   LYS  28           HA       LYS  28  11.106  -6.708   4.353
  197    HB2  LYS  28           1HB      LYS  28   8.856  -6.886   2.362
  198    HB3  LYS  28           2HB      LYS  28   9.606  -8.331   3.027
  199    HG2  LYS  28           1HG      LYS  28   8.338  -6.153   4.674
  200    HG3  LYS  28           2HG      LYS  28   7.540  -7.655   4.202
  201    HD2  LYS  28           1HD      LYS  28  10.058  -7.443   5.852
  202    HD3  LYS  28           2HD      LYS  28   8.443  -7.782   6.479
  203    HE2  LYS  28           1HE      LYS  28   9.040  -9.933   6.246
  204    HE3  LYS  28           2HE      LYS  28   8.681  -9.674   4.539
  205    HZ1  LYS  28           3HZ      LYS  28  10.885  -9.569   3.997
  206    HZ2  LYS  28           1HZ      LYS  28  10.959 -10.663   5.285
  207    HZ3  LYS  28           2HZ      LYS  28  11.369  -9.041   5.530
  208    H    LYS  29           H        LYS  29  11.700  -5.262   1.407
  209    HA   LYS  29           HA       LYS  29  13.174  -7.589   0.376
  210    HB2  LYS  29           1HB      LYS  29  12.686  -5.047  -1.153
  211    HB3  LYS  29           2HB      LYS  29  13.052  -6.650  -1.777
  212    HG2  LYS  29           1HG      LYS  29  10.471  -5.723  -0.544
  213    HG3  LYS  29           2HG      LYS  29  10.760  -6.167  -2.227
  214    HD2  LYS  29           1HD      LYS  29  10.947  -8.022   0.147
  215    HD3  LYS  29           2HD      LYS  29   9.615  -7.956  -1.010
  216    HE2  LYS  29           1HE      LYS  29  11.715  -8.264  -2.683
  217    HE3  LYS  29           2HE      LYS  29  12.303  -9.136  -1.268
  218    HZ1  LYS  29           3HZ      LYS  29  10.132 -10.357  -1.306
  219    HZ2  LYS  29           1HZ      LYS  29  11.164 -10.688  -2.607
  220    HZ3  LYS  29           2HZ      LYS  29   9.835  -9.663  -2.820
  221    H    ARG  30           H        ARG  30  13.490  -4.160   1.172
  222    HA   ARG  30           HA       ARG  30  16.273  -4.521   1.808
  223    HB2  ARG  30           1HB      ARG  30  16.819  -2.484   0.245
  224    HB3  ARG  30           2HB      ARG  30  16.821  -4.123  -0.393
  225    HG2  ARG  30           1HG      ARG  30  15.696  -2.520  -1.876
  226    HG3  ARG  30           2HG      ARG  30  14.623  -3.810  -1.330
  227    HD2  ARG  30           1HD      ARG  30  13.359  -2.405  -0.054
  228    HD3  ARG  30           2HD      ARG  30  14.709  -1.324   0.285
  229    HE   ARG  30           HE       ARG  30  14.025  -0.051  -1.471
  230   HH11  ARG  30          1HH1      ARG  30  12.852  -3.294  -1.948
  231   HH12  ARG  30          2HH1      ARG  30  11.977  -2.904  -3.392
  232   HH21  ARG  30          1HH2      ARG  30  12.877   0.475  -3.371
  233   HH22  ARG  30          2HH2      ARG  30  11.993  -0.761  -4.201
  234    H    ALA  31           H        ALA  31  17.164  -2.006   2.029
  235    HA   ALA  31           HA       ALA  31  15.175  -0.706   3.776
  236    HB1  ALA  31           3HB      ALA  31  17.824  -1.595   4.329
  237    HB2  ALA  31           1HB      ALA  31  17.776   0.163   4.466
  238    HB3  ALA  31           2HB      ALA  31  16.665  -0.828   5.414
  239    H    ILE  32           H        ILE  32  14.338   0.764   2.339
  240    HA   ILE  32           HA       ILE  32  16.191   2.873   1.471
  241    HB   ILE  32           HB       ILE  32  13.992   1.678  -0.220
  242   HG12  ILE  32          1HG1      ILE  32  16.094   0.371  -0.149
  243   HG13  ILE  32          2HG1      ILE  32  15.789   1.055  -1.742
  244   HG21  ILE  32          1HG2      ILE  32  15.768   4.063  -0.713
  245   HG22  ILE  32          2HG2      ILE  32  14.752   3.300  -1.936
  246   HG23  ILE  32          3HG2      ILE  32  14.014   4.062  -0.527
  247   HD11  ILE  32          3HD1      ILE  32  17.680   2.176   0.313
  248   HD12  ILE  32          1HD1      ILE  32  18.134   1.231  -1.106
  249   HD13  ILE  32          2HD1      ILE  32  17.396   2.820  -1.305
  250    H    LYS  33           H        LYS  33  15.591   4.450   2.849
  251    HA   LYS  33           HA       LYS  33  12.836   4.909   3.546
  252    HB2  LYS  33           1HB      LYS  33  13.773   6.883   4.777
  253    HB3  LYS  33           2HB      LYS  33  14.467   5.336   5.242
  254    HG2  LYS  33           1HG      LYS  33  16.483   6.157   4.864
  255    HG3  LYS  33           2HG      LYS  33  16.069   6.351   3.159
  256    HD2  LYS  33           1HD      LYS  33  16.442   8.533   3.537
  257    HD3  LYS  33           2HD      LYS  33  14.836   8.511   4.269
  258    HE2  LYS  33           1HE      LYS  33  17.046   7.695   6.034
  259    HE3  LYS  33           2HE      LYS  33  17.076   9.380   5.518
  260    HZ1  LYS  33           3HZ      LYS  33  15.397   8.127   7.431
  261    HZ2  LYS  33           1HZ      LYS  33  14.465   8.862   6.225
  262    HZ3  LYS  33           2HZ      LYS  33  15.591   9.774   7.097
  263    H    ASN  34           H        ASN  34  11.542   5.718   2.013
  264    HA   ASN  34           HA       ASN  34  12.485   8.084   0.531
  265    HB2  ASN  34           1HB      ASN  34  10.672   5.859  -0.421
  266    HB3  ASN  34           2HB      ASN  34  10.932   7.362  -1.302
  267   HD21  ASN  34          2HD2      ASN  34  11.486   4.789  -2.293
  268   HD22  ASN  34          1HD2      ASN  34  13.190   4.671  -2.557
  269    H    GLU  35           H        GLU  35  11.575   9.712   1.668
  270    HA   GLU  35           HA       GLU  35   8.945   9.543   2.787
  271    HB2  GLU  35           1HB      GLU  35  10.895  11.819   2.457
  272    HB3  GLU  35           2HB      GLU  35   9.312  12.027   3.192
  273    HG2  GLU  35           1HG      GLU  35   9.859  10.564   4.981
  274    HG3  GLU  35           2HG      GLU  35  11.351  10.058   4.190
  275    H    GLN  36           H        GLN  36  10.376  11.137  -0.031
  276    HA   GLN  36           HA       GLN  36   7.964  12.416  -0.846
  277    HB2  GLN  36           1HB      GLN  36  10.548  12.772  -1.499
  278    HB3  GLN  36           2HB      GLN  36  10.038  11.802  -2.875
  279    HG2  GLN  36           1HG      GLN  36   8.054  13.749  -2.529
  280    HG3  GLN  36           2HG      GLN  36   9.597  14.581  -2.342
  281   HE21  GLN  36          2HE2      GLN  36  10.658  15.147  -4.114
  282   HE22  GLN  36          1HE2      GLN  36  10.312  14.597  -5.714
  283    H    LEU  37           H        LEU  37   9.687   9.518  -1.979
  284    HA   LEU  37           HA       LEU  37   7.876   8.803  -3.992
  285    HB2  LEU  37           1HB      LEU  37  10.234   7.891  -3.419
  286    HB3  LEU  37           2HB      LEU  37   9.362   6.765  -2.381
  287    HG   LEU  37           HG       LEU  37   8.029   6.218  -4.552
  288   HD11  LEU  37          1HD1      LEU  37   8.911   7.982  -5.939
  289   HD12  LEU  37          2HD1      LEU  37   9.429   6.420  -6.574
  290   HD13  LEU  37          3HD1      LEU  37  10.560   7.420  -5.663
  291   HD21  LEU  37          3HD2      LEU  37   9.451   4.392  -4.948
  292   HD22  LEU  37          1HD2      LEU  37   9.683   4.791  -3.245
  293   HD23  LEU  37          2HD2      LEU  37  10.884   5.287  -4.438
  294    H    LEU  38           H        LEU  38   7.977   7.974  -0.557
  295    HA   LEU  38           HA       LEU  38   5.892   6.099  -0.552
  296    HB2  LEU  38           1HB      LEU  38   7.296   6.231   1.346
  297    HB3  LEU  38           2HB      LEU  38   6.964   7.948   1.561
  298    HG   LEU  38           HG       LEU  38   5.904   6.280   3.200
  299   HD11  LEU  38          1HD1      LEU  38   4.533   7.954   3.732
  300   HD12  LEU  38          2HD1      LEU  38   3.673   7.852   2.195
  301   HD13  LEU  38          3HD1      LEU  38   5.170   8.777   2.307
  302   HD21  LEU  38          3HD2      LEU  38   3.618   6.025   1.379
  303   HD22  LEU  38          1HD2      LEU  38   4.285   4.874   2.536
  304   HD23  LEU  38          2HD2      LEU  38   5.024   5.052   0.944
  305    H    GLN  39           H        GLN  39   5.858   9.612  -0.067
  306    HA   GLN  39           HA       GLN  39   3.112   9.850   0.490
  307    HB2  GLN  39           1HB      GLN  39   5.340  11.628  -0.061
  308    HB3  GLN  39           2HB      GLN  39   3.850  12.215  -0.789
  309    HG2  GLN  39           1HG      GLN  39   4.279  11.540   2.112
  310    HG3  GLN  39           2HG      GLN  39   4.138  13.153   1.415
  311   HE21  GLN  39          2HE2      GLN  39   2.515  12.353   3.472
  312   HE22  GLN  39          1HE2      GLN  39   0.893  12.189   2.901
  313    H    LEU  40           H        LEU  40   4.897  10.271  -2.561
  314    HA   LEU  40           HA       LEU  40   2.643  10.809  -4.157
  315    HB2  LEU  40           1HB      LEU  40   5.325  10.841  -4.546
  316    HB3  LEU  40           2HB      LEU  40   4.877   9.390  -5.441
  317    HG   LEU  40           HG       LEU  40   3.901  12.202  -5.924
  318   HD11  LEU  40          1HD1      LEU  40   5.737  10.329  -7.380
  319   HD12  LEU  40          2HD1      LEU  40   6.029  11.990  -6.867
  320   HD13  LEU  40          3HD1      LEU  40   4.925  11.662  -8.201
  321   HD21  LEU  40          3HD2      LEU  40   3.106   9.638  -7.303
  322   HD22  LEU  40          1HD2      LEU  40   2.631  11.267  -7.788
  323   HD23  LEU  40          2HD2      LEU  40   2.078  10.610  -6.247
  324    H    ILE  41           H        ILE  41   4.472   7.786  -3.696
  325    HA   ILE  41           HA       ILE  41   2.839   6.167  -5.297
  326    HB   ILE  41           HB       ILE  41   5.159   5.723  -4.054
  327   HG12  ILE  41          1HG1      ILE  41   3.091   3.681  -4.876
  328   HG13  ILE  41          2HG1      ILE  41   4.380   4.358  -5.865
  329   HG21  ILE  41          1HG2      ILE  41   3.210   4.178  -2.357
  330   HG22  ILE  41          2HG2      ILE  41   4.965   4.232  -2.203
  331   HG23  ILE  41          3HG2      ILE  41   4.003   5.663  -1.835
  332   HD11  ILE  41          3HD1      ILE  41   4.951   2.121  -5.227
  333   HD12  ILE  41          1HD1      ILE  41   6.026   3.248  -4.400
  334   HD13  ILE  41          2HD1      ILE  41   4.691   2.497  -3.524
  335    H    PHE  42           H        PHE  42   2.521   7.226  -1.982
  336    HA   PHE  42           HA       PHE  42   0.598   5.364  -1.119
  337    HB2  PHE  42           1HB      PHE  42   1.703   6.686   0.529
  338    HB3  PHE  42           2HB      PHE  42   1.208   8.188  -0.246
  339    HD1  PHE  42           HD1      PHE  42  -0.363   5.122   1.193
  340    HD2  PHE  42           HD2      PHE  42  -0.501   9.351   0.736
  341    HE1  PHE  42           HE1      PHE  42  -2.347   5.212   2.647
  342    HE2  PHE  42           HE2      PHE  42  -2.484   9.448   2.189
  343    HZ   PHE  42           HZ       PHE  42  -3.408   7.377   3.148
  344    H    LYS  43           H        LYS  43   0.204   8.645  -2.441
  345    HA   LYS  43           HA       LYS  43  -2.644   8.505  -2.487
  346    HB2  LYS  43           1HB      LYS  43  -0.844  10.535  -2.661
  347    HB3  LYS  43           2HB      LYS  43  -1.318  10.374  -4.347
  348    HG2  LYS  43           1HG      LYS  43  -3.417  11.132  -3.974
  349    HG3  LYS  43           2HG      LYS  43  -3.500  10.438  -2.353
  350    HD2  LYS  43           1HD      LYS  43  -2.939  12.387  -1.441
  351    HD3  LYS  43           2HD      LYS  43  -1.486  12.479  -2.439
  352    HE2  LYS  43           1HE      LYS  43  -2.851  13.397  -4.280
  353    HE3  LYS  43           2HE      LYS  43  -4.261  13.369  -3.222
  354    HZ1  LYS  43           3HZ      LYS  43  -3.393  15.041  -1.892
  355    HZ2  LYS  43           1HZ      LYS  43  -2.964  15.542  -3.451
  356    HZ3  LYS  43           2HZ      LYS  43  -1.810  14.821  -2.447
  357    H    SER  44           H        SER  44  -0.107   7.648  -4.713
  358    HA   SER  44           HA       SER  44  -1.751   7.490  -7.039
  359    HB2  SER  44           1HB      SER  44   0.997   6.477  -6.345
  360    HB3  SER  44           2HB      SER  44   0.225   6.042  -7.870
  361    HG   SER  44           HG       SER  44   0.703   8.683  -6.943
  362    H    ILE  45           H        ILE  45  -0.404   5.034  -4.842
  363    HA   ILE  45           HA       ILE  45  -1.699   2.841  -6.071
  364    HB   ILE  45           HB       ILE  45  -0.613   3.133  -3.269
  365   HG12  ILE  45          1HG1      ILE  45   0.552   1.765  -5.703
  366   HG13  ILE  45          2HG1      ILE  45   1.027   3.360  -5.131
  367   HG21  ILE  45          1HG2      ILE  45  -0.579   0.450  -3.937
  368   HG22  ILE  45          2HG2      ILE  45  -1.694   1.238  -2.822
  369   HG23  ILE  45          3HG2      ILE  45  -2.150   1.010  -4.509
  370   HD11  ILE  45          3HD1      ILE  45   1.165   1.193  -3.147
  371   HD12  ILE  45          1HD1      ILE  45   2.306   1.095  -4.487
  372   HD13  ILE  45          2HD1      ILE  45   2.275   2.527  -3.458
  373    H    ASP  46           H        ASP  46  -2.634   5.069  -3.534
  374    HA   ASP  46           HA       ASP  46  -5.008   3.554  -2.855
  375    HB2  ASP  46           1HB      ASP  46  -3.522   5.122  -1.329
  376    HB3  ASP  46           2HB      ASP  46  -4.593   6.373  -1.955
  377    H    ALA  47           H        ALA  47  -6.866   3.697  -3.909
  378    HA   ALA  47           HA       ALA  47  -7.281   5.409  -6.100
  379    HB1  ALA  47           3HB      ALA  47  -8.390   3.198  -5.720
  380    HB2  ALA  47           1HB      ALA  47  -9.429   3.991  -4.535
  381    HB3  ALA  47           2HB      ALA  47  -9.477   4.491  -6.226
  382    H    ASP  48           H        ASP  48  -8.414   5.563  -2.748
  383    HA   ASP  48           HA       ASP  48  -9.488   8.249  -3.289
  384    HB2  ASP  48           1HB      ASP  48 -10.793   7.947  -1.201
  385    HB3  ASP  48           2HB      ASP  48 -11.163   6.725  -2.413
  386    H    GLY  49           H        GLY  49  -6.998   6.537  -1.719
  387    HA2  GLY  49           1HA      GLY  49  -5.275   7.198  -0.354
  388    HA3  GLY  49           2HA      GLY  49  -5.596   8.824  -0.940
  389    H    ASN  50           H        ASN  50  -7.918   6.879   0.835
  390    HA   ASN  50           HA       ASN  50  -8.143   8.966   2.824
  391    HB2  ASN  50           1HB      ASN  50 -10.025   7.616   3.688
  392    HB3  ASN  50           2HB      ASN  50 -10.179   7.937   1.962
  393   HD21  ASN  50          2HD2      ASN  50 -11.531   5.890   3.281
  394   HD22  ASN  50          1HD2      ASN  50 -10.951   4.375   2.687
  395    H    GLY  51           H        GLY  51  -6.002   8.705   3.738
  396    HA2  GLY  51           1HA      GLY  51  -4.673   8.055   5.499
  397    HA3  GLY  51           2HA      GLY  51  -6.032   7.109   6.088
  398    H    GLU  52           H        GLU  52  -6.397   5.335   4.001
  399    HA   GLU  52           HA       GLU  52  -3.858   4.045   3.454
  400    HB2  GLU  52           1HB      GLU  52  -4.798   1.855   4.415
  401    HB3  GLU  52           2HB      GLU  52  -4.159   3.041   5.546
  402    HG2  GLU  52           1HG      GLU  52  -6.311   1.948   6.216
  403    HG3  GLU  52           2HG      GLU  52  -6.319   3.711   6.217
  404    H    ILE  53           H        ILE  53  -4.162   2.060   2.110
  405    HA   ILE  53           HA       ILE  53  -6.325   2.535   0.202
  406    HB   ILE  53           HB       ILE  53  -4.098   0.555  -0.182
  407   HG12  ILE  53          1HG1      ILE  53  -3.415   2.923  -1.533
  408   HG13  ILE  53          2HG1      ILE  53  -3.851   3.421   0.099
  409   HG21  ILE  53          1HG2      ILE  53  -4.530   1.551  -2.591
  410   HG22  ILE  53          2HG2      ILE  53  -5.538   0.268  -1.927
  411   HG23  ILE  53          3HG2      ILE  53  -6.099   1.939  -1.887
  412   HD11  ILE  53          3HD1      ILE  53  -2.027   2.487   1.002
  413   HD12  ILE  53          1HD1      ILE  53  -2.090   1.080  -0.059
  414   HD13  ILE  53          2HD1      ILE  53  -1.396   2.593  -0.642
  415    H    ASP  54           H        ASP  54  -8.066   1.288   0.124
  416    HA   ASP  54           HA       ASP  54  -8.323  -0.991   1.848
  417    HB2  ASP  54           1HB      ASP  54 -10.301  -0.226  -0.288
  418    HB3  ASP  54           2HB      ASP  54 -10.603  -0.998   1.267
  419    H    GLN  55           H        GLN  55  -9.054  -3.112   1.103
  420    HA   GLN  55           HA       GLN  55  -7.305  -4.285  -0.708
  421    HB2  GLN  55           1HB      GLN  55  -8.874  -6.237  -0.650
  422    HB3  GLN  55           2HB      GLN  55  -8.396  -5.642   0.934
  423    HG2  GLN  55           1HG      GLN  55 -10.540  -4.368   1.015
  424    HG3  GLN  55           2HG      GLN  55 -11.015  -5.190  -0.471
  425   HE21  GLN  55          2HE2      GLN  55 -11.737  -5.204   2.574
  426   HE22  GLN  55          1HE2      GLN  55 -11.946  -6.890   2.892
  427    H    ASN  56           H        ASN  56 -10.674  -3.270  -1.184
  428    HA   ASN  56           HA       ASN  56 -10.986  -4.178  -3.806
  429    HB2  ASN  56           1HB      ASN  56 -12.584  -2.886  -2.000
  430    HB3  ASN  56           2HB      ASN  56 -12.317  -1.622  -3.198
  431   HD21  ASN  56          2HD2      ASN  56 -14.610  -3.495  -2.395
  432   HD22  ASN  56          1HD2      ASN  56 -15.192  -4.081  -3.912
  433    H    GLU  57           H        GLU  57  -9.965  -0.973  -2.636
  434    HA   GLU  57           HA       GLU  57  -9.596   0.233  -5.122
  435    HB2  GLU  57           1HB      GLU  57  -7.987   0.744  -2.615
  436    HB3  GLU  57           2HB      GLU  57  -8.191   1.846  -3.969
  437    HG2  GLU  57           1HG      GLU  57 -10.435   2.258  -3.443
  438    HG3  GLU  57           2HG      GLU  57 -10.526   0.864  -2.368
  439    H    PHE  58           H        PHE  58  -7.390  -1.729  -3.181
  440    HA   PHE  58           HA       PHE  58  -5.101  -1.365  -4.787
  441    HB2  PHE  58           1HB      PHE  58  -5.282  -2.358  -2.414
  442    HB3  PHE  58           2HB      PHE  58  -5.662  -3.875  -3.223
  443    HD1  PHE  58           HD2      PHE  58  -3.074  -1.354  -2.617
  444    HD2  PHE  58           HD1      PHE  58  -3.982  -5.101  -4.418
  445    HE1  PHE  58           HE2      PHE  58  -0.670  -1.795  -2.903
  446    HE2  PHE  58           HE1      PHE  58  -1.580  -5.549  -4.705
  447    HZ   PHE  58           HZ       PHE  58   0.080  -3.895  -3.948
  448    H    ALA  59           H        ALA  59  -7.655  -3.817  -4.816
  449    HA   ALA  59           HA       ALA  59  -6.570  -5.484  -6.789
  450    HB1  ALA  59           3HB      ALA  59  -9.289  -5.698  -7.145
  451    HB2  ALA  59           1HB      ALA  59  -8.319  -6.616  -5.992
  452    HB3  ALA  59           2HB      ALA  59  -9.145  -5.144  -5.476
  453    H    LYS  60           H        LYS  60  -8.942  -2.843  -7.109
  454    HA   LYS  60           HA       LYS  60  -9.094  -2.978  -9.931
  455    HB2  LYS  60           1HB      LYS  60  -9.893  -0.954  -7.870
  456    HB3  LYS  60           2HB      LYS  60  -9.951  -0.528  -9.576
  457    HG2  LYS  60           1HG      LYS  60 -11.656  -1.999 -10.028
  458    HG3  LYS  60           2HG      LYS  60 -11.266  -3.039  -8.657
  459    HD2  LYS  60           1HD      LYS  60 -12.564  -1.865  -7.249
  460    HD3  LYS  60           2HD      LYS  60 -12.037  -0.315  -7.909
  461    HE2  LYS  60           1HE      LYS  60 -13.643  -0.350  -9.596
  462    HE3  LYS  60           2HE      LYS  60 -13.891  -2.089  -9.454
  463    HZ1  LYS  60           3HZ      LYS  60 -14.524  -0.928  -6.996
  464    HZ2  LYS  60           1HZ      LYS  60 -15.567  -1.691  -8.088
  465    HZ3  LYS  60           2HZ      LYS  60 -15.305  -0.023  -8.193
  466    H    PHE  61           H        PHE  61  -6.852  -1.505  -7.754
  467    HA   PHE  61           HA       PHE  61  -5.762   0.327  -9.695
  468    HB2  PHE  61           1HB      PHE  61  -5.513   1.131  -7.523
  469    HB3  PHE  61           2HB      PHE  61  -5.065  -0.448  -6.884
  470    HD1  PHE  61           HD1      PHE  61  -3.765   1.838  -9.538
  471    HD2  PHE  61           HD2      PHE  61  -2.915  -0.547  -6.116
  472    HE1  PHE  61           HE1      PHE  61  -1.387   2.454  -9.702
  473    HE2  PHE  61           HE2      PHE  61  -0.538   0.064  -6.275
  474    HZ   PHE  61           HZ       PHE  61   0.229   1.567  -8.070
  475    H    TYR  62           H        TYR  62  -5.102  -2.902  -8.553
  476    HA   TYR  62           HA       TYR  62  -2.475  -3.197  -9.481
  477    HB2  TYR  62           1HB      TYR  62  -3.379  -4.845  -7.998
  478    HB3  TYR  62           2HB      TYR  62  -4.695  -5.209  -9.107
  479    HD1  TYR  62           HD2      TYR  62  -0.977  -5.323  -8.865
  480    HD2  TYR  62           HD1      TYR  62  -4.493  -6.995 -10.583
  481    HE1  TYR  62           HE2      TYR  62   0.373  -7.120  -9.866
  482    HE2  TYR  62           HE1      TYR  62  -3.153  -8.796 -11.586
  483    HH   TYR  62           HH       TYR  62  -1.135  -9.786 -11.629
  484    H    GLY  63           H        GLY  63  -1.710  -3.073 -11.478
  485    HA2  GLY  63           1HA      GLY  63  -1.508  -3.605 -13.736
  486    HA3  GLY  63           2HA      GLY  63  -3.089  -4.372 -13.669
  487    H    SER  64           H        SER  64  -3.370  -1.381 -12.281
  488    HA   SER  64           HA       SER  64  -4.594  -0.312 -14.706
  489    HB2  SER  64           1HB      SER  64  -5.934  -0.319 -12.642
  490    HB3  SER  64           2HB      SER  64  -4.719   0.681 -11.847
  491    HG   SER  64           HG       SER  64  -5.592   2.360 -12.742
  492    H    ILE  65           H        ILE  65  -1.656  -0.387 -14.236
  493    HA   ILE  65           HA       ILE  65  -0.974   2.438 -13.987
  494    HB   ILE  65           HB       ILE  65   0.989   0.242 -14.573
  495   HG12  ILE  65          1HG1      ILE  65   1.186   0.506 -11.888
  496   HG13  ILE  65          2HG1      ILE  65  -0.547   0.738 -12.090
  497   HG21  ILE  65          1HG2      ILE  65   2.514   1.829 -14.263
  498   HG22  ILE  65          2HG2      ILE  65   1.196   3.000 -14.213
  499   HG23  ILE  65          3HG2      ILE  65   1.802   2.289 -12.717
  500   HD11  ILE  65          3HD1      ILE  65   0.502  -1.539 -13.575
  501   HD12  ILE  65          1HD1      ILE  65   0.719  -1.663 -11.830
  502   HD13  ILE  65          2HD1      ILE  65  -0.893  -1.423 -12.503
  503    H    GLN  66           H        GLN  66  -2.371   1.019 -16.347
  504    HA   GLN  66           HA       GLN  66  -0.772   0.939 -18.593
  505    HB2  GLN  66           1HB      GLN  66  -3.657   1.711 -18.224
  506    HB3  GLN  66           2HB      GLN  66  -2.912   1.685 -19.817
  507    HG2  GLN  66           1HG      GLN  66  -2.466  -0.745 -18.257
  508    HG3  GLN  66           2HG      GLN  66  -4.160  -0.418 -18.621
  509   HE21  GLN  66          2HE2      GLN  66  -4.881  -0.550 -20.709
  510   HE22  GLN  66          1HE2      GLN  66  -3.925  -1.180 -22.002
  Start of MODEL   10
    1    H1   MET   1           H        MET   1  -6.006 -11.803  -7.811
    2    HA   MET   1           HA       MET   1  -4.934 -14.546  -7.767
    3    HB2  MET   1           1HB      MET   1  -5.228 -12.655 -10.086
    4    HB3  MET   1           2HB      MET   1  -4.016 -13.929 -10.102
    5    HG2  MET   1           1HG      MET   1  -6.842 -14.629  -9.486
    6    HG3  MET   1           2HG      MET   1  -6.377 -14.303 -11.154
    7    HE1  MET   1           3HE      MET   1  -7.004 -16.968  -8.730
    8    HE2  MET   1           1HE      MET   1  -7.629 -17.060 -10.378
    9    HE3  MET   1           2HE      MET   1  -6.531 -18.305  -9.781
   10    H    ALA   2           H        ALA   2  -4.148 -11.125  -8.334
   11    HA   ALA   2           HA       ALA   2  -1.485 -11.646  -7.181
   12    HB1  ALA   2           3HB      ALA   2  -1.741  -9.324  -8.969
   13    HB2  ALA   2           1HB      ALA   2  -0.439 -10.505  -8.814
   14    HB3  ALA   2           2HB      ALA   2  -1.885 -10.902  -9.744
   15    H    GLU   3           H        GLU   3  -4.093 -10.725  -5.995
   16    HA   GLU   3           HA       GLU   3  -3.166  -8.132  -4.941
   17    HB2  GLU   3           1HB      GLU   3  -5.517  -7.634  -4.429
   18    HB3  GLU   3           2HB      GLU   3  -5.270  -7.915  -6.147
   19    HG2  GLU   3           1HG      GLU   3  -5.917 -10.403  -5.001
   20    HG3  GLU   3           2HG      GLU   3  -7.050  -9.223  -4.345
   21    H    ALA   4           H        ALA   4  -3.937 -11.379  -4.215
   22    HA   ALA   4           HA       ALA   4  -4.758 -11.293  -1.573
   23    HB1  ALA   4           3HB      ALA   4  -3.448 -13.265  -3.305
   24    HB2  ALA   4           1HB      ALA   4  -3.174 -13.498  -1.578
   25    HB3  ALA   4           2HB      ALA   4  -4.819 -13.445  -2.211
   26    H    LEU   5           H        LEU   5  -1.652 -10.591  -2.932
   27    HA   LEU   5           HA       LEU   5  -0.035 -10.983  -0.667
   28    HB2  LEU   5           1HB      LEU   5   0.477  -8.791  -2.636
   29    HB3  LEU   5           2HB      LEU   5   1.631  -9.835  -1.808
   30    HG   LEU   5           HG       LEU   5  -0.140 -10.552  -4.140
   31   HD11  LEU   5          1HD1      LEU   5   1.618 -10.069  -5.399
   32   HD12  LEU   5          2HD1      LEU   5   2.642 -11.138  -4.440
   33   HD13  LEU   5          3HD1      LEU   5   2.443  -9.451  -3.967
   34   HD21  LEU   5          3HD2      LEU   5   1.424 -12.698  -3.862
   35   HD22  LEU   5          1HD2      LEU   5  -0.170 -12.574  -3.115
   36   HD23  LEU   5          2HD2      LEU   5   1.278 -12.240  -2.165
   37    H    PHE   6           H        PHE   6  -1.932  -8.212  -1.757
   38    HA   PHE   6           HA       PHE   6  -1.008  -6.351   0.133
   39    HB2  PHE   6           1HB      PHE   6  -2.207  -5.391  -1.614
   40    HB3  PHE   6           2HB      PHE   6  -3.492  -6.591  -1.526
   41    HD1  PHE   6           HD1      PHE   6  -5.149  -6.474   0.330
   42    HD2  PHE   6           HD2      PHE   6  -2.322  -3.377  -0.399
   43    HE1  PHE   6           HE1      PHE   6  -6.506  -4.924   1.676
   44    HE2  PHE   6           HE2      PHE   6  -3.673  -1.822   0.946
   45    HZ   PHE   6           HZ       PHE   6  -5.767  -2.594   1.986
   46    H    LYS   7           H        LYS   7  -3.777  -8.569   0.212
   47    HA   LYS   7           HA       LYS   7  -4.597  -7.769   2.834
   48    HB2  LYS   7           1HB      LYS   7  -5.329 -10.164   1.142
   49    HB3  LYS   7           2HB      LYS   7  -6.079  -9.785   2.687
   50    HG2  LYS   7           1HG      LYS   7  -6.776  -7.590   1.720
   51    HG3  LYS   7           2HG      LYS   7  -6.187  -8.161   0.157
   52    HD2  LYS   7           1HD      LYS   7  -7.994  -9.442  -0.170
   53    HD3  LYS   7           2HD      LYS   7  -7.950 -10.069   1.479
   54    HE2  LYS   7           1HE      LYS   7  -8.761  -7.516   1.909
   55    HE3  LYS   7           2HE      LYS   7  -9.492  -7.841   0.337
   56    HZ1  LYS   7           3HZ      LYS   7 -10.065 -10.079   1.725
   57    HZ2  LYS   7           1HZ      LYS   7 -11.114  -8.766   1.535
   58    HZ3  LYS   7           2HZ      LYS   7 -10.168  -8.897   2.930
   59    H    GLU   8           H        GLU   8  -2.391 -10.110   1.538
   60    HA   GLU   8           HA       GLU   8  -2.250 -11.819   3.795
   61    HB2  GLU   8           1HB      GLU   8  -1.444 -12.374   1.481
   62    HB3  GLU   8           2HB      GLU   8  -0.079 -11.303   1.760
   63    HG2  GLU   8           1HG      GLU   8   0.476 -12.727   3.764
   64    HG3  GLU   8           2HG      GLU   8  -0.730 -13.870   3.174
   65    H    ILE   9           H        ILE   9  -0.433  -8.954   2.808
   66    HA   ILE   9           HA       ILE   9   1.463  -9.058   4.914
   67    HB   ILE   9           HB       ILE   9   0.543  -6.741   3.212
   68   HG12  ILE   9          1HG1      ILE   9   1.679  -8.591   2.019
   69   HG13  ILE   9          2HG1      ILE   9   2.621  -7.104   1.997
   70   HG21  ILE   9          1HG2      ILE   9   2.696  -5.683   3.988
   71   HG22  ILE   9          2HG2      ILE   9   1.414  -5.781   5.194
   72   HG23  ILE   9          3HG2      ILE   9   2.757  -6.922   5.240
   73   HD11  ILE   9          3HD1      ILE   9   4.034  -7.967   3.782
   74   HD12  ILE   9          1HD1      ILE   9   3.085  -9.453   3.819
   75   HD13  ILE   9          2HD1      ILE   9   4.027  -9.045   2.386
   76    H    ASP  10           H        ASP  10  -1.804  -7.962   4.716
   77    HA   ASP  10           HA       ASP  10  -1.687  -6.242   7.015
   78    HB2  ASP  10           1HB      ASP  10  -3.916  -7.334   5.316
   79    HB3  ASP  10           2HB      ASP  10  -4.258  -6.469   6.812
   80    H    VAL  11           H        VAL  11  -0.641  -7.816   8.441
   81    HA   VAL  11           HA       VAL  11  -1.806 -10.229   9.246
   82    HB   VAL  11           HB       VAL  11  -0.172  -8.408  11.013
   83   HG11  VAL  11          1HG1      VAL  11   0.592 -10.945  11.570
   84   HG12  VAL  11          2HG1      VAL  11  -0.659 -10.067  12.455
   85   HG13  VAL  11          3HG1      VAL  11  -1.107 -11.191  11.170
   86   HG21  VAL  11          3HG2      VAL  11   1.690 -10.022  10.081
   87   HG22  VAL  11          1HG2      VAL  11   0.601 -10.111   8.697
   88   HG23  VAL  11          2HG2      VAL  11   1.244  -8.552   9.216
   89    H    ASN  12           H        ASN  12  -2.727  -6.994   9.885
   90    HA   ASN  12           HA       ASN  12  -4.167  -7.583  12.320
   91    HB2  ASN  12           1HB      ASN  12  -5.066  -5.201  11.894
   92    HB3  ASN  12           2HB      ASN  12  -3.353  -5.382  12.261
   93   HD21  ASN  12          2HD2      ASN  12  -3.001  -3.356  11.262
   94   HD22  ASN  12          1HD2      ASN  12  -2.940  -3.217   9.540
   95    H    GLY  13           H        GLY  13  -4.717  -8.332   9.184
   96    HA2  GLY  13           1HA      GLY  13  -6.578  -8.854   7.939
   97    HA3  GLY  13           2HA      GLY  13  -7.291  -9.262   9.493
   98    H    ASP  14           H        ASP  14  -6.304  -6.127   8.140
   99    HA   ASP  14           HA       ASP  14  -9.030  -5.157   8.666
  100    HB2  ASP  14           1HB      ASP  14  -7.979  -2.881   8.599
  101    HB3  ASP  14           2HB      ASP  14  -7.386  -3.911   9.898
  102    H    GLY  15           H        GLY  15  -6.829  -5.914   6.182
  103    HA2  GLY  15           1HA      GLY  15  -7.033  -5.818   3.894
  104    HA3  GLY  15           2HA      GLY  15  -8.706  -5.342   4.137
  105    H    ALA  16           H        ALA  16  -6.315  -3.407   5.661
  106    HA   ALA  16           HA       ALA  16  -6.404  -1.453   3.468
  107    HB1  ALA  16           3HB      ALA  16  -7.482  -1.160   6.174
  108    HB2  ALA  16           1HB      ALA  16  -6.431   0.162   5.663
  109    HB3  ALA  16           2HB      ALA  16  -7.848  -0.262   4.700
  110    H    VAL  17           H        VAL  17  -4.527  -0.410   3.073
  111    HA   VAL  17           HA       VAL  17  -2.319  -0.807   4.987
  112    HB   VAL  17           HB       VAL  17  -2.224  -0.959   1.975
  113   HG11  VAL  17          1HG1      VAL  17  -0.244   0.052   3.722
  114   HG12  VAL  17          2HG1      VAL  17   0.293  -1.539   3.180
  115   HG13  VAL  17          3HG1      VAL  17  -0.108  -0.291   1.999
  116   HG21  VAL  17          3HG2      VAL  17  -2.902  -2.983   3.319
  117   HG22  VAL  17          1HG2      VAL  17  -1.495  -3.195   2.279
  118   HG23  VAL  17          2HG2      VAL  17  -1.282  -2.965   4.014
  119    H    SER  18           H        SER  18  -1.786   1.087   5.838
  120    HA   SER  18           HA       SER  18  -2.303   3.560   4.419
  121    HB2  SER  18           1HB      SER  18  -0.929   4.198   6.756
  122    HB3  SER  18           2HB      SER  18  -2.680   4.190   6.544
  123    HG   SER  18           HG       SER  18  -2.741   2.579   7.873
  124    H    TYR  19           H        TYR  19  -0.483   5.296   4.733
  125    HA   TYR  19           HA       TYR  19   1.574   4.741   2.991
  126    HB2  TYR  19           1HB      TYR  19   2.580   6.805   3.677
  127    HB3  TYR  19           2HB      TYR  19   0.835   7.014   3.766
  128    HD1  TYR  19           HD1      TYR  19  -0.273   6.765   6.061
  129    HD2  TYR  19           HD2      TYR  19   3.923   7.237   5.544
  130    HE1  TYR  19           HE1      TYR  19  -0.073   7.488   8.402
  131    HE2  TYR  19           HE2      TYR  19   4.136   7.960   7.885
  132    HH   TYR  19           HH       TYR  19   2.912   8.764   9.682
  133    H    GLU  20           H        GLU  20   1.496   4.358   6.488
  134    HA   GLU  20           HA       GLU  20   4.268   3.756   6.766
  135    HB2  GLU  20           1HB      GLU  20   1.973   4.020   8.488
  136    HB3  GLU  20           2HB      GLU  20   2.870   2.564   8.898
  137    HG2  GLU  20           1HG      GLU  20   4.150   5.269   8.625
  138    HG3  GLU  20           2HG      GLU  20   3.525   4.635  10.147
  139    H    GLU  21           H        GLU  21   1.328   1.793   6.519
  140    HA   GLU  21           HA       GLU  21   2.519  -0.714   6.907
  141    HB2  GLU  21           1HB      GLU  21  -0.010   0.263   5.680
  142    HB3  GLU  21           2HB      GLU  21   0.482  -1.386   5.318
  143    HG2  GLU  21           1HG      GLU  21   0.795  -1.425   7.968
  144    HG3  GLU  21           2HG      GLU  21  -0.464  -0.198   7.848
  145    H    VAL  22           H        VAL  22   1.791   1.032   3.892
  146    HA   VAL  22           HA       VAL  22   2.806  -0.884   2.120
  147    HB   VAL  22           HB       VAL  22   1.430   0.936   1.315
  148   HG11  VAL  22          1HG1      VAL  22   2.146   3.222   1.264
  149   HG12  VAL  22          2HG1      VAL  22   2.298   2.635   2.921
  150   HG13  VAL  22          3HG1      VAL  22   3.731   2.791   1.905
  151   HG21  VAL  22          3HG2      VAL  22   2.395   0.759  -0.681
  152   HG22  VAL  22          1HG2      VAL  22   3.735   1.789  -0.176
  153   HG23  VAL  22          2HG2      VAL  22   3.800   0.051   0.114
  154    H    LYS  23           H        LYS  23   4.382   1.858   3.713
  155    HA   LYS  23           HA       LYS  23   6.858   1.707   2.424
  156    HB2  LYS  23           1HB      LYS  23   5.800   3.370   4.259
  157    HB3  LYS  23           2HB      LYS  23   6.853   2.424   5.303
  158    HG2  LYS  23           1HG      LYS  23   7.860   3.685   2.775
  159    HG3  LYS  23           2HG      LYS  23   7.790   4.571   4.301
  160    HD2  LYS  23           1HD      LYS  23   9.134   1.895   4.113
  161    HD3  LYS  23           2HD      LYS  23   9.985   3.380   3.680
  162    HE2  LYS  23           1HE      LYS  23   8.620   2.923   6.328
  163    HE3  LYS  23           2HE      LYS  23  10.334   2.628   6.039
  164    HZ1  LYS  23           3HZ      LYS  23   8.968   5.245   5.712
  165    HZ2  LYS  23           1HZ      LYS  23  10.618   4.951   5.482
  166    HZ3  LYS  23           2HZ      LYS  23   9.941   4.806   7.025
  167    H    ALA  24           H        ALA  24   5.742   0.147   5.414
  168    HA   ALA  24           HA       ALA  24   8.162  -1.163   6.017
  169    HB1  ALA  24           3HB      ALA  24   6.351  -0.844   7.644
  170    HB2  ALA  24           1HB      ALA  24   5.358  -1.997   6.752
  171    HB3  ALA  24           2HB      ALA  24   6.849  -2.532   7.531
  172    H    PHE  25           H        PHE  25   5.372  -2.110   4.075
  173    HA   PHE  25           HA       PHE  25   5.891  -4.788   3.677
  174    HB2  PHE  25           1HB      PHE  25   3.889  -3.561   2.840
  175    HB3  PHE  25           2HB      PHE  25   4.890  -2.863   1.571
  176    HD1  PHE  25           HD2      PHE  25   5.868  -6.179   2.348
  177    HD2  PHE  25           HD1      PHE  25   3.025  -3.906   0.142
  178    HE1  PHE  25           HE2      PHE  25   5.418  -8.133   0.922
  179    HE2  PHE  25           HE1      PHE  25   2.569  -5.857  -1.287
  180    HZ   PHE  25           HZ       PHE  25   3.767  -7.973  -0.900
  181    H    VAL  26           H        VAL  26   7.093  -2.063   1.725
  182    HA   VAL  26           HA       VAL  26   8.734  -3.687   0.064
  183    HB   VAL  26           HB       VAL  26   7.844  -1.163  -0.171
  184   HG11  VAL  26          1HG1      VAL  26  10.749  -0.800   0.536
  185   HG12  VAL  26          2HG1      VAL  26   9.571   0.448   0.124
  186   HG13  VAL  26          3HG1      VAL  26   9.425  -0.438   1.643
  187   HG21  VAL  26          3HG2      VAL  26   8.705  -2.541  -1.981
  188   HG22  VAL  26          1HG2      VAL  26   9.404  -0.924  -2.054
  189   HG23  VAL  26          2HG2      VAL  26  10.358  -2.267  -1.427
  190    H    SER  27           H        SER  27   9.194  -2.089   3.126
  191    HA   SER  27           HA       SER  27  12.020  -2.087   3.165
  192    HB2  SER  27           1HB      SER  27   9.870  -1.464   4.994
  193    HB3  SER  27           2HB      SER  27  11.143  -2.361   5.822
  194    HG   SER  27           HG       SER  27  12.577  -0.789   5.351
  195    H    LYS  28           H        LYS  28   9.698  -4.581   3.554
  196    HA   LYS  28           HA       LYS  28  11.253  -6.359   5.143
  197    HB2  LYS  28           1HB      LYS  28   8.855  -6.720   3.359
  198    HB3  LYS  28           2HB      LYS  28   9.633  -8.090   4.142
  199    HG2  LYS  28           1HG      LYS  28   8.525  -5.697   5.595
  200    HG3  LYS  28           2HG      LYS  28   7.668  -7.225   5.367
  201    HD2  LYS  28           1HD      LYS  28  10.308  -6.888   6.791
  202    HD3  LYS  28           2HD      LYS  28   8.740  -7.093   7.573
  203    HE2  LYS  28           1HE      LYS  28   9.013  -9.293   7.468
  204    HE3  LYS  28           2HE      LYS  28   8.987  -9.186   5.708
  205    HZ1  LYS  28           3HZ      LYS  28  11.444  -8.624   5.927
  206    HZ2  LYS  28           1HZ      LYS  28  10.992 -10.230   6.207
  207    HZ3  LYS  28           2HZ      LYS  28  11.328  -9.206   7.510
  208    H    LYS  29           H        LYS  29  11.614  -5.290   1.997
  209    HA   LYS  29           HA       LYS  29  12.962  -7.754   1.134
  210    HB2  LYS  29           1HB      LYS  29  12.425  -5.365  -0.614
  211    HB3  LYS  29           2HB      LYS  29  12.720  -7.030  -1.097
  212    HG2  LYS  29           1HG      LYS  29  10.247  -5.932   0.220
  213    HG3  LYS  29           2HG      LYS  29  10.407  -6.526  -1.434
  214    HD2  LYS  29           1HD      LYS  29  10.742  -8.176   1.072
  215    HD3  LYS  29           2HD      LYS  29   9.324  -8.176   0.021
  216    HE2  LYS  29           1HE      LYS  29  11.154  -8.719  -1.817
  217    HE3  LYS  29           2HE      LYS  29  12.023  -9.341  -0.415
  218    HZ1  LYS  29           3HZ      LYS  29  10.189 -10.793   0.074
  219    HZ2  LYS  29           1HZ      LYS  29  10.671 -11.037  -1.529
  220    HZ3  LYS  29           2HZ      LYS  29   9.273 -10.147  -1.193
  221    H    ARG  30           H        ARG  30  13.477  -4.426   1.977
  222    HA   ARG  30           HA       ARG  30  16.253  -4.772   2.329
  223    HB2  ARG  30           1HB      ARG  30  17.044  -3.209   0.557
  224    HB3  ARG  30           2HB      ARG  30  16.410  -4.725  -0.072
  225    HG2  ARG  30           1HG      ARG  30  15.308  -3.385  -1.488
  226    HG3  ARG  30           2HG      ARG  30  14.186  -3.198  -0.139
  227    HD2  ARG  30           1HD      ARG  30  14.629  -1.026  -0.035
  228    HD3  ARG  30           2HD      ARG  30  16.345  -1.365   0.193
  229    HE   ARG  30           HE       ARG  30  16.683  -0.698  -1.955
  230   HH11  ARG  30          1HH1      ARG  30  13.366  -1.702  -1.628
  231   HH12  ARG  30          2HH1      ARG  30  12.936  -1.264  -3.248
  232   HH21  ARG  30          1HH2      ARG  30  16.130  -0.115  -4.090
  233   HH22  ARG  30          2HH2      ARG  30  14.509  -0.361  -4.649
  234    H    ALA  31           H        ALA  31  17.174  -2.186   2.033
  235    HA   ALA  31           HA       ALA  31  15.417  -0.706   3.880
  236    HB1  ALA  31           3HB      ALA  31  17.590   0.440   4.563
  237    HB2  ALA  31           1HB      ALA  31  17.365  -1.234   5.073
  238    HB3  ALA  31           2HB      ALA  31  18.411  -0.861   3.701
  239    H    ILE  32           H        ILE  32  14.288   0.589   2.502
  240    HA   ILE  32           HA       ILE  32  15.871   2.541   0.976
  241    HB   ILE  32           HB       ILE  32  14.987   0.987  -0.654
  242   HG12  ILE  32          1HG1      ILE  32  13.029   2.973  -1.313
  243   HG13  ILE  32          2HG1      ILE  32  14.421   3.767  -0.583
  244   HG21  ILE  32          1HG2      ILE  32  13.040   0.370   0.967
  245   HG22  ILE  32          2HG2      ILE  32  12.175   1.641   0.103
  246   HG23  ILE  32          3HG2      ILE  32  12.807   0.250  -0.777
  247   HD11  ILE  32          3HD1      ILE  32  15.513   1.950  -2.372
  248   HD12  ILE  32          1HD1      ILE  32  14.115   2.625  -3.210
  249   HD13  ILE  32          2HD1      ILE  32  15.369   3.695  -2.582
  250    H    LYS  33           H        LYS  33  15.590   4.310   2.211
  251    HA   LYS  33           HA       LYS  33  12.988   4.926   3.348
  252    HB2  LYS  33           1HB      LYS  33  15.340   6.775   3.490
  253    HB3  LYS  33           2HB      LYS  33  14.066   6.505   4.670
  254    HG2  LYS  33           1HG      LYS  33  15.077   4.162   4.932
  255    HG3  LYS  33           2HG      LYS  33  16.483   4.834   4.102
  256    HD2  LYS  33           1HD      LYS  33  16.177   6.743   5.912
  257    HD3  LYS  33           2HD      LYS  33  15.395   5.436   6.804
  258    HE2  LYS  33           1HE      LYS  33  17.825   4.474   5.640
  259    HE3  LYS  33           2HE      LYS  33  18.155   5.959   6.532
  260    HZ1  LYS  33           3HZ      LYS  33  16.448   4.376   8.078
  261    HZ2  LYS  33           1HZ      LYS  33  18.051   4.807   8.401
  262    HZ3  LYS  33           2HZ      LYS  33  17.714   3.387   7.548
  263    H    ASN  34           H        ASN  34  11.566   5.666   1.882
  264    HA   ASN  34           HA       ASN  34  12.399   7.964   0.236
  265    HB2  ASN  34           1HB      ASN  34  10.799   5.543  -0.505
  266    HB3  ASN  34           2HB      ASN  34  10.474   7.073  -1.315
  267   HD21  ASN  34          2HD2      ASN  34  12.889   8.179  -1.627
  268   HD22  ASN  34          1HD2      ASN  34  13.900   7.183  -2.612
  269    H    GLU  35           H        GLU  35  11.573   9.601   1.439
  270    HA   GLU  35           HA       GLU  35   9.000   9.452   2.693
  271    HB2  GLU  35           1HB      GLU  35  11.270  11.108   2.890
  272    HB3  GLU  35           2HB      GLU  35   9.948  12.154   2.392
  273    HG2  GLU  35           1HG      GLU  35   9.361  10.276   4.585
  274    HG3  GLU  35           2HG      GLU  35  10.504  11.569   4.946
  275    H    GLN  36           H        GLN  36  10.317  11.091  -0.160
  276    HA   GLN  36           HA       GLN  36   7.826  12.317  -0.855
  277    HB2  GLN  36           1HB      GLN  36   9.782  13.436  -1.590
  278    HB3  GLN  36           2HB      GLN  36  10.442  11.972  -2.306
  279    HG2  GLN  36           1HG      GLN  36   9.420  12.341  -4.240
  280    HG3  GLN  36           2HG      GLN  36   7.880  12.676  -3.452
  281   HE21  GLN  36          2HE2      GLN  36   7.156  14.538  -4.188
  282   HE22  GLN  36          1HE2      GLN  36   8.072  15.994  -4.349
  283    H    LEU  37           H        LEU  37   9.709   9.622  -2.225
  284    HA   LEU  37           HA       LEU  37   7.943   8.891  -4.240
  285    HB2  LEU  37           1HB      LEU  37  10.336   7.981  -3.360
  286    HB3  LEU  37           2HB      LEU  37   9.278   6.673  -2.837
  287    HG   LEU  37           HG       LEU  37   8.458   6.588  -5.248
  288   HD11  LEU  37          1HD1      LEU  37   9.351   8.783  -5.911
  289   HD12  LEU  37          2HD1      LEU  37   9.939   7.477  -6.941
  290   HD13  LEU  37          3HD1      LEU  37  10.989   8.163  -5.701
  291   HD21  LEU  37          3HD2      LEU  37   9.714   4.759  -5.109
  292   HD22  LEU  37          1HD2      LEU  37  10.844   5.547  -4.007
  293   HD23  LEU  37          2HD2      LEU  37  11.056   5.708  -5.752
  294    H    LEU  38           H        LEU  38   8.125   7.665  -0.903
  295    HA   LEU  38           HA       LEU  38   5.981   5.873  -1.076
  296    HB2  LEU  38           1HB      LEU  38   7.696   6.038   0.755
  297    HB3  LEU  38           2HB      LEU  38   6.795   7.418   1.378
  298    HG   LEU  38           HG       LEU  38   6.382   5.238   2.550
  299   HD11  LEU  38          1HD1      LEU  38   3.737   5.891   1.513
  300   HD12  LEU  38          2HD1      LEU  38   4.680   7.308   1.973
  301   HD13  LEU  38          3HD1      LEU  38   4.383   6.028   3.149
  302   HD21  LEU  38          3HD2      LEU  38   6.202   4.193   0.039
  303   HD22  LEU  38          1HD2      LEU  38   4.502   4.360   0.482
  304   HD23  LEU  38          2HD2      LEU  38   5.592   3.420   1.503
  305    H    GLN  39           H        GLN  39   6.072   9.292  -0.151
  306    HA   GLN  39           HA       GLN  39   3.376   9.537   0.590
  307    HB2  GLN  39           1HB      GLN  39   5.590  11.363  -0.069
  308    HB3  GLN  39           2HB      GLN  39   3.986  12.019  -0.367
  309    HG2  GLN  39           1HG      GLN  39   4.971  10.886   2.242
  310    HG3  GLN  39           2HG      GLN  39   4.792  12.596   1.854
  311   HE21  GLN  39          2HE2      GLN  39   2.550  13.215   1.119
  312   HE22  GLN  39          1HE2      GLN  39   1.229  12.529   1.997
  313    H    LEU  40           H        LEU  40   4.968  10.328  -2.498
  314    HA   LEU  40           HA       LEU  40   2.622  11.038  -3.871
  315    HB2  LEU  40           1HB      LEU  40   5.269  11.131  -4.427
  316    HB3  LEU  40           2HB      LEU  40   4.767   9.785  -5.450
  317    HG   LEU  40           HG       LEU  40   3.753  12.624  -5.553
  318   HD11  LEU  40          1HD1      LEU  40   4.662  12.433  -7.895
  319   HD12  LEU  40          2HD1      LEU  40   5.456  10.947  -7.377
  320   HD13  LEU  40          3HD1      LEU  40   5.864  12.479  -6.606
  321   HD21  LEU  40          3HD2      LEU  40   1.845  11.450  -6.095
  322   HD22  LEU  40          1HD2      LEU  40   2.743  10.098  -6.785
  323   HD23  LEU  40          2HD2      LEU  40   2.615  11.616  -7.673
  324    H    ILE  41           H        ILE  41   4.450   7.981  -3.876
  325    HA   ILE  41           HA       ILE  41   2.728   6.559  -5.566
  326    HB   ILE  41           HB       ILE  41   4.530   5.551  -3.364
  327   HG12  ILE  41          1HG1      ILE  41   4.927   5.513  -6.360
  328   HG13  ILE  41          2HG1      ILE  41   5.563   6.775  -5.311
  329   HG21  ILE  41          1HG2      ILE  41   2.856   3.880  -3.768
  330   HG22  ILE  41          2HG2      ILE  41   3.059   4.035  -5.513
  331   HG23  ILE  41          3HG2      ILE  41   4.359   3.361  -4.530
  332   HD11  ILE  41          3HD1      ILE  41   7.236   5.077  -5.878
  333   HD12  ILE  41          1HD1      ILE  41   6.927   5.161  -4.144
  334   HD13  ILE  41          2HD1      ILE  41   6.235   3.851  -5.102
  335    H    PHE  42           H        PHE  42   2.597   7.190  -2.122
  336    HA   PHE  42           HA       PHE  42   0.702   5.268  -1.382
  337    HB2  PHE  42           1HB      PHE  42   1.809   6.372   0.380
  338    HB3  PHE  42           2HB      PHE  42   1.428   7.966  -0.262
  339    HD1  PHE  42           HD2      PHE  42  -0.062   4.974   1.331
  340    HD2  PHE  42           HD1      PHE  42  -0.497   9.108   0.416
  341    HE1  PHE  42           HE2      PHE  42  -2.033   5.088   2.799
  342    HE2  PHE  42           HE1      PHE  42  -2.468   9.229   1.884
  343    HZ   PHE  42           HZ       PHE  42  -3.239   7.216   3.076
  344    H    LYS  43           H        LYS  43   0.224   8.675  -2.307
  345    HA   LYS  43           HA       LYS  43  -2.617   8.507  -2.258
  346    HB2  LYS  43           1HB      LYS  43  -0.825  10.561  -2.307
  347    HB3  LYS  43           2HB      LYS  43  -1.404  10.579  -3.968
  348    HG2  LYS  43           1HG      LYS  43  -3.669  10.870  -3.238
  349    HG3  LYS  43           2HG      LYS  43  -3.197  10.660  -1.551
  350    HD2  LYS  43           1HD      LYS  43  -2.773  12.835  -1.382
  351    HD3  LYS  43           2HD      LYS  43  -1.599  12.726  -2.696
  352    HE2  LYS  43           1HE      LYS  43  -3.740  12.759  -4.203
  353    HE3  LYS  43           2HE      LYS  43  -4.487  13.482  -2.780
  354    HZ1  LYS  43           3HZ      LYS  43  -1.959  14.550  -3.858
  355    HZ2  LYS  43           1HZ      LYS  43  -3.112  15.323  -2.892
  356    HZ3  LYS  43           2HZ      LYS  43  -3.443  15.016  -4.522
  357    H    SER  44           H        SER  44  -0.177   7.900  -4.663
  358    HA   SER  44           HA       SER  44  -1.884   8.001  -6.936
  359    HB2  SER  44           1HB      SER  44   0.875   6.996  -6.383
  360    HB3  SER  44           2HB      SER  44   0.069   6.462  -7.857
  361    HG   SER  44           HG       SER  44  -0.371   8.902  -8.014
  362    H    ILE  45           H        ILE  45  -0.571   5.295  -5.031
  363    HA   ILE  45           HA       ILE  45  -1.962   3.276  -6.441
  364    HB   ILE  45           HB       ILE  45  -0.822   3.257  -3.644
  365   HG12  ILE  45          1HG1      ILE  45   0.253   2.172  -6.257
  366   HG13  ILE  45          2HG1      ILE  45   0.830   3.618  -5.435
  367   HG21  ILE  45          1HG2      ILE  45  -0.926   0.655  -4.700
  368   HG22  ILE  45          2HG2      ILE  45  -1.836   1.307  -3.339
  369   HG23  ILE  45          3HG2      ILE  45  -2.518   1.365  -4.965
  370   HD11  ILE  45          3HD1      ILE  45   1.036   0.775  -4.484
  371   HD12  ILE  45          1HD1      ILE  45   2.347   1.842  -4.984
  372   HD13  ILE  45          2HD1      ILE  45   1.452   2.179  -3.502
  373    H    ASP  46           H        ASP  46  -2.697   5.087  -3.493
  374    HA   ASP  46           HA       ASP  46  -5.070   3.644  -2.873
  375    HB2  ASP  46           1HB      ASP  46  -3.565   5.271  -1.418
  376    HB3  ASP  46           2HB      ASP  46  -4.718   6.473  -1.990
  377    H    ALA  47           H        ALA  47  -6.960   3.723  -3.873
  378    HA   ALA  47           HA       ALA  47  -7.509   5.431  -6.038
  379    HB1  ALA  47           3HB      ALA  47  -9.591   4.373  -6.185
  380    HB2  ALA  47           1HB      ALA  47  -8.523   3.146  -5.502
  381    HB3  ALA  47           2HB      ALA  47  -9.639   4.026  -4.457
  382    H    ASP  48           H        ASP  48  -8.552   5.520  -2.653
  383    HA   ASP  48           HA       ASP  48  -9.725   8.174  -3.139
  384    HB2  ASP  48           1HB      ASP  48 -10.960   7.815  -1.020
  385    HB3  ASP  48           2HB      ASP  48 -11.323   6.586  -2.229
  386    H    GLY  49           H        GLY  49  -7.138   6.532  -1.652
  387    HA2  GLY  49           1HA      GLY  49  -5.399   7.238  -0.331
  388    HA3  GLY  49           2HA      GLY  49  -5.788   8.858  -0.896
  389    H    ASN  50           H        ASN  50  -7.994   6.826   0.928
  390    HA   ASN  50           HA       ASN  50  -8.245   8.893   2.933
  391    HB2  ASN  50           1HB      ASN  50 -10.039   7.466   3.848
  392    HB3  ASN  50           2HB      ASN  50 -10.256   7.769   2.127
  393   HD21  ASN  50          2HD2      ASN  50 -11.418   5.651   3.599
  394   HD22  ASN  50          1HD2      ASN  50 -10.810   4.167   2.956
  395    H    GLY  51           H        GLY  51  -6.058   8.719   3.768
  396    HA2  GLY  51           1HA      GLY  51  -4.641   8.125   5.480
  397    HA3  GLY  51           2HA      GLY  51  -5.945   7.138   6.124
  398    H    GLU  52           H        GLU  52  -6.316   5.356   4.022
  399    HA   GLU  52           HA       GLU  52  -3.750   4.140   3.427
  400    HB2  GLU  52           1HB      GLU  52  -4.606   1.922   4.393
  401    HB3  GLU  52           2HB      GLU  52  -3.996   3.122   5.523
  402    HG2  GLU  52           1HG      GLU  52  -6.089   1.975   6.236
  403    HG3  GLU  52           2HG      GLU  52  -6.189   3.734   6.189
  404    H    ILE  53           H        ILE  53  -4.013   2.167   2.067
  405    HA   ILE  53           HA       ILE  53  -6.214   2.590   0.195
  406    HB   ILE  53           HB       ILE  53  -3.938   0.672  -0.216
  407   HG12  ILE  53          1HG1      ILE  53  -3.372   3.066  -1.590
  408   HG13  ILE  53          2HG1      ILE  53  -3.772   3.537   0.058
  409   HG21  ILE  53          1HG2      ILE  53  -6.015   1.969  -1.894
  410   HG22  ILE  53          2HG2      ILE  53  -4.444   1.646  -2.624
  411   HG23  ILE  53          3HG2      ILE  53  -5.388   0.322  -1.940
  412   HD11  ILE  53          3HD1      ILE  53  -1.770   2.914   0.746
  413   HD12  ILE  53          1HD1      ILE  53  -2.034   1.281   0.133
  414   HD13  ILE  53          2HD1      ILE  53  -1.345   2.519  -0.920
  415    H    ASP  54           H        ASP  54  -7.959   1.355   0.256
  416    HA   ASP  54           HA       ASP  54  -8.091  -0.980   1.913
  417    HB2  ASP  54           1HB      ASP  54 -10.151   0.002  -0.069
  418    HB3  ASP  54           2HB      ASP  54 -10.420  -1.074   1.300
  419    H    GLN  55           H        GLN  55  -8.818  -3.091   1.160
  420    HA   GLN  55           HA       GLN  55  -7.175  -4.199  -0.773
  421    HB2  GLN  55           1HB      GLN  55  -8.700  -6.164  -0.692
  422    HB3  GLN  55           2HB      GLN  55  -8.217  -5.585   0.897
  423    HG2  GLN  55           1HG      GLN  55 -10.403  -5.783   1.343
  424    HG3  GLN  55           2HG      GLN  55 -10.496  -4.200   0.572
  425   HE21  GLN  55          2HE2      GLN  55 -12.745  -5.562   0.596
  426   HE22  GLN  55          1HE2      GLN  55 -13.110  -6.238  -0.951
  427    H    ASN  56           H        ASN  56 -10.549  -3.145  -1.067
  428    HA   ASN  56           HA       ASN  56 -11.006  -3.985  -3.687
  429    HB2  ASN  56           1HB      ASN  56 -12.532  -2.790  -1.817
  430    HB3  ASN  56           2HB      ASN  56 -12.218  -1.406  -2.860
  431   HD21  ASN  56          2HD2      ASN  56 -12.464  -1.993  -5.275
  432   HD22  ASN  56          1HD2      ASN  56 -13.905  -2.861  -5.674
  433    H    GLU  57           H        GLU  57  -9.845  -0.834  -2.504
  434    HA   GLU  57           HA       GLU  57  -9.546   0.364  -5.028
  435    HB2  GLU  57           1HB      GLU  57  -7.951   0.940  -2.526
  436    HB3  GLU  57           2HB      GLU  57  -8.165   2.014  -3.900
  437    HG2  GLU  57           1HG      GLU  57 -10.328   2.534  -3.338
  438    HG3  GLU  57           2HG      GLU  57 -10.565   1.039  -2.435
  439    H    PHE  58           H        PHE  58  -7.261  -1.443  -3.010
  440    HA   PHE  58           HA       PHE  58  -5.005  -1.105  -4.653
  441    HB2  PHE  58           1HB      PHE  58  -5.100  -1.983  -2.252
  442    HB3  PHE  58           2HB      PHE  58  -5.523  -3.541  -2.954
  443    HD1  PHE  58           HD1      PHE  58  -3.903  -4.799  -4.260
  444    HD2  PHE  58           HD2      PHE  58  -2.882  -1.084  -2.449
  445    HE1  PHE  58           HE1      PHE  58  -1.516  -5.296  -4.594
  446    HE2  PHE  58           HE2      PHE  58  -0.494  -1.575  -2.782
  447    HZ   PHE  58           HZ       PHE  58   0.192  -3.683  -3.856
  448    H    ALA  59           H        ALA  59  -7.460  -3.660  -4.539
  449    HA   ALA  59           HA       ALA  59  -6.353  -5.361  -6.461
  450    HB1  ALA  59           3HB      ALA  59  -8.971  -5.825  -6.814
  451    HB2  ALA  59           1HB      ALA  59  -8.056  -6.434  -5.435
  452    HB3  ALA  59           2HB      ALA  59  -9.027  -4.970  -5.272
  453    H    LYS  60           H        LYS  60  -8.785  -2.788  -6.861
  454    HA   LYS  60           HA       LYS  60  -9.046  -3.044  -9.650
  455    HB2  LYS  60           1HB      LYS  60  -9.496  -0.637  -7.876
  456    HB3  LYS  60           2HB      LYS  60 -10.017  -0.758  -9.550
  457    HG2  LYS  60           1HG      LYS  60 -10.892  -2.788  -7.536
  458    HG3  LYS  60           2HG      LYS  60 -11.712  -1.230  -7.670
  459    HD2  LYS  60           1HD      LYS  60 -11.239  -2.891 -10.113
  460    HD3  LYS  60           2HD      LYS  60 -12.583  -3.271  -9.032
  461    HE2  LYS  60           1HE      LYS  60 -12.365  -0.433  -9.701
  462    HE3  LYS  60           2HE      LYS  60 -12.657  -1.470 -11.096
  463    HZ1  LYS  60           3HZ      LYS  60 -14.769  -1.607 -10.503
  464    HZ2  LYS  60           1HZ      LYS  60 -14.487  -0.620  -9.159
  465    HZ3  LYS  60           2HZ      LYS  60 -14.339  -2.300  -9.021
  466    H    PHE  61           H        PHE  61  -6.687  -1.444  -7.664
  467    HA   PHE  61           HA       PHE  61  -5.624   0.214  -9.746
  468    HB2  PHE  61           1HB      PHE  61  -5.163   1.090  -7.650
  469    HB3  PHE  61           2HB      PHE  61  -4.807  -0.487  -6.954
  470    HD1  PHE  61           HD1      PHE  61  -3.465   1.527  -9.800
  471    HD2  PHE  61           HD2      PHE  61  -2.639  -0.688  -6.261
  472    HE1  PHE  61           HE1      PHE  61  -1.058   1.942 -10.105
  473    HE2  PHE  61           HE2      PHE  61  -0.232  -0.276  -6.560
  474    HZ   PHE  61           HZ       PHE  61   0.561   1.041  -8.484
  475    H    TYR  62           H        TYR  62  -4.907  -2.963  -8.435
  476    HA   TYR  62           HA       TYR  62  -2.409  -3.372  -9.636
  477    HB2  TYR  62           1HB      TYR  62  -3.914  -4.809  -7.926
  478    HB3  TYR  62           2HB      TYR  62  -4.226  -5.707  -9.407
  479    HD1  TYR  62           HD1      TYR  62  -2.186  -6.522 -10.740
  480    HD2  TYR  62           HD2      TYR  62  -1.959  -5.189  -6.706
  481    HE1  TYR  62           HE1      TYR  62  -0.050  -7.713 -10.472
  482    HE2  TYR  62           HE2      TYR  62   0.178  -6.375  -6.428
  483    HH   TYR  62           HH       TYR  62   2.015  -7.213  -7.827
  484    H    GLY  63           H        GLY  63  -1.883  -3.432 -11.712
  485    HA2  GLY  63           1HA      GLY  63  -1.948  -4.101 -13.932
  486    HA3  GLY  63           2HA      GLY  63  -3.467  -4.922 -13.606
  487    H    SER  64           H        SER  64  -3.729  -1.838 -12.437
  488    HA   SER  64           HA       SER  64  -5.293  -1.029 -14.764
  489    HB2  SER  64           1HB      SER  64  -5.576  -0.703 -11.947
  490    HB3  SER  64           2HB      SER  64  -5.436   0.900 -12.665
  491    HG   SER  64           HG       SER  64  -7.258   0.590 -13.763
  492    H    ILE  65           H        ILE  65  -2.296  -0.940 -14.600
  493    HA   ILE  65           HA       ILE  65  -1.758   1.924 -14.718
  494    HB   ILE  65           HB       ILE  65  -0.193   0.259 -13.596
  495   HG12  ILE  65          1HG1      ILE  65   1.209   1.815 -15.750
  496   HG13  ILE  65          2HG1      ILE  65   0.315   2.649 -14.483
  497   HG21  ILE  65          1HG2      ILE  65   1.017  -0.275 -16.246
  498   HG22  ILE  65          2HG2      ILE  65   1.017  -1.254 -14.781
  499   HG23  ILE  65          3HG2      ILE  65  -0.416  -1.203 -15.808
  500   HD11  ILE  65          3HD1      ILE  65   2.929   1.974 -14.344
  501   HD12  ILE  65          1HD1      ILE  65   1.889   2.250 -12.947
  502   HD13  ILE  65          2HD1      ILE  65   2.178   0.607 -13.520
  503    H    GLN  66           H        GLN  66  -3.293   0.191 -16.761
  504    HA   GLN  66           HA       GLN  66  -1.904  -0.041 -19.139
  505    HB2  GLN  66           1HB      GLN  66  -4.795   0.595 -18.586
  506    HB3  GLN  66           2HB      GLN  66  -4.185   0.377 -20.220
  507    HG2  GLN  66           1HG      GLN  66  -3.310  -1.809 -18.623
  508    HG3  GLN  66           2HG      GLN  66  -5.044  -1.589 -18.390
  509   HE21  GLN  66          2HE2      GLN  66  -5.919  -3.165 -19.562
  510   HE22  GLN  66          1HE2      GLN  66  -5.630  -3.438 -21.244