*HEADER    HORMONE                                 25-APR-18   6GDZ              
*TITLE     EXENDIN-4 BASED DUAL GLP-1/GLUCAGON RECEPTOR AGONIST                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EXENDIN-4;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HELODERMA SUSPECTUM;                            
*SOURCE   4 ORGANISM_COMMON: GILA MONSTER;                                       
*SOURCE   5 ORGANISM_TAXID: 8554                                                 
*KEYWDS    HORMONE                                                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    A.EVERS,M.KURZ                                                        
*REVDAT   1   20-JUN-18 6GDZ    0                                                
# Restraints file 1: peptide5_restraints.txt
ATOM1	ATOM2	LOWER	UPPER
AIB27.H	GLY30.H	4.23	5.18
AIB27.H	GLY29.H	3.64	4.45
AIB27.H	ALA28.H	2.64	3.23
AIB27.H	ILE23.QG2	3.43	5.2
AIB27.H	LEU26.QD1	3.61	5.41
AIB27.H	LEU26.QD2	3.78	5.63
AIB27.H	AIB27.QB3	2.27	3.78
AIB27.H	AIB27.QB2	2.47	4.02
AIB27.H	ALA28.QB	3.15	4.85
AIB27.H	ILE23.QD1	4.79	6.86
ALA19.H	LYS20.H	2.61	3.19
ALA19.H	LEU21.H	3.33	4.07
ALA19.H	ALA19.QB	2.27	3.77
ALA19.H	ARG18.QD	3.93	5.71
ALA19.HA	ILE23.H	3.24	3.96
ALA19.HA	PHE22.CG	3.3	6.03
ALA28.H	GLY30.H	3.27	4
ALA28.H	LEU26.QD2	4.8	6.87
ALA28.H	LEU26.QD1	5.14	7.28
ALA28.H	ILE23.QG2	4.76	6.82
ALA28.H	AIB27.QB3	2.49	4.05
ALA28.H	AIB27.QB2	3.14	4.84
ALA28.H	ALA28.QB	2.24	3.74
ALA28.H	GLY29.H	2.55	3.12
ALA35.H	ALA35.QB	2.34	3.87
ALA35.H	PRO36.HD2	3.93	4.8
ALA35.H	PRO36.HD3	3.84	4.69
ALA35.HA	PRO36.HD3	2.25	2.81
ALA35.HA	PRO36.HD2	2.25	2.81
ALA35.HA	PRO36.QG	3.02	4.59
ALA35.HA	PRO36.HB2	4.23	5.17
ALA35.QB	PRO37.QD	4.49	7.39
ARG18.H	ALA19.H	2.7	3.31
ARG18.H	GLN17.QG	3.21	4.82
ARG18.HA	ALA19.H	2.82	3.45
ARG18.HA	GLN17.QG	3.7	5.42
ARG18.HB2	ALA19.H	2.74	3.4
ARG18.HB3	ALA19.H	2.74	3.4
ASP15.H	ARG18.QD	3.38	5.03
ASP15.H	ASP15.HB2	2.43	2.97
ASP15.H	ASP15.HB3	2.53	3.1
ASP15.H	LYS14.QB	2.43	3.86
ASP15.HB2	LYS12.QD	4.14	5.95
ASP15.HB2	GLU16.HA	3.84	4.69
ASP15.HB2	ALA19.QB	4.28	6.24
ASP15.HB3	ALA19.QB	3.68	5.5
ASP15.HB3	GLU16.HA	3.8	4.65
ASP15.HA	ALA19.H	3.67	4.49
ASP15.HA	ARG18.H	2.91	3.56
ASP15.HA	ARG18.QD	3.09	4.67
ASP15.HA	LYS14.QG	4.44	6.32
ASP15.HA	ALA19.QB	4.11	6.02
ASP9.H	LEU10.H	2.85	3.48
ASP9.HA	LYS12.H	3.21	3.93
ASP9.HA	GLN13.H	3.69	4.51
ASP9.HA	LYS12.QB	2.72	4.22
ASP9.HA	LYS12.QD	3.39	5.05
ASP9.HA	LYS12.QE	4.33	6.2
ASP9.HA	GLN13.QB	4.62	6.55
ASP9.HA	LEU10.QD2	4.96	7.06
ASP9.HA	LYS12.HG3	3.78	5.03
ASP9.HA	LYS12.HG2	3.78	5.03
ASP9.HA	THR7.QG2	5.52	7.74
GLN13.H	LYS14.H	2.61	3.19
GLN13.H	GLN13.QB	2.2	3.59
GLN13.H	LEU10.QD2	4.77	6.83
GLN13.H	GLN13.HG3	2.92	3.78
GLN13.H	GLN13.HG2	2.92	3.78
GLN13.HG2	LYS14.H	3.79	4.9
GLN13.HG3	LYS14.H	3.79	4.9
GLN17.H	ARG18.H	2.56	3.13
GLN17.H	GLN17.QG	2.61	4.09
GLN17.H61	LEU21.QD1	4.51	6.51
GLN17.H61	LEU21.QD2	4.23	6.27
GLN17.H62	LEU21.QD1	4.51	6.51
GLN17.H62	LEU21.QD2	4.23	6.27
GLN17.HA	LEU21.H	3.33	4.07
GLN17.HA	LYS20.H	3.01	3.68
GLN17.HA	ALA19.H	3.51	4.29
GLN17.HA	ARG18.H	3.19	3.89
GLN17.HA	LYS20.QE	3.75	5.49
GLN17.HA	LYS20.QB	2.36	3.79
GLN17.HA	LYS20.QG	3.62	5.33
GLN17.HA	LEU21.QD1	3.84	5.69
GLN17.HA	LEU21.HG	3.11	3.8
GLN3.H	AIB2.QB2	3.02	4.92
GLN3.H	AIB2.QB3	3.02	4.92
GLN3.H	GLY4.H	3.15	3.84
GLU1'.H	GLU2'.QG	2.42	3.86
GLU16.H	ALA19.H	3.93	4.8
GLU16.H	GLN17.H	2.42	2.95
GLU16.HA	LYS20.H	3.2	3.96
GLU16.HA	ALA19.H	2.96	3.62
GLU16.HA	ALA19.QB	2.35	3.87
GLU16.HG2	GLN17.H	3.34	4.45
GLU16.HG2	GLN17.HA	3.67	4.48
GLU16.HG3	GLN17.H	3.34	4.45
GLU16.HG3	ALA19.QB	3.76	5.6
GLU16.HG3	LYS20.QE	4.08	5.88
GLU16.HG3	GLN17.HA	4.37	5.34
GLU16.HG3	LYS12.QD	3.56	5.25
GLU2'.H	GLU2'.QG	3.1	4.69
GLU24.H	AIB27.H	3.83	4.68
GLU24.HA	AIB27.H	3	3.66
GLU24.HA	ALA28.H	3.42	4.19
GLU24.HB2	LEU21.QD2	3.43	5.19
GLU24.HB2	ILE23.QG2	4.05	5.95
GLU24.HG2	ILE23.QG2	3.71	5.7
GLU24.HG3	ILE23.QG2	3.71	5.7
GLY29.H	GLY30.H	2.39	2.92
GLY29.H	AIB27.QB2	3.16	4.86
GLY29.H	AIB27.QB3	3.19	4.9
GLY29.H	ALA28.QB	2.85	4.48
GLY29.H	LEU26.QD2	4.25	6.19
GLY29.H	GLY30.HA3	3.49	4.27
GLY29.HA3	SER32.H	3.99	4.87
GLY29.HA3	GLY30.H	2.83	3.46
GLY29.HA3	ALA28.QB	4.02	5.91
GLY29.HA3	GLY30.HA3	4.08	4.99
GLY30.H	ALA28.QB	3.06	4.74
GLY30.H	LEU26.QD2	3.63	5.44
GLY30.H	AIB27.QB2	3.85	5.7
GLY30.H	SER32.H	4.27	5.22
GLY30.H	SER33.HA	4.13	5.05
GLY30.H	SER33.HB3	3.35	4.1
GLY30.H	GLY30.HA3	2.63	3.22
GLY30.H	GLY30.HA2	2.46	3.01
GLY30.HA2	SER32.H	3.7	4.52
GLY30.HA3	SER32.H	3.58	4.37
GLY30.HA3	PRO31.HD2	2.51	3.07
GLY30.HA3	LEU26.QD2	3.22	4.93
GLY30.HA3	PRO31.HD3	2.56	3.12
GLY34.H	ALA35.H	2.52	3.08
GLY34.H	ALA35.QB	3.53	5.31
GLY34.H	ALA28.QB	4.95	7.05
GLY4.H	THR5.H	3.27	4
ILE23.CG2	ILE23.H	2.79	4.41
ILE23.H	GLU24.H	2.7	3.3
ILE23.H	ALA19.QB	3.31	5.04
ILE23.H	ILE23.HB	2.38	2.91
ILE23.H	ILE23.QD1	2.95	4.61
ILE23.HA	AIB27.H	3.23	3.95
ILE23.HA	LEU26.QD1	2.73	4.34
ILE23.HA	ILE23.QD1	2.81	4.44
ILE23.HA	AIB27.QB3	3.66	5.47
ILE23.HA	LEU26.HG	3.15	3.86
ILE23.HA	LEU26.QD2	3.51	5.29
ILE23.HA	LEU26.HB2	2.6	3.17
ILE23.HB	LEU26.QD1	3.95	5.83
LEU10.H	LYS12.H	3.76	4.6
LEU10.H	LEU10.QD2	3.48	5.29
LEU10.H	LEU10.QD1	3.48	5.29
LEU10.H	ASP9.QB	2.66	4.15
LEU10.H	THR7.QG2	4.22	6.16
LEU10.QD1	LYS14.QE	3.56	5.35
LEU10.QD2	LYS14.QE	3.83	5.68
LEU10.QD2	ASP9.QB	4.46	7.35
LEU21.H	ILE23.H	3.81	4.66
LEU21.H	PHE22.H	2.59	3.17
LEU21.H	LEU21.HG	2.48	3.03
LEU21.H	LEU21.QD1	3.12	4.83
LEU21.H	LEU21.QD2	3.12	4.83
LEU21.H	PHE22.HB2	3.75	4.62
LEU21.H	PHE22.HB3	3.75	4.62
LEU21.H	LYS20.QG	3.72	5.45
LEU21.QD1	GLN17.QG	3	5.56
LEU21.QD1	ARG18.QD	3.77	6.5
LEU21.QD2	GLN17.QG	3.46	6.13
LEU26.H	AIB27.H	2.64	3.22
LEU26.H	LEU26.HG	2.58	3.15
LEU26.H	GLY29.H	4.36	5.33
LEU26.H	ALA28.H	3.69	4.52
LEU26.H	ALA28.QB	3.83	5.68
LEU26.H	LEU26.QD1	3.05	4.73
LEU26.H	LEU26.QD2	3.24	4.97
LEU26.H	LEU26.HB2	2.5	3.05
LEU26.H	AIB27.QB3	3.26	4.99
LEU26.HA	AIB27.H	3.12	3.81
LEU26.HA	LEU26.QD2	2.47	4.02
LEU26.HA	LEU26.QD1	2.98	4.64
LEU26.HA	GLY30.H	2.58	3.15
LEU26.HA	ALA28.H	3.71	4.53
LEU26.HA	GLY29.H	3.11	3.8
LEU26.HA	GLY30.HA2	2.75	3.36
LEU26.HA	GLY30.HA3	2.97	3.64
LEU26.HA	AIB27.QB3	4.01	5.91
LEU26.HB2	AIB27.H	2.65	3.24
LEU26.HB2	ALA28.H	4.16	5.08
LEU26.HB2	ILE23.QG2	3.25	4.97
LEU26.HG	AIB27.H	3.48	4.25
LYS12.H	LYS14.H	3.72	4.54
LYS12.H	GLN13.H	2.65	3.24
LYS12.H	LYS12.HA	2.55	3.11
LYS12.H	GLN13.QB	3.55	5.24
LYS12.H	LYS12.QE	4.76	6.72
LYS12.H	THR7.QG2	5.25	7.41
LYS12.H	LYS12.QB	2.29	3.69
LYS12.H	LEU10.QD2	5.71	7.98
LYS12.H	ASP15.H	4.07	4.98
LYS12.H	GLN13.HG3	4.79	6.03
LYS12.H	GLN13.HG2	4.79	6.03
LYS12.H	ASP15.HB2	4.26	5.21
LYS12.H	LEU10.QD1	5.64	7.9
LYS12.H	LYS12.QD	3.63	5.34
LYS12.H	LYS12.HG2	2.96	3.86
LYS12.H	LYS12.HG3	2.96	3.86
LYS12.H	ASP9.QB	3.76	5.5
LYS12.HA	GLN13.H	2.87	3.5
LYS12.HA	ASP15.H	2.99	3.65
LYS12.HA	ASP15.HB2	2.63	3.21
LYS12.HA	ASP15.HB3	2.86	3.49
LYS12.HA	GLU16.HG3	5.23	6.39
LYS14.EH	GLU1'.QG	2.39	3.82
LYS14.EH	LEU10.QD2	4.83	6.9
LYS14.EH	ARG18.QD	5.23	7.29
LYS14.EH	LEU10.QD1	5.42	7.63
LYS14.H	ASP15.H	2.52	3.08
LYS14.HA	ARG18.QD	4.31	6.17
LYS14.HA	GLN17.QG	2.99	4.56
LYS14.HA	LYS14.QE	3.69	5.41
LYS14.QE	GLU1'.QG	3.65	5.37
LYS20.H	ILE23.H	4.19	5.12
LYS20.H	ALA19.QB	2.58	4.16
LYS20.H	ILE23.QG2	4.81	6.88
LYS20.H	LYS20.QG	3.13	4.73
LYS20.HA	PHE22.CG	4.94	8.04
LYS20.HA	ILE23.HB	2.42	2.96
PHE22.CG	ILE23.H	3.34	6.08
PHE22.CG	PRO38.HD2	3.5	6.27
PHE22.CG	PRO38.HD3	4.18	7.11
PHE22.CG	TRP25.HB3	3.14	5.84
PHE22.CG	TRP25.HB2	3.53	6.31
PHE22.CG	ILE23.HB	4.48	7.48
PHE22.CG	LEU26.HG	3.63	6.44
PHE22.CG	LEU26.QD1	3.2	5.91
PHE22.CG	LEU26.QD2	3.43	6.19
PHE22.CG	ILE23.QD1	3.44	6.21
PHE22.CG	PRO38.QG	3.22	5.94
PHE22.H	ILE23.H	2.7	3.3
PHE22.HA	TRP25.H5	4.2	5.13
PHE22.HA	LEU26.QD1	4.75	6.8
PHE22.HA	LEU26.QD2	5.11	7.25
PHE22.HA	TRP25.HB2	2.65	3.24
PHE22.HB2	ILE23.QD1	4.23	6.17
PHE22.HB3	ILE23.H	2.69	3.29
PHE22.HB3	LEU26.QD1	4.23	6.17
PHE22.HB3	ILE23.QD1	3.96	5.84
PHE22.HB3	ILE23.HB	4.57	5.58
PHE6.CG	PHE6.H	3.64	6.45
PHE6.H	THR7.H	3.11	3.8
PHE6.H	THR5.QG2	3.74	5.57
PHE6.H	AIB2.QB3	4.24	6.18
PHE6.H	PHE6.HB3	2.77	3.56
PHE6.H	PHE6.HB2	2.77	3.56
PHE6.H	THR7.QG2	4.21	6.14
PHE6.H	GLY4.QA	3.17	4.77
PHE6.HA	LEU10.QD1	4.73	6.78
PHE6.HA	THR5.QG2	4.34	6.3
PHE6.HA	ASP9.QB	3.12	4.72
PHE6.HA	LEU10.QD2	4.93	7.03
PHE6.HA	THR7.QG2	4.42	6.4
PHE6.HB2	THR7.H	3.13	4.12
PHE6.HB2	SER8.H	4	4.92
PHE6.HB3	THR7.H	3.13	4.12
PHE6.HB3	SER8.H	4	4.92
PRO31.HA	SER32.H	2.97	3.64
PRO31.HA	GLY34.H	3.49	4.27
PRO31.HA	SER33.H	3.22	3.94
PRO31.HA	PRO37.QD	3.96	5.74
PRO31.HA	LEU26.QD2	5.95	8.27
PRO31.HB2	SER32.H	3.55	4.34
PRO31.HD2	LEU26.QD2	3.6	5.4
PRO31.HD2	SER32.H	3.01	3.68
PRO31.HD3	LEU26.QD2	3.64	5.44
PRO31.HD3	SER32.H	3.31	4.04
PRO31.HG2	LEU26.QD2	3.88	5.74
PRO36.HA	PRO37.QD	2.18	3.56
PRO36.HA	ALA35.QB	4.45	6.43
PRO36.HA	PRO37.HB3	4.66	5.7
PRO36.HA	PRO37.HB2	4.52	5.53
PRO36.HB2	PRO37.QD	2.65	4.24
PRO36.HB3	PRO37.QD	2.65	4.24
PRO36.HD2	ALA35.QB	2.53	4.09
PRO36.HD3	ALA35.QB	2.86	4.5
PRO36.QG	PRO37.QD	3.46	6.03
PRO37.HB2	PRO38.HD2	3	3.67
PRO38.HD2	SER39.H	4.12	5.03
SER11.H	LYS12.H	2.68	3.28
SER11.H	LYS14.H	3.31	4.05
SER11.H	GLN13.H	3.21	3.92
SER11.H	LEU10.QD2	3.84	5.7
SER11.H	LEU10.QD1	3.94	5.82
SER11.HA	LYS14.QE	3.48	5.15
SER11.HA	LYS14.EH	3.57	4.36
SER11.HA	ASP15.H	2.89	3.53
SER11.HB2	LYS12.H	3.06	3.93
SER11.HB3	LYS12.H	3.06	3.93
SER11.QB	LYS14.QE	4.34	6.21
SER32.H	SER33.H	2.64	3.23
SER32.H	LEU26.QD2	5.33	7.52
SER32.H	GLY34.H	3.84	4.7
SER32.H	SER32.HB2	2.65	3.3
SER32.H	SER32.HB3	2.65	3.3
SER32.H	SER33.HB3	4.1	5.1
SER32.HA	GLY34.H	3.28	4.01
SER32.HA	SER33.H	2.95	3.61
SER33.H	GLY34.H	2.68	3.27
SER33.H	SER33.HB3	2.76	3.37
SER33.HB2	GLY34.H	3.43	4.54
SER33.HB3	GLY34.H	3.43	4.54
SER33.HB3	ALA35.H	3.91	4.78
SER39.H	SER39.HB2	3.39	4.21
SER39.H	SER39.HB3	3.39	4.21
SER39.H	LEU21.QD1	5.25	7.42
SER8.H	ASP9.H	2.96	3.62
SER8.H	THR7.QG2	3.42	5.19
SER8.H	THR5.QG2	4.71	6.76
SER8.HA	LYS12.H	4.08	4.99
SER8.HA	THR7.QG2	4.12	6.04
THR5.H	PHE6.H	3.14	3.84
THR5.H	AIB2.QB3	4.25	7.12
THR5.H	AIB2.QB2	4.25	7.12
THR5.H	THR5.QG2	3.29	5.02
THR5.H	GLY4.QA	2.61	4.09
THR5.H	THR5.HB	2.95	3.6
THR5.HB	PHE6.H	2.86	3.5
THR7.H	SER8.H	2.97	3.63
THR7.H	THR7.QG2	3.01	4.68
THR7.H	LEU10.QD1	4.76	6.81
THR7.H	LEU10.QD2	5.31	7.49
THR7.HA	LEU10.QD1	3.56	5.35
THR7.HA	LEU10.QD2	3.83	5.68
TRP25.H	AIB27.H	3.76	4.6
TRP25.H	ALA28.H	4.18	5.11
TRP25.H1	LEU26.H	5.78	7.07
TRP25.H1	GLY30.H	4.9	5.98
TRP25.H1	ALA35.H	3.73	4.56
TRP25.H1	ALA35.HA	4.56	5.57
TRP25.H1	PRO36.HA	3.48	4.25
TRP25.H1	PRO31.HA	3.6	4.4
TRP25.H1	PRO37.QD	3.71	5.43
TRP25.H1	ALA35.QB	2.96	4.61
TRP25.H1	SER33.H	4.82	5.89
TRP25.H1	PRO38.HD3	3.94	4.82
TRP25.H1	PRO38.HD2	4.5	5.5
TRP25.H1	PRO31.HD3	4.56	5.57
TRP25.H1	SER33.HA	4.96	6.06
TRP25.H1	PRO36.HB2	4.77	5.83
TRP25.H2	GLY30.H	4.18	5.1
TRP25.H2	SER33.H	4.62	5.65
TRP25.H2	ALA35.H	4.4	5.38
TRP25.H2	PRO37.HA	3.21	3.92
TRP25.H2	PRO38.HD3	3.6	4.39
TRP25.H2	ALA35.QB	2.74	4.35
TRP25.H2	AIB27.H	5.58	6.82
TRP25.H2	SER33.HB2	4.79	5.86
TRP25.H4	LEU26.H	2.87	3.51
TRP25.H4	GLY30.H	4.15	5.08
TRP25.H4	GLY30.HA3	3.83	4.69
TRP25.H4	PRO38.HD2	3.94	4.82
TRP25.H4	PRO31.HD3	4	4.89
TRP25.H4	LEU26.HA	2.97	3.63
TRP25.H4	PRO37.HA	3.67	4.49
TRP25.H4	PRO38.HD3	4.01	4.9
TRP25.H5	PRO37.QD	4.5	6.4
TRP25.H5	LEU26.HA	3.66	4.48
TRP25.H5	PRO31.HD3	3.4	4.16
TRP25.H5	GLY30.HA2	3.57	4.37
TRP25.H5	GLY30.HA3	3.75	4.59
TRP25.H5	PRO38.HD3	5.13	6.27
TRP25.H5	PRO38.HD2	4.94	6.03
TRP25.H5	PRO37.HA	4.62	5.64
TRP25.H5	LEU26.HG	3.58	4.37
TRP25.H5	LEU26.QD2	2.83	4.46
TRP25.H5	LEU26.QD1	3.58	5.38
TRP25.H5	PRO37.HB2	3.8	4.75
TRP25.H5	PRO37.HB3	3.8	4.75
TRP25.H5	LEU26.H	4.01	4.9
TRP25.H5	PRO31.HA	4.39	5.37
TRP25.H5	PRO31.HG2	4.13	5.05
TRP25.H5	PRO37.HG3	3.94	4.81
TRP25.H5	PRO31.HD2	3.73	4.56
TRP25.H6	PRO31.HD3	3.01	3.68
TRP25.H6	PRO37.HG3	3.85	4.71
TRP25.H7	SER32.H	4.68	5.72
TRP25.H7	PRO37.HA	3.55	4.34
TRP25.H7	PRO31.HD3	3.57	4.37
TRP25.H7	PRO31.HD2	3.93	4.8
TRP25.H7	PRO37.QD	2.92	4.47
TRP25.H7	PRO36.HA	3.87	4.73
TRP25.H7	PRO31.HA	2.74	3.35
TRP25.H7	GLY30.HA2	3.42	4.18
TRP25.H7	GLY30.HA3	3.94	4.82
TRP25.H7	PRO31.HG2	4.23	5.16
TRP25.H7	PRO37.HG3	3.59	4.39
TRP25.HA	AIB27.H	3.42	4.19
TRP25.HA	LEU26.H	3.14	3.83
TRP25.HB2	PRO38.HD2	3.56	4.35
TRP25.HB2	AIB27.H	4.54	5.55
TRP25.HB2	ALA28.H	4.55	5.56
TRP25.HB3	PRO38.HD2	3.83	4.68
TRP25.HB3	AIB27.H	4.19	5.12
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   HIS   1           H1       HIS   1  -7.716   7.089   5.605
    2    H2   HIS   1           H2       HIS   1  -7.287   8.089   4.254
    3    H3   HIS   1           H3       HIS   1  -8.629   8.529   5.287
    4    HA   HIS   1           HA       HIS   1  -8.524   6.109   3.473
    5    HB2  HIS   1           HB2      HIS   1 -10.887   7.242   5.071
    6    HB3  HIS   1           HB3      HIS   1 -10.876   5.759   4.093
    7    HD1  HIS   1           HD1      HIS   1  -8.483   4.261   5.073
    8    HD2  HIS   1           HD2      HIS   1 -11.088   6.418   7.568
    9    HE1  HIS   1           HE1      HIS   1  -8.222   3.247   7.362
   10    H    AIB   2           H        AIB   2 -10.439   6.306   1.799
   11   HB11  AIB   2           H31      AIB   2 -12.751   6.914   0.770
   12   HB12  AIB   2           H32      AIB   2 -12.556   7.962  -0.656
   13   HB13  AIB   2           H33      AIB   2 -11.573   6.481  -0.486
   14   HB21  AIB   2           H21      AIB   2  -9.336   7.663  -0.616
   15   HB22  AIB   2           H22      AIB   2 -10.291   9.115  -1.040
   16   HB23  AIB   2           H23      AIB   2  -9.078   9.186   0.270
   17    H    GLN   3           H        GLN   3 -12.529   8.156   2.885
   18    HA   GLN   3           HA       GLN   3 -13.675  10.720   2.562
   19    HB2  GLN   3           H42      GLN   3 -14.649   9.127   4.143
   20    HB3  GLN   3           H43      GLN   3 -13.162   9.098   5.129
   21    HG2  GLN   3           H32      GLN   3 -13.506  11.465   5.796
   22    HG3  GLN   3           H33      GLN   3 -14.877  11.622   4.673
   23   HE21  GLN   3           H61      GLN   3 -15.416   9.328   8.119
   24   HE22  GLN   3           H62      GLN   3 -13.836   9.408   7.445
   25    H    GLY   4           H        GLY   4 -10.767   9.728   4.583
   26    HA2  GLY   4           HA2      GLY   4 -10.102  12.078   5.728
   27    HA3  GLY   4           HA3      GLY   4  -8.859  11.034   5.011
   28    H    THR   5           H        THR   5  -9.284  11.217   2.262
   29    HA   THR   5           HA       THR   5  -8.023  13.702   1.695
   30    HB   THR   5           HB       THR   5  -9.537  11.880  -0.260
   31    HG1  THR   5           HG1      THR   5  -7.340  11.018  -0.495
   32   HG21  THR   5          HG21      THR   5  -8.026  12.947  -1.985
   33   HG22  THR   5          HG22      THR   5  -9.030  14.191  -1.197
   34   HG23  THR   5          HG23      THR   5  -7.322  13.974  -0.714
   35    H    PHE   6           H        PHE   6 -11.497  12.604   1.166
   36    HA   PHE   6           HA       PHE   6 -12.136  15.176   0.002
   37    HB2  PHE   6           HB2      PHE   6 -13.898  12.818   0.794
   38    HB3  PHE   6           HB3      PHE   6 -14.562  14.423   0.438
   39    HD1  PHE   6           HD1      PHE   6 -15.756  13.525  -1.533
   40    HD2  PHE   6           HD2      PHE   6 -11.479  13.149  -1.370
   41    HE1  PHE   6           HE1      PHE   6 -15.668  13.308  -3.990
   42    HE2  PHE   6           HE2      PHE   6 -11.406  12.968  -3.811
   43    HZ   PHE   6           HZ       PHE   6 -13.484  13.079  -5.146
   44    H    THR   7           H        THR   7 -13.125  13.779   3.289
   45    HA   THR   7           HA       THR   7 -14.378  16.135   4.026
   46    HB   THR   7           HB       THR   7 -14.410  14.055   5.423
   47    HG1  THR   7           HG1      THR   7 -14.605  15.378   7.362
   48   HG21  THR   7          HG21      THR   7 -11.895  13.668   5.552
   49   HG22  THR   7          HG22      THR   7 -11.730  15.142   6.545
   50   HG23  THR   7          HG23      THR   7 -12.627  13.750   7.172
   51    H    SER   8           H        SER   8 -10.806  15.466   4.057
   52    HA   SER   8           HA       SER   8 -10.253  17.854   5.534
   53    HB2  SER   8           HB2      SER   8  -7.939  17.668   4.862
   54    HB3  SER   8           HB3      SER   8  -8.549  16.073   5.343
   55    HG   SER   8           HG       SER   8  -8.676  15.632   3.004
   56    H    ASP   9           H        ASP   9 -10.407  17.064   1.946
   57    HA   ASP   9           HA       ASP   9  -9.598  19.681   1.102
   58    HB2  ASP   9           HB2      ASP   9  -9.709  17.622  -0.387
   59    HB3  ASP   9           HB3      ASP   9 -11.473  17.696  -0.328
   60    H    LEU  10           H        LEU  10 -12.858  18.212   1.721
   61    HA   LEU  10           HA       LEU  10 -14.319  20.471   0.811
   62    HB2  LEU  10           HB2      LEU  10 -15.042  18.342   2.923
   63    HB3  LEU  10           HB3      LEU  10 -16.215  19.504   2.271
   64    HG   LEU  10           HG       LEU  10 -14.694  17.559   0.442
   65   HD11  LEU  10          HD11      LEU  10 -15.868  16.138   2.092
   66   HD12  LEU  10          HD12      LEU  10 -17.374  17.071   1.891
   67   HD13  LEU  10          HD13      LEU  10 -16.752  16.069   0.556
   68   HD21  LEU  10          HD21      LEU  10 -16.563  17.907  -1.079
   69   HD22  LEU  10          HD22      LEU  10 -17.388  18.972   0.097
   70   HD23  LEU  10          HD23      LEU  10 -15.879  19.498  -0.698
   71    H    SER  11           H        SER  11 -13.048  19.584   4.119
   72    HA   SER  11           HA       SER  11 -14.153  21.965   5.310
   73    HB2  SER  11           HB2      SER  11 -12.508  21.619   7.127
   74    HB3  SER  11           HB3      SER  11 -13.463  20.148   6.778
   75    HG   SER  11           HG       SER  11 -11.168  19.656   6.911
   76    H    LYS  12           H        LYS  12 -10.998  21.219   3.549
   77    HA   LYS  12           HA       LYS  12  -9.838  23.701   4.263
   78    HB2  LYS  12           HB2      LYS  12  -8.738  21.692   3.133
   79    HB3  LYS  12           HB3      LYS  12  -9.417  22.230   1.584
   80    HG2  LYS  12           HG2      LYS  12  -7.566  23.894   3.412
   81    HG3  LYS  12           HG3      LYS  12  -6.982  22.824   2.119
   82    HD2  LYS  12           HD2      LYS  12  -8.188  24.167   0.401
   83    HD3  LYS  12           HD3      LYS  12  -8.778  25.272   1.659
   84    HE2  LYS  12           HE2      LYS  12  -6.370  25.818   2.251
   85    HE3  LYS  12           HE3      LYS  12  -5.856  24.794   0.885
   86    HZ1  LYS  12           HZ1      LYS  12  -5.923  27.133   0.215
   87    HZ2  LYS  12           HZ2      LYS  12  -7.184  26.270  -0.636
   88    HZ3  LYS  12           HZ3      LYS  12  -7.570  27.289   0.725
   89    H    GLN  13           H        GLN  13 -12.100  22.758   1.562
   90    HA   GLN  13           HA       GLN  13 -12.107  25.298   0.324
   91    HB2  GLN  13           HB2      GLN  13 -14.516  23.400   0.584
   92    HB3  GLN  13           HB3      GLN  13 -14.426  24.797  -0.517
   93    HG2  GLN  13           HG2      GLN  13 -12.504  23.716  -1.710
   94    HG3  GLN  13           HG3      GLN  13 -12.720  22.267  -0.716
   95   HE21  GLN  13          HE21      GLN  13 -15.259  22.934  -3.855
   96   HE22  GLN  13          HE22      GLN  13 -14.011  24.062  -3.518
   97    H    LYS  14           H        LYS  14 -14.171  23.943   3.039
   98    HA   LYS  14           HA       LYS  14 -15.689  26.422   3.208
   99    HB2  LYS  14           HB2      LYS  14 -15.437  24.038   5.122
  100    HB3  LYS  14           HB3      LYS  14 -16.499  25.436   5.418
  101    HG2  LYS  14           HG2      LYS  14 -17.777  24.972   3.374
  102    HG3  LYS  14           HG3      LYS  14 -16.683  23.658   2.900
  103    HD2  LYS  14           HD2      LYS  14 -17.866  23.415   5.657
  104    HD3  LYS  14           HD3      LYS  14 -19.036  23.264   4.335
  105    HE2  LYS  14           HE2      LYS  14 -17.774  21.404   3.355
  106    HE3  LYS  14           HE3      LYS  14 -16.452  21.569   4.531
  107    HZ1  LYS  14           HZ1      LYS  14 -18.760  21.281   6.072
  108    H    ASP  15           H        ASP  15 -13.300  24.934   5.574
  109    HA   ASP  15           HA       ASP  15 -12.826  26.982   7.244
  110    HB2  ASP  15           H32      ASP  15 -10.601  25.464   5.748
  111    HB3  ASP  15           H33      ASP  15 -10.413  26.307   7.296
  112    H    GLU  16           H        GLU  16 -11.589  26.829   3.781
  113    HA   GLU  16           HA       GLU  16 -10.037  29.212   4.072
  114    HB2  GLU  16           HB2      GLU  16  -9.729  27.660   2.094
  115    HB3  GLU  16           HB3      GLU  16 -11.338  28.118   1.498
  116    HG2  GLU  16           HG2      GLU  16 -10.557  30.522   1.361
  117    HG3  GLU  16           HG3      GLU  16  -8.945  29.999   1.896
  118    H    GLN  17           H        GLN  17 -13.439  28.672   2.767
  119    HA   GLN  17           HA       GLN  17 -13.923  31.415   2.333
  120    HB2  GLN  17           H42      GLN  17 -15.432  29.552   1.572
  121    HB3  GLN  17           H43      GLN  17 -15.953  29.291   3.252
  122    HG2  GLN  17           H32      GLN  17 -17.652  30.632   2.066
  123    HG3  GLN  17           H33      GLN  17 -16.887  31.670   3.282
  124   HE21  GLN  17           H61      GLN  17 -15.371  33.840   0.831
  125   HE22  GLN  17           H62      GLN  17 -15.370  33.397   2.494
  126    H    ARG  18           H        ARG  18 -14.336  29.406   5.346
  127    HA   ARG  18           HA       ARG  18 -15.583  31.470   6.854
  128    HB2  ARG  18           H42      ARG  18 -13.753  29.208   7.850
  129    HB3  ARG  18           H43      ARG  18 -14.750  30.257   8.886
  130    HG2  ARG  18           H33      ARG  18 -16.820  29.424   7.703
  131    HG3  ARG  18           H32      ARG  18 -15.823  28.258   6.794
  132    HD2  ARG  18           H52      ARG  18 -15.092  27.200   8.927
  133    HD3  ARG  18           H53      ARG  18 -16.050  28.434   9.826
  134    HE   ARG  18           H10      ARG  18 -17.737  27.009   7.975
  135   HH11  ARG  18           H71      ARG  18 -19.292  25.660   8.906
  136   HH12  ARG  18           H72      ARG  18 -19.071  25.009  10.487
  137   HH21  ARG  18           H81      ARG  18 -16.004  26.569  11.064
  138   HH22  ARG  18           H82      ARG  18 -17.265  25.552  11.732
  139    H    ALA  19           H        ALA  19 -12.086  30.600   6.358
  140    HA   ALA  19           HA       ALA  19 -11.078  32.633   8.110
  141    HB1  ALA  19           H21      ALA  19  -9.789  31.366   5.629
  142    HB2  ALA  19           H22      ALA  19  -8.929  32.351   6.850
  143    HB3  ALA  19           H23      ALA  19  -9.647  30.776   7.310
  144    H    LYS  20           H        LYS  20 -11.919  32.650   4.533
  145    HA   LYS  20           HA       LYS  20 -10.785  35.239   4.128
  146    HB2  LYS  20           H42      LYS  20 -12.984  33.767   2.593
  147    HB3  LYS  20           H43      LYS  20 -12.322  35.339   2.083
  148    HG2  LYS  20           H23      LYS  20 -10.054  34.380   1.850
  149    HG3  LYS  20           H22      LYS  20 -10.593  32.835   2.510
  150    HD2  LYS  20           H33      LYS  20 -10.452  32.629   0.089
  151    HD3  LYS  20           H32      LYS  20 -12.149  32.497   0.578
  152    HE2  LYS  20           H53      LYS  20 -11.863  33.827  -1.493
  153    HE3  LYS  20           H52      LYS  20 -12.636  34.776  -0.220
  154    HZ1  LYS  20           H71      LYS  20  -9.659  34.826  -0.831
  155    HZ2  LYS  20           H72      LYS  20 -10.815  35.921  -1.572
  156    HZ3  LYS  20           H73      LYS  20 -10.558  35.971   0.161
  157    H    LEU  21           H        LEU  21 -14.101  34.146   5.191
  158    HA   LEU  21           HA       LEU  21 -15.204  36.802   5.135
  159    HB2  LEU  21           HB2      LEU  21 -15.822  34.405   6.965
  160    HB3  LEU  21           HB3      LEU  21 -16.783  35.896   6.984
  161    HG   LEU  21           HG       LEU  21 -16.478  34.240   4.423
  162   HD11  LEU  21          HD11      LEU  21 -18.682  33.246   4.979
  163   HD12  LEU  21          HD12      LEU  21 -17.436  32.773   6.157
  164   HD13  LEU  21          HD13      LEU  21 -18.643  34.008   6.606
  165   HD21  LEU  21          HD21      LEU  21 -18.661  36.242   5.313
  166   HD22  LEU  21          HD22      LEU  21 -17.329  36.668   4.211
  167   HD23  LEU  21          HD23      LEU  21 -18.523  35.450   3.725
  168    H    PHE  22           H        PHE  22 -13.290  34.955   7.623
  169    HA   PHE  22           HA       PHE  22 -13.449  37.005   9.579
  170    HB2  PHE  22           HB2      PHE  22 -12.612  34.662   9.985
  171    HB3  PHE  22           HB3      PHE  22 -11.114  35.070   9.142
  172    HD1  PHE  22           HD1      PHE  22 -13.298  36.014  12.037
  173    HD2  PHE  22           HD2      PHE  22  -9.361  36.306  10.363
  174    HE1  PHE  22           HE1      PHE  22 -12.463  36.941  14.166
  175    HE2  PHE  22           HE2      PHE  22  -8.475  36.902  12.597
  176    HZ   PHE  22           HZ       PHE  22 -10.024  37.300  14.482
  177    H    ILE  23           H        ILE  23 -11.037  36.517   6.862
  178    HA   ILE  23           HA       ILE  23  -9.522  38.857   7.573
  179    HB   ILE  23           HB       ILE  23  -9.714  37.152   5.076
  180   HG12  ILE  23          HG12      ILE  23  -7.263  37.094   5.282
  181   HG13  ILE  23          HG13      ILE  23  -7.306  38.301   6.593
  182   HG21  ILE  23          HG21      ILE  23  -8.537  39.978   5.009
  183   HG22  ILE  23          HG22      ILE  23  -8.277  38.720   3.773
  184   HG23  ILE  23          HG23      ILE  23  -9.902  39.385   4.022
  185   HD11  ILE  23          HD11      ILE  23  -8.530  35.460   6.721
  186   HD12  ILE  23          HD12      ILE  23  -6.989  35.947   7.465
  187   HD13  ILE  23          HD13      ILE  23  -8.514  36.642   8.063
  188    H    GLU  24           H        GLU  24 -12.436  38.508   5.414
  189    HA   GLU  24           HA       GLU  24 -12.348  41.275   4.672
  190    HB2  GLU  24           HB2      GLU  24 -14.737  39.349   4.867
  191    HB3  GLU  24           HB3      GLU  24 -14.851  40.990   4.183
  192    HG2  GLU  24           HG2      GLU  24 -13.148  40.481   2.464
  193    HG3  GLU  24           HG3      GLU  24 -13.000  38.806   3.050
  194    H    TRP  25           H        TRP  25 -13.696  39.570   7.553
  195    HA   TRP  25           HA       TRP  25 -14.985  41.926   8.630
  196    HB2  TRP  25           HB2      TRP  25 -15.599  39.711   9.384
  197    HB3  TRP  25           HB3      TRP  25 -13.948  39.351   9.915
  198    HD1  TRP  25           HD1      TRP  25 -16.880  41.674  10.969
  199    HE1  TRP  25           HE1      TRP  25 -16.654  42.057  13.448
  200    HE3  TRP  25           HE3      TRP  25 -12.324  39.333  11.812
  201    HZ2  TRP  25           HZ2      TRP  25 -14.932  41.538  15.501
  202    HZ3  TRP  25           HZ3      TRP  25 -11.440  39.403  14.148
  203    HH2  TRP  25           HH2      TRP  25 -12.754  40.398  15.970
  204    H    LEU  26           H        LEU  26 -11.617  40.534   8.982
  205    HA   LEU  26           HA       LEU  26 -10.801  42.499  10.904
  206    HB2  LEU  26           HB2      LEU  26  -9.126  41.144   8.742
  207    HB3  LEU  26           HB3      LEU  26  -8.439  42.104  10.069
  208    HG   LEU  26           HG       LEU  26 -10.006  39.477  10.442
  209   HD11  LEU  26          HD11      LEU  26  -7.745  38.472  10.910
  210   HD12  LEU  26          HD12      LEU  26  -7.812  39.149   9.267
  211   HD13  LEU  26          HD13      LEU  26  -6.992  40.050  10.573
  212   HD21  LEU  26          HD21      LEU  26  -8.344  41.088  12.455
  213   HD22  LEU  26          HD22      LEU  26 -10.128  40.965  12.479
  214   HD23  LEU  26          HD23      LEU  26  -9.140  39.528  12.794
  215    H    AIB  27           H        ALA  27 -10.839  42.467   7.276
  216   HB11  AIB  27           H21      ALA  27  -8.953  45.625   7.891
  217   HB12  AIB  27           H22      ALA  27  -8.368  44.431   6.709
  218   HB13  AIB  27           H23      ALA  27  -9.027  46.000   6.164
  219   HB21  AIB  27           H31      ALA  27 -10.678  44.944   4.656
  220   HB22  AIB  27           H32      ALA  27 -10.052  43.313   5.046
  221   HB23  AIB  27           H33      ALA  27 -11.785  43.669   5.208
  222    H    ALA  28           H        ALA  28 -13.016  44.026   7.497
  223    HA   ALA  28           HA       ALA  28 -14.084  46.653   7.152
  224    HB1  ALA  28           H21      ALA  28 -15.119  44.450   9.035
  225    HB2  ALA  28           H22      ALA  28 -16.065  45.825   8.420
  226    HB3  ALA  28           H23      ALA  28 -15.494  44.566   7.292
  227    H    GLY  29           H        GLY  29 -12.017  45.364   9.741
  228    HA2  GLY  29           HA2      GLY  29 -11.399  47.436  11.177
  229    HA3  GLY  29           HA3      GLY  29 -13.091  47.324  11.705
  230    H    GLY  30           H        GLY  30 -12.955  44.145  11.448
  231    HA2  GLY  30           HA2      GLY  30 -12.342  42.443  12.907
  232    HA3  GLY  30           HA3      GLY  30 -10.993  43.467  13.438
  233    HA   PRO  31           HA       PRO  31 -14.107  43.538  16.964
  234    HB2  PRO  31           HB2      PRO  31 -11.585  44.917  18.066
  235    HB3  PRO  31           HB3      PRO  31 -12.717  43.852  18.943
  236    HG2  PRO  31           HG2      PRO  31 -10.389  42.772  18.066
  237    HG3  PRO  31           HG3      PRO  31 -11.908  41.909  17.678
  238    HD2  PRO  31           HD2      PRO  31 -10.367  43.835  15.824
  239    HD3  PRO  31           HD3      PRO  31 -10.951  42.166  15.457
  240    H    SER  32           H        SER  32 -12.019  46.120  15.428
  241    HA   SER  32           HA       SER  32 -13.395  48.309  16.660
  242    HB2  SER  32           HB2      SER  32 -11.905  48.305  13.985
  243    HB3  SER  32           HB3      SER  32 -12.194  49.691  15.073
  244    HG   SER  32           HG       SER  32 -10.040  48.659  15.400
  245    H    SER  33           H        SER  33 -14.190  46.238  13.787
  246    HA   SER  33           HA       SER  33 -15.588  48.157  12.311
  247    HB2  SER  33           HB2      SER  33 -16.877  46.309  11.298
  248    HB3  SER  33           HB3      SER  33 -15.142  45.910  11.406
  249    HG   SER  33           HG       SER  33 -16.506  44.161  12.217
  250    H    GLY  34           H        GLY  34 -16.693  46.132  15.144
  251    HA2  GLY  34           HA2      GLY  34 -18.468  46.961  16.567
  252    HA3  GLY  34           HA3      GLY  34 -19.286  47.681  15.175
  253    H    ALA  35           H        ALA  35 -18.688  45.350  13.270
  254    HA   ALA  35           HA       ALA  35 -21.074  43.907  13.945
  255    HB1  ALA  35           HB1      ALA  35 -18.962  43.249  11.838
  256    HB2  ALA  35           HB2      ALA  35 -20.600  42.545  11.955
  257    HB3  ALA  35           HB3      ALA  35 -20.401  44.282  11.599
  258    HA   PRO  36           HA       PRO  36 -18.718  40.723  16.372
  259    HB2  PRO  36           HB2      PRO  36 -20.883  38.949  15.072
  260    HB3  PRO  36           HB3      PRO  36 -20.303  38.849  16.765
  261    HG2  PRO  36           HG2      PRO  36 -22.633  40.117  16.351
  262    HG3  PRO  36           HG3      PRO  36 -21.382  40.973  17.301
  263    HD2  PRO  36           HD2      PRO  36 -22.022  41.440  14.324
  264    HD3  PRO  36           HD3      PRO  36 -21.835  42.626  15.670
  265    HA   PRO  37           HA       PRO  37 -16.477  38.861  12.908
  266    HB2  PRO  37           HB2      PRO  37 -15.201  36.663  14.103
  267    HB3  PRO  37           HB3      PRO  37 -14.808  38.341  14.573
  268    HG2  PRO  37           HG2      PRO  37 -16.830  36.500  15.922
  269    HG3  PRO  37           HG3      PRO  37 -15.423  37.307  16.696
  270    HD2  PRO  37           HD2      PRO  37 -17.898  38.450  16.832
  271    HD3  PRO  37           HD3      PRO  37 -16.480  39.508  16.453
  272    HA   PRO  38           HA       PRO  38 -19.251  35.617  11.399
  273    HB2  PRO  38           HB2      PRO  38 -17.727  34.283   9.542
  274    HB3  PRO  38           HB3      PRO  38 -18.128  36.009   9.346
  275    HG2  PRO  38           HG2      PRO  38 -15.545  34.937  10.621
  276    HG3  PRO  38           HG3      PRO  38 -15.672  36.006   9.196
  277    HD2  PRO  38           HD2      PRO  38 -15.317  37.075  11.681
  278    HD3  PRO  38           HD3      PRO  38 -16.527  37.839  10.596
  279    H    SER  39           H        SER  39 -19.304  34.740  13.678
  280    HA   SER  39           HA       SER  39 -17.973  32.068  13.833
  281    HB2  SER  39           HB2      SER  39 -17.780  34.196  16.060
  282    HB3  SER  39           HB3      SER  39 -17.252  32.499  16.162
  283    HG   SER  39           HG       SER  39 -16.172  34.417  14.326
  284    HN1  NH2  40           H11      SER  39 -20.931  30.991  15.487
  285    HN2  NH2  40           H12      SER  39 -19.484  30.502  14.708
  286    H93  EVT 101           H93      XXX  40 -20.117  17.845  12.637
  287    H92  EVT 101           H92      XXX  40 -18.832  19.059  12.493
  288   H103  EVT 101          H103      XXX  40 -20.342  20.881  13.113
  289   H102  EVT 101          H102      XXX  40 -21.761  19.817  12.989
  290    H11  EVT 101           H11      XXX  40 -20.906  18.442  14.903
  291   H122  EVT 101          H122      XXX  40 -23.174  21.912  16.753
  292   H123  EVT 101          H123      XXX  40 -24.515  21.417  15.704
  293   H133  EVT 101          H133      XXX  40 -24.865  19.362  17.091
  294   H132  EVT 101          H132      XXX  40 -25.048  20.842  18.064
  295   H143  EVT 101          H143      XXX  40 -22.725  20.572  18.953
  296   H142  EVT 101          H142      XXX  40 -22.495  19.119  17.946
  297   H153  EVT 101          H153      XXX  40 -24.312  17.952  19.174
  298   H152  EVT 101          H152      XXX  40 -24.633  19.412  20.146
  299    H6   EVT 101           H6       XXX  40 -18.713  17.789  10.328
  300   H163  EVT 101          H163      XXX  40 -22.380  19.307  21.168
  301   H162  EVT 101          H162      XXX  40 -21.922  17.946  20.112
  302   H173  EVT 101          H173      XXX  40 -23.673  16.511  21.124
  303   H172  EVT 101          H172      XXX  40 -24.156  17.837  22.221
  304   H183  EVT 101          H183      XXX  40 -21.784  17.858  23.150
  305   H182  EVT 101          H182      XXX  40 -21.410  16.435  22.152
  306   H193  EVT 101          H193      XXX  40 -23.428  16.608  24.471
  307   H192  EVT 101          H192      XXX  40 -21.881  15.736  24.420
  308   H203  EVT 101          H203      XXX  40 -22.859  14.289  22.522
  309   H202  EVT 101          H202      XXX  40 -24.449  15.028  22.878
  310   H213  EVT 101          H213      XXX  40 -24.259  14.234  25.270
  311   H212  EVT 101          H212      XXX  40 -22.703  13.471  24.858
  312   H223  EVT 101          H223      XXX  40 -23.829  12.014  23.189
  313   H222  EVT 101          H222      XXX  40 -25.413  12.733  23.596
  314    H25  EVT 101           H25      XXX  40 -21.060  21.083  16.097
  315   H293  EVT 101          H293      XXX  40 -25.244  11.859  25.925
  316   H292  EVT 101          H292      XXX  40 -23.572  11.329  25.632
  317   H303  EVT 101          H303      XXX  40 -25.029   9.389  25.605
  318   H302  EVT 101          H302      XXX  40 -24.347   9.643  23.977
  319   H313  EVT 101          H313      XXX  40 -26.513  10.614  23.210
  320   H312  EVT 101          H312      XXX  40 -27.180  10.518  24.857
  321   H321  EVT 101          H321      XXX  40 -26.272   8.104  23.154
  322   H323  EVT 101          H323      XXX  40 -27.965   8.615  23.399
  323   H322  EVT 101          H322      XXX  40 -27.007   7.999  24.772
  324   H353  EVT 101          H353      XXX  40 -18.803  17.583   5.985
  325   H352  EVT 101          H352      XXX  40 -19.967  18.913   6.005
  326   H363  EVT 101          H363      XXX  40 -18.509  19.901   7.968
  327   H362  EVT 101          H362      XXX  40 -17.700  18.317   7.996
  328    H37  EVT 101           H37      XXX  40 -20.696  18.864   8.333
  Start of MODEL    2
    1    H1   HIS   1           H1       HIS   1 -10.878   6.811   7.710
    2    H2   HIS   1           H2       HIS   1 -10.788   8.126   6.566
    3    H3   HIS   1           H3       HIS   1 -11.995   8.129   7.822
    4    HA   HIS   1           HA       HIS   1 -11.849   6.099   5.592
    5    HB2  HIS   1           HB2      HIS   1 -14.189   6.779   7.476
    6    HB3  HIS   1           HB3      HIS   1 -14.108   5.427   6.321
    7    HD1  HIS   1           HD1      HIS   1 -11.672   3.975   6.891
    8    HD2  HIS   1           HD2      HIS   1 -13.859   5.883   9.933
    9    HE1  HIS   1           HE1      HIS   1 -10.986   2.846   9.058
   10    H    AIB   2           H        AIB   2 -13.891   6.425   4.048
   11   HB11  AIB   2           H31      AIB   2 -16.290   8.369   2.093
   12   HB12  AIB   2           H32      AIB   2 -15.256   6.935   1.905
   13   HB13  AIB   2           H33      AIB   2 -16.327   7.074   3.316
   14   HB21  AIB   2           H21      AIB   2 -13.110   8.227   1.767
   15   HB22  AIB   2           H22      AIB   2 -14.074   9.725   1.774
   16   HB23  AIB   2           H23      AIB   2 -12.749   9.503   2.952
   17    H    GLN   3           H        GLN   3 -15.979   8.027   5.572
   18    HA   GLN   3           HA       GLN   3 -17.255  10.560   5.681
   19    HB2  GLN   3           H42      GLN   3 -18.031   8.584   6.930
   20    HB3  GLN   3           H43      GLN   3 -16.577   8.575   7.944
   21    HG2  GLN   3           H32      GLN   3 -18.528  10.949   7.886
   22    HG3  GLN   3           H33      GLN   3 -18.703   9.580   9.002
   23   HE21  GLN   3           H61      GLN   3 -15.956  12.391   9.973
   24   HE22  GLN   3           H62      GLN   3 -16.916  12.615   8.565
   25    H    GLY   4           H        GLY   4 -14.222   9.367   7.357
   26    HA2  GLY   4           HA2      GLY   4 -13.737  11.731   8.786
   27    HA3  GLY   4           HA3      GLY   4 -12.475  10.596   8.285
   28    H    THR   5           H        THR   5 -12.140  10.717   5.601
   29    HA   THR   5           HA       THR   5 -10.774  13.125   5.356
   30    HB   THR   5           HB       THR   5 -11.857  11.757   2.862
   31    HG1  THR   5           HG1      THR   5 -10.208  10.127   3.258
   32   HG21  THR   5          HG21      THR   5  -9.590  12.298   1.971
   33   HG22  THR   5          HG22      THR   5 -10.267  13.785   2.695
   34   HG23  THR   5          HG23      THR   5  -9.063  12.836   3.589
   35    H    PHE   6           H        PHE   6 -14.172  12.225   4.378
   36    HA   PHE   6           HA       PHE   6 -14.610  14.565   2.778
   37    HB2  PHE   6           HB2      PHE   6 -16.649  13.002   4.462
   38    HB3  PHE   6           HB3      PHE   6 -17.029  14.256   3.247
   39    HD1  PHE   6           HD1      PHE   6 -18.262  11.621   3.300
   40    HD2  PHE   6           HD2      PHE   6 -14.658  12.857   1.282
   41    HE1  PHE   6           HE1      PHE   6 -18.606   9.862   1.589
   42    HE2  PHE   6           HE2      PHE   6 -15.135  11.271  -0.536
   43    HZ   PHE   6           HZ       PHE   6 -17.092   9.736  -0.383
   44    H    THR   7           H        THR   7 -15.409  14.074   6.395
   45    HA   THR   7           HA       THR   7 -16.189  16.826   6.543
   46    HB   THR   7           HB       THR   7 -16.789  15.194   8.339
   47    HG1  THR   7           HG1      THR   7 -15.469  17.575   9.228
   48   HG21  THR   7          HG21      THR   7 -15.131  14.802  10.196
   49   HG22  THR   7          HG22      THR   7 -14.620  14.016   8.689
   50   HG23  THR   7          HG23      THR   7 -13.834  15.519   9.224
   51    H    SER   8           H        SER   8 -12.951  15.224   6.701
   52    HA   SER   8           HA       SER   8 -11.615  17.450   7.875
   53    HB2  SER   8           HB2      SER   8 -10.604  15.202   7.635
   54    HB3  SER   8           HB3      SER   8 -10.471  15.441   5.881
   55    HG   SER   8           HG       SER   8  -9.067  17.288   6.406
   56    H    ASP   9           H        ASP   9 -12.277  16.521   4.423
   57    HA   ASP   9           HA       ASP   9 -10.884  18.832   3.336
   58    HB2  ASP   9           HB2      ASP   9 -11.189  16.628   2.151
   59    HB3  ASP   9           HB3      ASP   9 -12.946  16.896   2.100
   60    H    LEU  10           H        LEU  10 -14.378  17.974   3.874
   61    HA   LEU  10           HA       LEU  10 -15.364  20.354   2.581
   62    HB2  LEU  10           HB2      LEU  10 -16.602  18.541   4.732
   63    HB3  LEU  10           HB3      LEU  10 -17.500  19.823   3.912
   64    HG   LEU  10           HG       LEU  10 -16.161  17.595   2.264
   65   HD11  LEU  10          HD11      LEU  10 -17.642  16.483   3.926
   66   HD12  LEU  10          HD12      LEU  10 -18.994  17.555   3.460
   67   HD13  LEU  10          HD13      LEU  10 -18.336  16.372   2.292
   68   HD21  LEU  10          HD21      LEU  10 -17.951  18.187   0.620
   69   HD22  LEU  10          HD22      LEU  10 -18.583  19.419   1.735
   70   HD23  LEU  10          HD23      LEU  10 -16.972  19.621   1.011
   71    H    SER  11           H        SER  11 -14.600  19.499   6.056
   72    HA   SER  11           HA       SER  11 -15.357  22.058   7.024
   73    HB2  SER  11           HB2      SER  11 -14.084  21.673   9.022
   74    HB3  SER  11           HB3      SER  11 -14.867  20.135   8.591
   75    HG   SER  11           HG       SER  11 -12.729  19.562   7.652
   76    H    LYS  12           H        LYS  12 -12.256  20.861   5.461
   77    HA   LYS  12           HA       LYS  12 -10.834  23.251   6.076
   78    HB2  LYS  12           HB2      LYS  12  -9.875  21.092   5.290
   79    HB3  LYS  12           HB3      LYS  12 -10.447  21.421   3.645
   80    HG2  LYS  12           HG2      LYS  12  -8.626  23.340   5.215
   81    HG3  LYS  12           HG3      LYS  12  -7.982  21.959   4.316
   82    HD2  LYS  12           HD2      LYS  12  -8.878  22.836   2.167
   83    HD3  LYS  12           HD3      LYS  12  -9.570  24.242   3.008
   84    HE2  LYS  12           HE2      LYS  12  -7.256  24.908   3.746
   85    HE3  LYS  12           HE3      LYS  12  -6.594  23.499   2.877
   86    HZ1  LYS  12           HZ1      LYS  12  -7.401  24.433   0.754
   87    HZ2  LYS  12           HZ2      LYS  12  -8.110  25.795   1.585
   88    HZ3  LYS  12           HZ3      LYS  12  -6.383  25.573   1.567
   89    H    GLN  13           H        GLN  13 -13.143  22.382   3.353
   90    HA   GLN  13           HA       GLN  13 -12.731  24.872   1.997
   91    HB2  GLN  13           HB2      GLN  13 -15.338  23.279   2.172
   92    HB3  GLN  13           HB3      GLN  13 -15.031  24.638   1.077
   93    HG2  GLN  13           HG2      GLN  13 -13.096  23.282   0.078
   94    HG3  GLN  13           HG3      GLN  13 -13.741  21.871   0.964
   95   HE21  GLN  13          HE21      GLN  13 -16.885  22.001  -1.066
   96   HE22  GLN  13          HE22      GLN  13 -16.523  21.986   0.612
   97    H    LYS  14           H        LYS  14 -15.107  23.887   4.637
   98    HA   LYS  14           HA       LYS  14 -16.330  26.473   4.604
   99    HB2  LYS  14           HB2      LYS  14 -16.286  24.262   6.715
  100    HB3  LYS  14           HB3      LYS  14 -17.052  25.833   7.037
  101    HG2  LYS  14           HG2      LYS  14 -18.588  25.617   5.202
  102    HG3  LYS  14           HG3      LYS  14 -17.763  24.193   4.538
  103    HD2  LYS  14           HD2      LYS  14 -19.004  24.102   7.334
  104    HD3  LYS  14           HD3      LYS  14 -20.041  23.918   5.912
  105    HE2  LYS  14           HE2      LYS  14 -18.758  22.004   5.073
  106    HE3  LYS  14           HE3      LYS  14 -17.638  22.082   6.451
  107    HZ1  LYS  14           HZ1      LYS  14 -19.944  21.811   7.760
  108    H    ASP  15           H        ASP  15 -13.641  25.179   6.732
  109    HA   ASP  15           HA       ASP  15 -13.073  27.563   8.066
  110    HB2  ASP  15           H32      ASP  15 -11.196  25.399   6.996
  111    HB3  ASP  15           H33      ASP  15 -10.601  26.778   7.922
  112    H    GLU  16           H        GLU  16 -12.188  26.577   4.650
  113    HA   GLU  16           HA       GLU  16 -10.310  28.678   4.270
  114    HB2  GLU  16           HB2      GLU  16 -10.531  26.702   2.743
  115    HB3  GLU  16           HB3      GLU  16 -12.058  27.359   2.111
  116    HG2  GLU  16           HG2      GLU  16 -10.800  29.453   1.366
  117    HG3  GLU  16           HG3      GLU  16  -9.304  28.671   1.926
  118    H    GLN  17           H        GLN  17 -13.857  28.456   3.363
  119    HA   GLN  17           HA       GLN  17 -14.065  31.152   2.467
  120    HB2  GLN  17           H42      GLN  17 -15.897  29.616   2.032
  121    HB3  GLN  17           H43      GLN  17 -16.064  29.242   3.772
  122    HG2  GLN  17           H32      GLN  17 -17.942  30.628   3.147
  123    HG3  GLN  17           H33      GLN  17 -16.900  31.620   4.159
  124   HE21  GLN  17           H61      GLN  17 -15.965  33.772   1.316
  125   HE22  GLN  17           H62      GLN  17 -15.273  33.142   2.752
  126    H    ARG  18           H        ARG  18 -14.468  29.672   5.760
  127    HA   ARG  18           HA       ARG  18 -15.472  32.096   6.898
  128    HB2  ARG  18           H42      ARG  18 -14.177  29.633   8.171
  129    HB3  ARG  18           H43      ARG  18 -14.893  30.939   9.128
  130    HG2  ARG  18           H33      ARG  18 -17.087  30.629   8.177
  131    HG3  ARG  18           H32      ARG  18 -16.519  29.530   6.920
  132    HD2  ARG  18           H52      ARG  18 -15.894  27.838   8.595
  133    HD3  ARG  18           H53      ARG  18 -16.554  28.887   9.904
  134    HE   ARG  18           H10      ARG  18 -18.597  28.621   7.946
  135   HH11  ARG  18           H71      ARG  18 -20.230  27.089   8.110
  136   HH12  ARG  18           H72      ARG  18 -20.060  25.715   9.142
  137   HH21  ARG  18           H81      ARG  18 -16.842  26.536  10.232
  138   HH22  ARG  18           H82      ARG  18 -18.152  25.375  10.327
  139    H    ALA  19           H        ALA  19 -12.098  30.813   6.520
  140    HA   ALA  19           HA       ALA  19 -10.902  32.917   8.067
  141    HB1  ALA  19           H21      ALA  19  -8.852  32.492   6.655
  142    HB2  ALA  19           H22      ALA  19  -9.518  31.004   7.365
  143    HB3  ALA  19           H23      ALA  19  -9.801  31.373   5.639
  144    H    LYS  20           H        LYS  20 -11.883  32.646   4.546
  145    HA   LYS  20           HA       LYS  20 -10.758  35.210   3.915
  146    HB2  LYS  20           H42      LYS  20 -12.918  33.628   2.450
  147    HB3  LYS  20           H43      LYS  20 -12.167  35.122   1.838
  148    HG2  LYS  20           H23      LYS  20  -9.917  34.047   1.864
  149    HG3  LYS  20           H22      LYS  20 -10.598  32.582   2.587
  150    HD2  LYS  20           H33      LYS  20 -10.355  31.998   0.313
  151    HD3  LYS  20           H32      LYS  20 -12.090  32.348   0.480
  152    HE2  LYS  20           H53      LYS  20 -11.582  34.701  -0.453
  153    HE3  LYS  20           H52      LYS  20  -9.882  34.197  -0.633
  154    HZ1  LYS  20           H71      LYS  20 -11.023  34.000  -2.742
  155    HZ2  LYS  20           H72      LYS  20 -10.616  32.398  -2.154
  156    HZ3  LYS  20           H73      LYS  20 -12.266  32.988  -2.035
  157    H    LEU  21           H        LEU  21 -14.029  34.226   5.160
  158    HA   LEU  21           HA       LEU  21 -15.128  36.899   4.908
  159    HB2  LEU  21           HB2      LEU  21 -15.744  34.689   6.952
  160    HB3  LEU  21           HB3      LEU  21 -16.709  36.161   6.774
  161    HG   LEU  21           HG       LEU  21 -16.388  34.030   4.596
  162   HD11  LEU  21          HD11      LEU  21 -17.616  33.121   6.557
  163   HD12  LEU  21          HD12      LEU  21 -18.714  34.521   6.538
  164   HD13  LEU  21          HD13      LEU  21 -18.717  33.355   5.183
  165   HD21  LEU  21          HD21      LEU  21 -16.965  36.241   3.571
  166   HD22  LEU  21          HD22      LEU  21 -18.376  35.171   3.544
  167   HD23  LEU  21          HD23      LEU  21 -18.269  36.457   4.763
  168    H    PHE  22           H        PHE  22 -13.272  35.121   7.485
  169    HA   PHE  22           HA       PHE  22 -13.450  37.158   9.428
  170    HB2  PHE  22           HB2      PHE  22 -12.568  34.833   9.838
  171    HB3  PHE  22           HB3      PHE  22 -11.088  35.254   8.954
  172    HD1  PHE  22           HD1      PHE  22 -13.245  36.222  11.901
  173    HD2  PHE  22           HD2      PHE  22  -9.343  36.543  10.134
  174    HE1  PHE  22           HE1      PHE  22 -12.288  36.762  14.120
  175    HE2  PHE  22           HE2      PHE  22  -8.363  36.929  12.386
  176    HZ   PHE  22           HZ       PHE  22  -9.843  37.128  14.359
  177    H    ILE  23           H        ILE  23 -11.090  36.642   6.686
  178    HA   ILE  23           HA       ILE  23  -9.479  38.921   7.336
  179    HB   ILE  23           HB       ILE  23  -9.819  37.217   4.864
  180   HG12  ILE  23          HG12      ILE  23  -7.345  37.179   4.931
  181   HG13  ILE  23          HG13      ILE  23  -7.324  38.394   6.227
  182   HG21  ILE  23          HG21      ILE  23  -8.692  40.045   4.681
  183   HG22  ILE  23          HG22      ILE  23  -8.452  38.773   3.455
  184   HG23  ILE  23          HG23      ILE  23 -10.083  39.387   3.786
  185   HD11  ILE  23          HD11      ILE  23  -8.450  36.744   7.777
  186   HD12  ILE  23          HD12      ILE  23  -8.487  35.549   6.455
  187   HD13  ILE  23          HD13      ILE  23  -6.928  36.100   7.109
  188    H    GLU  24           H        GLU  24 -12.438  38.702   5.161
  189    HA   GLU  24           HA       GLU  24 -12.280  41.471   4.490
  190    HB2  GLU  24           HB2      GLU  24 -14.785  39.683   4.768
  191    HB3  GLU  24           HB3      GLU  24 -14.791  41.369   4.181
  192    HG2  GLU  24           HG2      GLU  24 -13.195  40.676   2.345
  193    HG3  GLU  24           HG3      GLU  24 -13.318  38.990   2.906
  194    H    TRP  25           H        TRP  25 -13.628  39.759   7.370
  195    HA   TRP  25           HA       TRP  25 -14.816  42.159   8.534
  196    HB2  TRP  25           HB2      TRP  25 -15.551  39.903   9.121
  197    HB3  TRP  25           HB3      TRP  25 -13.925  39.482   9.692
  198    HD1  TRP  25           HD1      TRP  25 -16.890  41.693  10.785
  199    HE1  TRP  25           HE1      TRP  25 -16.755  41.917  13.296
  200    HE3  TRP  25           HE3      TRP  25 -12.260  39.493  11.581
  201    HZ2  TRP  25           HZ2      TRP  25 -15.074  41.240  15.358
  202    HZ3  TRP  25           HZ3      TRP  25 -11.436  39.389  13.940
  203    HH2  TRP  25           HH2      TRP  25 -12.904  40.087  15.805
  204    H    LEU  26           H        LEU  26 -11.496  40.646   8.817
  205    HA   LEU  26           HA       LEU  26 -10.637  42.563  10.810
  206    HB2  LEU  26           HB2      LEU  26  -8.996  41.184   8.623
  207    HB3  LEU  26           HB3      LEU  26  -8.306  42.130   9.962
  208    HG   LEU  26           HG       LEU  26  -9.891  39.527  10.337
  209   HD11  LEU  26          HD11      LEU  26  -6.851  40.051  10.368
  210   HD12  LEU  26          HD12      LEU  26  -7.642  38.508  10.764
  211   HD13  LEU  26          HD13      LEU  26  -7.743  39.146   9.113
  212   HD21  LEU  26          HD21      LEU  26  -8.182  41.125  12.342
  213   HD22  LEU  26          HD22      LEU  26  -9.963  40.998  12.397
  214   HD23  LEU  26          HD23      LEU  26  -8.966  39.556  12.650
  215    H    AIB  27           H        ALA  27 -10.678  42.552   7.185
  216   HB11  AIB  27           H21      ALA  27  -8.642  45.617   7.821
  217   HB12  AIB  27           H22      ALA  27  -8.091  44.341   6.705
  218   HB13  AIB  27           H23      ALA  27  -8.638  45.917   6.072
  219   HB21  AIB  27           H31      ALA  27 -10.381  45.049   4.579
  220   HB22  AIB  27           H32      ALA  27  -9.852  43.382   4.955
  221   HB23  AIB  27           H33      ALA  27 -11.561  43.837   5.124
  222    H    ALA  28           H        ALA  28 -12.744  44.221   7.463
  223    HA   ALA  28           HA       ALA  28 -13.661  46.911   7.148
  224    HB1  ALA  28           H21      ALA  28 -14.789  44.717   8.994
  225    HB2  ALA  28           H22      ALA  28 -15.657  46.169   8.434
  226    HB3  ALA  28           H23      ALA  28 -15.191  44.900   7.265
  227    H    GLY  29           H        GLY  29 -11.723  45.423   9.751
  228    HA2  GLY  29           HA2      GLY  29 -11.107  47.480  11.314
  229    HA3  GLY  29           HA3      GLY  29 -12.816  47.294  11.779
  230    H    GLY  30           H        GLY  30 -12.756  44.212  11.420
  231    HA2  GLY  30           HA2      GLY  30 -12.209  42.419  12.819
  232    HA3  GLY  30           HA3      GLY  30 -10.899  43.399  13.530
  233    HA   PRO  31           HA       PRO  31 -14.442  43.329  16.632
  234    HB2  PRO  31           HB2      PRO  31 -12.133  44.597  18.186
  235    HB3  PRO  31           HB3      PRO  31 -13.360  43.451  18.800
  236    HG2  PRO  31           HG2      PRO  31 -10.883  42.467  18.172
  237    HG3  PRO  31           HG3      PRO  31 -12.333  41.615  17.581
  238    HD2  PRO  31           HD2      PRO  31 -10.577  43.591  16.019
  239    HD3  PRO  31           HD3      PRO  31 -11.184  41.975  15.497
  240    H    SER  32           H        SER  32 -12.212  46.003  15.542
  241    HA   SER  32           HA       SER  32 -13.703  48.141  16.703
  242    HB2  SER  32           HB2      SER  32 -12.036  48.122  14.116
  243    HB3  SER  32           HB3      SER  32 -12.703  49.575  14.903
  244    HG   SER  32           HG       SER  32 -10.822  47.848  16.172
  245    H    SER  33           H        SER  33 -14.249  46.183  13.673
  246    HA   SER  33           HA       SER  33 -16.000  48.080  12.497
  247    HB2  SER  33           HB2      SER  33 -16.799  46.252  11.054
  248    HB3  SER  33           HB3      SER  33 -15.024  46.237  11.223
  249    HG   SER  33           HG       SER  33 -15.891  44.085  11.570
  250    H    GLY  34           H        GLY  34 -16.626  46.071  15.370
  251    HA2  GLY  34           HA2      GLY  34 -18.422  46.929  16.710
  252    HA3  GLY  34           HA3      GLY  34 -19.427  47.158  15.277
  253    H    ALA  35           H        ALA  35 -19.007  44.610  13.930
  254    HA   ALA  35           HA       ALA  35 -20.984  43.202  15.530
  255    HB1  ALA  35           HB1      ALA  35 -19.718  42.417  12.865
  256    HB2  ALA  35           HB2      ALA  35 -21.141  41.661  13.637
  257    HB3  ALA  35           HB3      ALA  35 -21.222  43.359  13.085
  258    HA   PRO  36           HA       PRO  36 -17.923  40.148  17.196
  259    HB2  PRO  36           HB2      PRO  36 -20.254  38.291  16.391
  260    HB3  PRO  36           HB3      PRO  36 -19.258  38.171  17.878
  261    HG2  PRO  36           HG2      PRO  36 -21.677  39.291  18.118
  262    HG3  PRO  36           HG3      PRO  36 -20.268  40.190  18.762
  263    HD2  PRO  36           HD2      PRO  36 -21.665  40.651  16.043
  264    HD3  PRO  36           HD3      PRO  36 -21.234  41.843  17.331
  265    HA   PRO  37           HA       PRO  37 -16.311  38.806  13.299
  266    HB2  PRO  37           HB2      PRO  37 -15.110  36.280  13.812
  267    HB3  PRO  37           HB3      PRO  37 -14.459  37.871  14.337
  268    HG2  PRO  37           HG2      PRO  37 -16.210  35.953  15.945
  269    HG3  PRO  37           HG3      PRO  37 -14.649  36.666  16.456
  270    HD2  PRO  37           HD2      PRO  37 -16.988  37.806  17.254
  271    HD3  PRO  37           HD3      PRO  37 -15.677  38.906  16.661
  272    HA   PRO  38           HA       PRO  38 -19.475  36.415  11.401
  273    HB2  PRO  38           HB2      PRO  38 -18.333  35.603   8.995
  274    HB3  PRO  38           HB3      PRO  38 -18.628  37.328   9.401
  275    HG2  PRO  38           HG2      PRO  38 -16.016  35.792   9.770
  276    HG3  PRO  38           HG3      PRO  38 -16.228  37.325   8.884
  277    HD2  PRO  38           HD2      PRO  38 -15.410  37.275  11.510
  278    HD3  PRO  38           HD3      PRO  38 -16.595  38.535  10.968
  279    H    SER  39           H        SER  39 -20.185  34.190  10.856
  280    HA   SER  39           HA       SER  39 -20.280  31.931  11.416
  281    HB2  SER  39           HB2      SER  39 -17.396  31.949  10.417
  282    HB3  SER  39           HB3      SER  39 -18.542  30.601  10.391
  283    HG   SER  39           HG       SER  39 -18.846  33.021   8.858
  284    HN1  NH2  40           H11      SER  39 -18.974  32.428  14.801
  285    HN2  NH2  40           H12      SER  39 -20.058  33.269  13.762
  286    H93  EVT 101           H93      XXX  40 -18.533  17.729  12.942
  287    H92  EVT 101           H92      XXX  40 -18.284  15.984  12.765
  288   H103  EVT 101          H103      XXX  40 -15.948  16.353  11.991
  289   H102  EVT 101          H102      XXX  40 -16.165  18.118  12.014
  290    H11  EVT 101           H11      XXX  40 -16.415  16.309  14.476
  291   H122  EVT 101          H122      XXX  40 -16.529  20.454  16.666
  292   H123  EVT 101          H123      XXX  40 -18.129  19.898  16.122
  293   H133  EVT 101          H133      XXX  40 -18.174  18.380  18.240
  294   H132  EVT 101          H132      XXX  40 -18.387  20.129  18.482
  295   H143  EVT 101          H143      XXX  40 -16.014  20.406  19.100
  296   H142  EVT 101          H142      XXX  40 -15.727  18.661  18.896
  297   H153  EVT 101          H153      XXX  40 -17.298  18.129  20.731
  298   H152  EVT 101          H152      XXX  40 -17.792  19.839  20.871
  299    H6   EVT 101           H6       XXX  40 -18.296  19.141  10.956
  300   H163  EVT 101          H163      XXX  40 -15.544  20.515  21.583
  301   H162  EVT 101          H162      XXX  40 -14.921  18.866  21.376
  302   H173  EVT 101          H173      XXX  40 -16.302  17.988  23.143
  303   H172  EVT 101          H172      XXX  40 -17.230  19.503  23.317
  304   H183  EVT 101          H183      XXX  40 -15.222  20.704  24.115
  305   H182  EVT 101          H182      XXX  40 -14.214  19.261  23.905
  306   H193  EVT 101          H193      XXX  40 -16.632  19.408  25.833
  307   H192  EVT 101          H192      XXX  40 -14.942  19.717  26.298
  308   H203  EVT 101          H203      XXX  40 -14.398  17.358  25.409
  309   H202  EVT 101          H202      XXX  40 -16.157  17.072  25.346
  310   H213  EVT 101          H213      XXX  40 -16.313  17.616  27.827
  311   H212  EVT 101          H212      XXX  40 -14.553  17.839  27.851
  312   H223  EVT 101          H223      XXX  40 -14.401  15.410  26.882
  313   H222  EVT 101          H222      XXX  40 -16.124  15.236  27.287
  314    H25  EVT 101           H25      XXX  40 -16.881  19.177  14.145
  315   H293  EVT 101          H293      XXX  40 -15.527  15.726  29.714
  316   H292  EVT 101          H292      XXX  40 -13.820  15.895  29.230
  317   H303  EVT 101          H303      XXX  40 -13.855  13.508  28.359
  318   H302  EVT 101          H302      XXX  40 -15.535  13.352  28.927
  319   H313  EVT 101          H313      XXX  40 -14.797  13.710  31.279
  320   H312  EVT 101          H312      XXX  40 -13.110  13.980  30.749
  321   H321  EVT 101          H321      XXX  40 -14.680  11.367  30.332
  322   H323  EVT 101          H323      XXX  40 -13.443  11.638  31.591
  323   H322  EVT 101          H322      XXX  40 -12.978  11.653  29.866
  324   H353  EVT 101          H353      XXX  40 -20.832  18.311   6.966
  325   H352  EVT 101          H352      XXX  40 -21.713  19.772   7.447
  326   H363  EVT 101          H363      XXX  40 -20.898  18.403   9.389
  327   H362  EVT 101          H362      XXX  40 -20.268  20.061   9.414
  328    H37  EVT 101           H37      XXX  40 -18.724  17.602   8.416
  Start of MODEL    3
    1    H1   HIS   1           H1       HIS   1  -9.973   6.713   8.651
    2    H2   HIS   1           H2       HIS   1  -9.970   7.809   7.327
    3    H3   HIS   1           H3       HIS   1 -11.017   8.100   8.687
    4    HA   HIS   1           HA       HIS   1 -11.242   5.698   6.860
    5    HB2  HIS   1           HB2      HIS   1 -13.384   6.938   8.699
    6    HB3  HIS   1           HB3      HIS   1 -13.407   5.319   7.957
    7    HD1  HIS   1           HD1      HIS   1 -10.781   4.166   8.788
    8    HD2  HIS   1           HD2      HIS   1 -13.168   6.547  11.290
    9    HE1  HIS   1           HE1      HIS   1 -10.085   3.592  11.160
   10    H    AIB   2           H        AIB   2 -13.589   5.935   5.629
   11   HB11  AIB   2           H31      AIB   2 -15.903   7.697   3.422
   12   HB12  AIB   2           H32      AIB   2 -15.095   6.114   3.527
   13   HB13  AIB   2           H33      AIB   2 -15.997   6.734   4.920
   14   HB21  AIB   2           H21      AIB   2 -12.892   7.059   2.895
   15   HB22  AIB   2           H22      AIB   2 -13.645   8.660   2.634
   16   HB23  AIB   2           H23      AIB   2 -12.203   8.496   3.671
   17    H    GLN   3           H        GLN   3 -15.197   7.947   6.904
   18    HA   GLN   3           HA       GLN   3 -16.231  10.564   6.795
   19    HB2  GLN   3           H42      GLN   3 -16.897   8.906   8.475
   20    HB3  GLN   3           H43      GLN   3 -15.282   8.881   9.200
   21    HG2  GLN   3           H32      GLN   3 -16.956  11.447   9.088
   22    HG3  GLN   3           H33      GLN   3 -17.145  10.265  10.395
   23   HE21  GLN   3           H61      GLN   3 -13.946  12.765  10.578
   24   HE22  GLN   3           H62      GLN   3 -15.058  12.912   9.273
   25    H    GLY   4           H        GLY   4 -13.044   9.437   8.210
   26    HA2  GLY   4           HA2      GLY   4 -12.087  11.885   9.067
   27    HA3  GLY   4           HA3      GLY   4 -11.045  10.619   8.387
   28    H    THR   5           H        THR   5 -11.967  10.521   5.680
   29    HA   THR   5           HA       THR   5 -10.423  12.739   4.687
   30    HB   THR   5           HB       THR   5 -12.209  10.807   3.135
   31    HG1  THR   5           HG1      THR   5 -10.134   9.653   2.968
   32   HG21  THR   5          HG21      THR   5 -11.646  12.697   1.703
   33   HG22  THR   5          HG22      THR   5  -9.938  12.671   2.226
   34   HG23  THR   5          HG23      THR   5 -10.591  11.356   1.213
   35    H    PHE   6           H        PHE   6 -14.028  12.015   4.779
   36    HA   PHE   6           HA       PHE   6 -14.774  14.179   3.134
   37    HB2  PHE   6           HB2      PHE   6 -16.270  12.832   5.456
   38    HB3  PHE   6           HB3      PHE   6 -16.898  14.295   4.676
   39    HD1  PHE   6           HD1      PHE   6 -17.220  14.371   2.169
   40    HD2  PHE   6           HD2      PHE   6 -16.650  10.694   4.324
   41    HE1  PHE   6           HE1      PHE   6 -18.225  13.099   0.290
   42    HE2  PHE   6           HE2      PHE   6 -17.501   9.418   2.382
   43    HZ   PHE   6           HZ       PHE   6 -18.254  10.619   0.344
   44    H    THR   7           H        THR   7 -14.448  14.143   6.797
   45    HA   THR   7           HA       THR   7 -14.968  16.945   6.924
   46    HB   THR   7           HB       THR   7 -15.139  15.392   8.916
   47    HG1  THR   7           HG1      THR   7 -13.615  17.770   9.272
   48   HG21  THR   7          HG21      THR   7 -13.066  15.016  10.266
   49   HG22  THR   7          HG22      THR   7 -12.940  14.184   8.697
   50   HG23  THR   7          HG23      THR   7 -12.059  15.700   8.978
   51    H    SER   8           H        SER   8 -11.924  15.167   6.211
   52    HA   SER   8           HA       SER   8 -10.170  17.265   6.953
   53    HB2  SER   8           HB2      SER   8  -9.873  15.194   4.719
   54    HB3  SER   8           HB3      SER   8  -8.627  16.373   5.187
   55    HG   SER   8           HG       SER   8  -9.725  14.440   7.009
   56    H    ASP   9           H        ASP   9 -11.750  16.618   3.683
   57    HA   ASP   9           HA       ASP   9 -10.649  19.112   2.676
   58    HB2  ASP   9           HB2      ASP   9 -11.247  17.152   1.180
   59    HB3  ASP   9           HB3      ASP   9 -12.962  17.483   1.499
   60    H    LEU  10           H        LEU  10 -13.915  18.108   4.014
   61    HA   LEU  10           HA       LEU  10 -15.150  20.570   3.190
   62    HB2  LEU  10           HB2      LEU  10 -15.851  18.678   5.502
   63    HB3  LEU  10           HB3      LEU  10 -16.888  20.019   5.000
   64    HG   LEU  10           HG       LEU  10 -16.110  17.897   2.965
   65   HD11  LEU  10          HD11      LEU  10 -17.188  16.731   4.875
   66   HD12  LEU  10          HD12      LEU  10 -18.589  17.844   4.798
   67   HD13  LEU  10          HD13      LEU  10 -18.248  16.735   3.435
   68   HD21  LEU  10          HD21      LEU  10 -18.101  18.654   1.765
   69   HD22  LEU  10          HD22      LEU  10 -18.577  19.725   3.116
   70   HD23  LEU  10          HD23      LEU  10 -17.132  20.093   2.146
   71    H    SER  11           H        SER  11 -13.522  19.601   6.289
   72    HA   SER  11           HA       SER  11 -13.922  22.075   7.593
   73    HB2  SER  11           HB2      SER  11 -11.958  21.666   8.935
   74    HB3  SER  11           HB3      SER  11 -12.877  20.151   8.767
   75    HG   SER  11           HG       SER  11 -11.240  19.570   7.117
   76    H    LYS  12           H        LYS  12 -11.381  21.022   5.132
   77    HA   LYS  12           HA       LYS  12  -9.953  23.472   5.302
   78    HB2  LYS  12           HB2      LYS  12  -9.196  21.279   4.311
   79    HB3  LYS  12           HB3      LYS  12 -10.148  21.642   2.858
   80    HG2  LYS  12           HG2      LYS  12  -7.932  23.442   4.008
   81    HG3  LYS  12           HG3      LYS  12  -7.634  22.144   2.839
   82    HD2  LYS  12           HD2      LYS  12  -9.046  23.226   1.118
   83    HD3  LYS  12           HD3      LYS  12  -9.439  24.556   2.226
   84    HE2  LYS  12           HE2      LYS  12  -6.993  25.127   2.376
   85    HE3  LYS  12           HE3      LYS  12  -6.646  23.853   1.178
   86    HZ1  LYS  12           HZ1      LYS  12  -6.804  26.024   0.092
   87    HZ2  LYS  12           HZ2      LYS  12  -8.135  25.030  -0.431
   88    HZ3  LYS  12           HZ3      LYS  12  -8.376  26.316   0.742
   89    H    GLN  13           H        GLN  13 -12.816  22.454   3.214
   90    HA   GLN  13           HA       GLN  13 -12.897  24.871   1.738
   91    HB2  GLN  13           HB2      GLN  13 -15.325  23.216   2.683
   92    HB3  GLN  13           HB3      GLN  13 -15.367  24.603   1.574
   93    HG2  GLN  13           HG2      GLN  13 -13.816  23.288  -0.008
   94    HG3  GLN  13           HG3      GLN  13 -14.079  21.865   1.042
   95   HE21  GLN  13          HE21      GLN  13 -17.227  23.334  -1.228
   96   HE22  GLN  13          HE22      GLN  13 -15.947  24.410  -0.815
   97    H    LYS  14           H        LYS  14 -14.342  23.957   4.978
   98    HA   LYS  14           HA       LYS  14 -15.645  26.533   5.175
   99    HB2  LYS  14           HB2      LYS  14 -15.122  24.347   7.255
  100    HB3  LYS  14           HB3      LYS  14 -15.963  25.872   7.627
  101    HG2  LYS  14           HG2      LYS  14 -17.675  25.460   5.954
  102    HG3  LYS  14           HG3      LYS  14 -16.856  24.010   5.335
  103    HD2  LYS  14           HD2      LYS  14 -17.931  24.261   8.215
  104    HD3  LYS  14           HD3      LYS  14 -18.916  23.639   6.864
  105    HE2  LYS  14           HE2      LYS  14 -17.358  21.831   6.430
  106    HE3  LYS  14           HE3      LYS  14 -16.288  22.335   7.749
  107    HZ1  LYS  14           HZ1      LYS  14 -18.474  22.084   9.178
  108    H    ASP  15           H        ASP  15 -12.780  25.281   7.106
  109    HA   ASP  15           HA       ASP  15 -11.840  27.618   8.091
  110    HB2  ASP  15           H32      ASP  15 -10.347  25.412   6.576
  111    HB3  ASP  15           H33      ASP  15  -9.453  26.743   7.312
  112    H    GLU  16           H        GLU  16 -11.643  26.747   4.532
  113    HA   GLU  16           HA       GLU  16 -10.053  29.073   3.967
  114    HB2  GLU  16           HB2      GLU  16 -10.112  27.149   2.415
  115    HB3  GLU  16           HB3      GLU  16 -11.818  27.459   2.034
  116    HG2  GLU  16           HG2      GLU  16 -11.176  29.770   1.172
  117    HG3  GLU  16           HG3      GLU  16  -9.477  29.390   1.544
  118    H    GLN  17           H        GLN  17 -13.614  28.408   3.326
  119    HA   GLN  17           HA       GLN  17 -14.182  31.065   2.500
  120    HB2  GLN  17           H42      GLN  17 -15.716  29.040   2.226
  121    HB3  GLN  17           H43      GLN  17 -15.999  29.066   3.984
  122    HG2  GLN  17           H32      GLN  17 -17.903  30.106   3.003
  123    HG3  GLN  17           H33      GLN  17 -16.963  31.457   3.660
  124   HE21  GLN  17           H61      GLN  17 -16.190  32.763   0.342
  125   HE22  GLN  17           H62      GLN  17 -15.752  32.855   2.006
  126    H    ARG  18           H        ARG  18 -14.337  29.531   5.755
  127    HA   ARG  18           HA       ARG  18 -15.335  31.766   7.154
  128    HB2  ARG  18           H42      ARG  18 -13.447  29.537   8.103
  129    HB3  ARG  18           H43      ARG  18 -14.219  30.721   9.184
  130    HG2  ARG  18           H33      ARG  18 -16.476  29.958   8.475
  131    HG3  ARG  18           H32      ARG  18 -15.784  28.734   7.402
  132    HD2  ARG  18           H52      ARG  18 -14.646  27.659   9.280
  133    HD3  ARG  18           H53      ARG  18 -15.384  28.838  10.435
  134    HE   ARG  18           H10      ARG  18 -17.536  27.734   9.008
  135   HH11  ARG  18           H71      ARG  18 -18.739  26.018   9.833
  136   HH12  ARG  18           H72      ARG  18 -18.061  24.939  10.997
  137   HH21  ARG  18           H81      ARG  18 -14.985  26.576  11.222
  138   HH22  ARG  18           H82      ARG  18 -15.957  25.228  11.778
  139    H    ALA  19           H        ALA  19 -11.904  30.797   6.300
  140    HA   ALA  19           HA       ALA  19 -10.782  32.986   7.751
  141    HB1  ALA  19           H21      ALA  19  -8.737  32.688   6.294
  142    HB2  ALA  19           H22      ALA  19  -9.293  31.214   7.127
  143    HB3  ALA  19           H23      ALA  19  -9.625  31.430   5.387
  144    H    LYS  20           H        LYS  20 -11.933  32.651   4.261
  145    HA   LYS  20           HA       LYS  20 -11.013  35.201   3.466
  146    HB2  LYS  20           H42      LYS  20 -13.636  33.884   2.549
  147    HB3  LYS  20           H43      LYS  20 -12.860  35.286   1.796
  148    HG2  LYS  20           H23      LYS  20 -10.798  33.753   1.359
  149    HG3  LYS  20           H22      LYS  20 -11.840  32.401   1.871
  150    HD2  LYS  20           H33      LYS  20 -11.996  32.368  -0.486
  151    HD3  LYS  20           H32      LYS  20 -13.511  33.108   0.064
  152    HE2  LYS  20           H53      LYS  20 -12.478  35.403  -0.495
  153    HE3  LYS  20           H52      LYS  20 -10.998  34.571  -1.002
  154    HZ1  LYS  20           H71      LYS  20 -13.733  34.206  -2.228
  155    HZ2  LYS  20           H72      LYS  20 -12.419  35.165  -2.899
  156    HZ3  LYS  20           H73      LYS  20 -12.247  33.419  -2.753
  157    H    LEU  21           H        LEU  21 -14.113  34.193   5.095
  158    HA   LEU  21           HA       LEU  21 -15.225  36.838   5.089
  159    HB2  LEU  21           HB2      LEU  21 -15.645  34.483   7.020
  160    HB3  LEU  21           HB3      LEU  21 -16.626  35.954   7.057
  161    HG   LEU  21           HG       LEU  21 -16.488  34.170   4.552
  162   HD11  LEU  21          HD11      LEU  21 -18.631  33.152   5.352
  163   HD12  LEU  21          HD12      LEU  21 -17.324  32.832   6.508
  164   HD13  LEU  21          HD13      LEU  21 -18.519  34.093   6.871
  165   HD21  LEU  21          HD21      LEU  21 -17.385  36.486   4.143
  166   HD22  LEU  21          HD22      LEU  21 -18.721  35.320   4.075
  167   HD23  LEU  21          HD23      LEU  21 -18.490  36.316   5.522
  168    H    PHE  22           H        PHE  22 -13.168  35.063   7.502
  169    HA   PHE  22           HA       PHE  22 -13.252  37.069   9.480
  170    HB2  PHE  22           HB2      PHE  22 -12.325  34.818   9.838
  171    HB3  PHE  22           HB3      PHE  22 -10.955  35.175   8.774
  172    HD1  PHE  22           HD1      PHE  22 -12.667  36.597  11.890
  173    HD2  PHE  22           HD2      PHE  22  -8.972  36.128   9.777
  174    HE1  PHE  22           HE1      PHE  22 -11.410  36.954  13.994
  175    HE2  PHE  22           HE2      PHE  22  -7.723  36.291  11.897
  176    HZ   PHE  22           HZ       PHE  22  -8.937  36.683  14.014
  177    H    ILE  23           H        ILE  23 -11.075  36.666   6.567
  178    HA   ILE  23           HA       ILE  23  -9.475  38.977   7.193
  179    HB   ILE  23           HB       ILE  23  -9.874  37.251   4.714
  180   HG12  ILE  23          HG12      ILE  23  -7.423  37.224   4.707
  181   HG13  ILE  23          HG13      ILE  23  -7.355  38.476   5.961
  182   HG21  ILE  23          HG21      ILE  23  -8.792  40.094   4.501
  183   HG22  ILE  23          HG22      ILE  23  -8.593  38.826   3.261
  184   HG23  ILE  23          HG23      ILE  23 -10.211  39.442   3.644
  185   HD11  ILE  23          HD11      ILE  23  -8.368  36.880   7.613
  186   HD12  ILE  23          HD12      ILE  23  -8.509  35.635   6.348
  187   HD13  ILE  23          HD13      ILE  23  -6.905  36.178   6.890
  188    H    GLU  24           H        GLU  24 -12.520  38.647   5.203
  189    HA   GLU  24           HA       GLU  24 -12.494  41.432   4.521
  190    HB2  GLU  24           HB2      GLU  24 -14.933  39.607   4.869
  191    HB3  GLU  24           HB3      GLU  24 -14.949  41.219   4.114
  192    HG2  GLU  24           HG2      GLU  24 -13.478  38.751   3.008
  193    HG3  GLU  24           HG3      GLU  24 -14.935  39.495   2.346
  194    H    TRP  25           H        TRP  25 -13.618  39.674   7.441
  195    HA   TRP  25           HA       TRP  25 -14.899  42.009   8.609
  196    HB2  TRP  25           HB2      TRP  25 -15.536  39.714   9.287
  197    HB3  TRP  25           HB3      TRP  25 -13.862  39.358   9.764
  198    HD1  TRP  25           HD1      TRP  25 -16.877  41.434  11.028
  199    HE1  TRP  25           HE1      TRP  25 -16.637  41.655  13.522
  200    HE3  TRP  25           HE3      TRP  25 -12.119  39.470  11.600
  201    HZ2  TRP  25           HZ2      TRP  25 -14.845  41.077  15.512
  202    HZ3  TRP  25           HZ3      TRP  25 -11.175  39.436  13.927
  203    HH2  TRP  25           HH2      TRP  25 -12.590  40.072  15.855
  204    H    LEU  26           H        LEU  26 -11.547  40.576   8.881
  205    HA   LEU  26           HA       LEU  26 -10.737  42.479  10.903
  206    HB2  LEU  26           HB2      LEU  26  -9.121  41.096   8.698
  207    HB3  LEU  26           HB3      LEU  26  -8.380  42.116   9.951
  208    HG   LEU  26           HG       LEU  26  -9.934  39.536  10.577
  209   HD11  LEU  26          HD11      LEU  26  -7.932  38.994   9.245
  210   HD12  LEU  26          HD12      LEU  26  -6.905  40.053  10.248
  211   HD13  LEU  26          HD13      LEU  26  -7.605  38.575  10.944
  212   HD21  LEU  26          HD21      LEU  26  -8.108  41.292  12.298
  213   HD22  LEU  26          HD22      LEU  26  -9.864  41.106  12.532
  214   HD23  LEU  26          HD23      LEU  26  -8.799  39.717  12.789
  215    H    AIB  27           H        ALA  27 -10.775  42.478   7.277
  216   HB11  AIB  27           H21      ALA  27  -8.858  45.552   7.978
  217   HB12  AIB  27           H22      ALA  27  -8.265  44.357   6.796
  218   HB13  AIB  27           H23      ALA  27  -8.847  45.960   6.249
  219   HB21  AIB  27           H31      ALA  27 -10.526  44.971   4.677
  220   HB22  AIB  27           H32      ALA  27  -9.880  43.352   5.071
  221   HB23  AIB  27           H33      ALA  27 -11.626  43.680   5.224
  222    H    ALA  28           H        ALA  28 -12.939  44.086   7.422
  223    HA   ALA  28           HA       ALA  28 -13.987  46.716   7.134
  224    HB1  ALA  28           H21      ALA  28 -14.884  44.536   9.116
  225    HB2  ALA  28           H22      ALA  28 -15.851  45.946   8.627
  226    HB3  ALA  28           H23      ALA  28 -15.455  44.671   7.434
  227    H    GLY  29           H        GLY  29 -12.211  45.064   9.791
  228    HA2  GLY  29           HA2      GLY  29 -11.119  47.232  10.967
  229    HA3  GLY  29           HA3      GLY  29 -12.737  47.214  11.719
  230    H    GLY  30           H        GLY  30 -12.854  44.080  11.685
  231    HA2  GLY  30           HA2      GLY  30 -12.006  42.391  13.084
  232    HA3  GLY  30           HA3      GLY  30 -10.774  43.509  13.715
  233    HA   PRO  31           HA       PRO  31 -14.292  43.272  16.832
  234    HB2  PRO  31           HB2      PRO  31 -11.950  44.521  18.382
  235    HB3  PRO  31           HB3      PRO  31 -13.213  43.429  19.017
  236    HG2  PRO  31           HG2      PRO  31 -10.789  42.345  18.346
  237    HG3  PRO  31           HG3      PRO  31 -12.257  41.564  17.691
  238    HD2  PRO  31           HD2      PRO  31 -10.439  43.603  16.271
  239    HD3  PRO  31           HD3      PRO  31 -10.973  41.988  15.669
  240    H    SER  32           H        SER  32 -12.069  45.970  15.723
  241    HA   SER  32           HA       SER  32 -13.522  48.110  16.801
  242    HB2  SER  32           HB2      SER  32 -12.142  47.953  14.067
  243    HB3  SER  32           HB3      SER  32 -12.716  49.454  14.857
  244    HG   SER  32           HG       SER  32 -10.436  49.024  15.351
  245    H    SER  33           H        SER  33 -14.115  46.123  13.761
  246    HA   SER  33           HA       SER  33 -16.169  47.861  12.829
  247    HB2  SER  33           HB2      SER  33 -16.842  45.932  11.343
  248    HB3  SER  33           HB3      SER  33 -15.108  46.347  11.294
  249    HG   SER  33           HG       SER  33 -15.406  44.023  11.527
  250    H    GLY  34           H        GLY  34 -16.302  45.693  15.622
  251    HA2  GLY  34           HA2      GLY  34 -18.042  46.277  17.133
  252    HA3  GLY  34           HA3      GLY  34 -19.160  46.551  15.797
  253    H    ALA  35           H        ALA  35 -18.879  44.187  14.245
  254    HA   ALA  35           HA       ALA  35 -20.610  42.580  15.815
  255    HB1  ALA  35           HB1      ALA  35 -19.179  41.827  13.220
  256    HB2  ALA  35           HB2      ALA  35 -20.618  41.008  13.872
  257    HB3  ALA  35           HB3      ALA  35 -20.734  42.704  13.313
  258    HA   PRO  36           HA       PRO  36 -17.452  39.619  17.445
  259    HB2  PRO  36           HB2      PRO  36 -19.459  37.473  16.542
  260    HB3  PRO  36           HB3      PRO  36 -18.645  37.593  18.134
  261    HG2  PRO  36           HG2      PRO  36 -21.244  38.313  17.956
  262    HG3  PRO  36           HG3      PRO  36 -20.110  39.428  18.773
  263    HD2  PRO  36           HD2      PRO  36 -21.070  39.648  15.843
  264    HD3  PRO  36           HD3      PRO  36 -21.130  40.871  17.166
  265    HA   PRO  37           HA       PRO  37 -15.774  38.414  13.478
  266    HB2  PRO  37           HB2      PRO  37 -14.403  35.985  13.936
  267    HB3  PRO  37           HB3      PRO  37 -13.809  37.585  14.456
  268    HG2  PRO  37           HG2      PRO  37 -15.389  35.609  16.128
  269    HG3  PRO  37           HG3      PRO  37 -13.868  36.429  16.580
  270    HD2  PRO  37           HD2      PRO  37 -16.244  37.455  17.469
  271    HD3  PRO  37           HD3      PRO  37 -15.018  38.596  16.804
  272    HA   PRO  38           HA       PRO  38 -19.028  35.890  11.953
  273    HB2  PRO  38           HB2      PRO  38 -18.221  35.302   9.338
  274    HB3  PRO  38           HB3      PRO  38 -18.529  36.975   9.886
  275    HG2  PRO  38           HG2      PRO  38 -15.829  35.574   9.765
  276    HG3  PRO  38           HG3      PRO  38 -16.238  37.160   9.063
  277    HD2  PRO  38           HD2      PRO  38 -15.054  36.975  11.571
  278    HD3  PRO  38           HD3      PRO  38 -16.329  38.210  11.204
  279    H    SER  39           H        SER  39 -19.642  33.719  10.989
  280    HA   SER  39           HA       SER  39 -19.716  31.440  11.472
  281    HB2  SER  39           HB2      SER  39 -16.814  31.493  10.507
  282    HB3  SER  39           HB3      SER  39 -17.993  30.179  10.350
  283    HG   SER  39           HG       SER  39 -18.176  32.707   9.003
  284    HN1  NH2  40           H11      SER  39 -18.218  31.969  14.856
  285    HN2  NH2  40           H12      SER  39 -19.187  32.978  13.857
  286    H93  EVT 101           H93      XXX  40 -16.386  19.641  14.879
  287    H92  EVT 101           H92      XXX  40 -16.224  17.897  15.163
  288   H103  EVT 101          H103      XXX  40 -13.924  18.046  13.956
  289   H102  EVT 101          H102      XXX  40 -14.060  19.814  14.116
  290    H11  EVT 101           H11      XXX  40 -14.043  17.721  16.332
  291   H122  EVT 101          H122      XXX  40 -14.638  21.359  19.139
  292   H123  EVT 101          H123      XXX  40 -16.173  20.535  18.796
  293   H133  EVT 101          H133      XXX  40 -15.633  18.885  20.673
  294   H132  EVT 101          H132      XXX  40 -16.021  20.549  21.176
  295   H143  EVT 101          H143      XXX  40 -13.648  21.103  21.512
  296   H142  EVT 101          H142      XXX  40 -13.130  19.515  20.908
  297   H153  EVT 101          H153      XXX  40 -14.308  18.386  22.801
  298   H152  EVT 101          H152      XXX  40 -14.908  19.950  23.398
  299    H6   EVT 101           H6       XXX  40 -15.828  20.284  12.391
  300   H163  EVT 101          H163      XXX  40 -12.554  20.720  23.780
  301   H162  EVT 101          H162      XXX  40 -11.938  19.159  23.199
  302   H173  EVT 101          H173      XXX  40 -13.110  17.974  25.036
  303   H172  EVT 101          H172      XXX  40 -13.796  19.514  25.633
  304   H183  EVT 101          H183      XXX  40 -11.480  20.397  26.016
  305   H182  EVT 101          H182      XXX  40 -10.795  18.833  25.525
  306   H193  EVT 101          H193      XXX  40 -12.597  19.334  27.972
  307   H192  EVT 101          H192      XXX  40 -10.852  19.035  27.997
  308   H203  EVT 101          H203      XXX  40 -11.258  16.757  26.946
  309   H202  EVT 101          H202      XXX  40 -13.014  17.022  27.141
  310   H213  EVT 101          H213      XXX  40 -12.733  17.212  29.616
  311   H212  EVT 101          H212      XXX  40 -10.973  16.969  29.436
  312   H223  EVT 101          H223      XXX  40 -11.388  14.729  28.377
  313   H222  EVT 101          H222      XXX  40 -13.140  14.959  28.585
  314    H25  EVT 101           H25      XXX  40 -14.836  20.535  16.580
  315   H293  EVT 101          H293      XXX  40 -12.859  15.048  31.072
  316   H292  EVT 101          H292      XXX  40 -11.097  14.867  30.898
  317   H303  EVT 101          H303      XXX  40 -11.404  12.624  29.841
  318   H302  EVT 101          H302      XXX  40 -13.170  12.785  29.961
  319   H313  EVT 101          H313      XXX  40 -12.966  12.895  32.480
  320   H312  EVT 101          H312      XXX  40 -11.201  12.733  32.311
  321   H321  EVT 101          H321      XXX  40 -13.280  10.620  31.426
  322   H323  EVT 101          H323      XXX  40 -12.206  10.507  32.848
  323   H322  EVT 101          H322      XXX  40 -11.513  10.470  31.208
  324   H353  EVT 101          H353      XXX  40 -19.029  18.439   9.221
  325   H352  EVT 101          H352      XXX  40 -19.960  19.917   9.512
  326   H363  EVT 101          H363      XXX  40 -18.768  19.117  11.538
  327   H362  EVT 101          H362      XXX  40 -18.236  20.744  11.095
  328    H37  EVT 101           H37      XXX  40 -16.695  18.143  10.523
  Start of MODEL    4
    1    H1   HIS   1           H1       HIS   1 -15.449   7.159   6.868
    2    H2   HIS   1           H2       HIS   1 -15.434   5.420   7.040
    3    H3   HIS   1           H3       HIS   1 -14.294   6.219   6.010
    4    HA   HIS   1           HA       HIS   1 -16.116   5.172   4.694
    5    HB2  HIS   1           HB2      HIS   1 -17.905   7.119   6.287
    6    HB3  HIS   1           HB3      HIS   1 -18.455   6.172   4.887
    7    HD1  HIS   1           HD1      HIS   1 -18.056   3.520   5.122
    8    HD2  HIS   1           HD2      HIS   1 -18.317   5.816   8.628
    9    HE1  HIS   1           HE1      HIS   1 -18.650   1.893   6.969
   10    H    AIB   2           H        AIB   2 -17.054   6.268   2.734
   11   HB11  AIB   2           H31      AIB   2 -17.559   8.825   0.211
   12   HB12  AIB   2           H32      AIB   2 -17.230   7.064   0.321
   13   HB13  AIB   2           H33      AIB   2 -18.549   7.784   1.267
   14   HB21  AIB   2           H21      AIB   2 -14.814   7.379   1.060
   15   HB22  AIB   2           H22      AIB   2 -15.085   9.104   0.696
   16   HB23  AIB   2           H23      AIB   2 -14.414   8.616   2.280
   17    H    GLN   3           H        GLN   3 -18.585   8.517   3.673
   18    HA   GLN   3           HA       GLN   3 -19.052  11.242   3.459
   19    HB2  GLN   3           H42      GLN   3 -20.596   9.659   4.566
   20    HB3  GLN   3           H43      GLN   3 -19.481   9.444   5.929
   21    HG2  GLN   3           H32      GLN   3 -20.547  12.227   5.179
   22    HG3  GLN   3           H33      GLN   3 -21.511  11.122   6.167
   23   HE21  GLN   3           H61      GLN   3 -18.465  13.073   8.017
   24   HE22  GLN   3           H62      GLN   3 -18.779  13.365   6.349
   25    H    GLY   4           H        GLY   4 -16.895   9.539   5.895
   26    HA2  GLY   4           HA2      GLY   4 -16.109  11.754   7.376
   27    HA3  GLY   4           HA3      GLY   4 -15.003  10.418   6.967
   28    H    THR   5           H        THR   5 -14.875  10.705   4.114
   29    HA   THR   5           HA       THR   5 -12.967  12.882   4.072
   30    HB   THR   5           HB       THR   5 -13.932  11.137   1.753
   31    HG1  THR   5           HG1      THR   5 -11.713  10.821   3.527
   32   HG21  THR   5          HG21      THR   5 -11.757  11.748   0.704
   33   HG22  THR   5          HG22      THR   5 -12.751  13.196   0.987
   34   HG23  THR   5          HG23      THR   5 -11.379  12.843   2.066
   35    H    PHE   6           H        PHE   6 -16.386  12.465   2.761
   36    HA   PHE   6           HA       PHE   6 -16.385  14.803   1.233
   37    HB2  PHE   6           HB2      PHE   6 -18.656  13.454   2.731
   38    HB3  PHE   6           HB3      PHE   6 -18.874  15.116   2.217
   39    HD1  PHE   6           HD1      PHE   6 -19.045  15.790  -0.075
   40    HD2  PHE   6           HD2      PHE   6 -18.268  11.687   0.907
   41    HE1  PHE   6           HE1      PHE   6 -19.352  15.172  -2.436
   42    HE2  PHE   6           HE2      PHE   6 -18.659  11.062  -1.454
   43    HZ   PHE   6           HZ       PHE   6 -19.046  12.823  -3.158
   44    H    THR   7           H        THR   7 -17.183  14.495   4.779
   45    HA   THR   7           HA       THR   7 -17.511  17.282   5.051
   46    HB   THR   7           HB       THR   7 -18.335  15.803   6.813
   47    HG1  THR   7           HG1      THR   7 -17.592  17.292   8.512
   48   HG21  THR   7          HG21      THR   7 -16.442  14.185   7.008
   49   HG22  THR   7          HG22      THR   7 -15.366  15.475   7.602
   50   HG23  THR   7          HG23      THR   7 -16.753  14.944   8.584
   51    H    SER   8           H        SER   8 -14.504  15.272   5.011
   52    HA   SER   8           HA       SER   8 -12.906  17.177   6.266
   53    HB2  SER   8           HB2      SER   8 -10.985  16.093   5.518
   54    HB3  SER   8           HB3      SER   8 -12.194  14.790   5.575
   55    HG   SER   8           HG       SER   8 -12.316  15.088   3.198
   56    H    ASP   9           H        ASP   9 -13.799  16.859   2.731
   57    HA   ASP   9           HA       ASP   9 -12.105  19.136   2.015
   58    HB2  ASP   9           HB2      ASP   9 -12.685  17.263   0.438
   59    HB3  ASP   9           HB3      ASP   9 -14.377  17.825   0.422
   60    H    LEU  10           H        LEU  10 -15.688  18.576   2.552
   61    HA   LEU  10           HA       LEU  10 -16.425  21.188   1.754
   62    HB2  LEU  10           HB2      LEU  10 -17.615  19.323   3.860
   63    HB3  LEU  10           HB3      LEU  10 -18.421  20.833   3.408
   64    HG   LEU  10           HG       LEU  10 -17.738  18.731   1.269
   65   HD11  LEU  10          HD11      LEU  10 -19.069  17.570   2.983
   66   HD12  LEU  10          HD12      LEU  10 -20.280  18.886   2.979
   67   HD13  LEU  10          HD13      LEU  10 -20.073  17.839   1.542
   68   HD21  LEU  10          HD21      LEU  10 -19.603  19.808   0.037
   69   HD22  LEU  10          HD22      LEU  10 -19.888  20.928   1.395
   70   HD23  LEU  10          HD23      LEU  10 -18.378  21.034   0.447
   71    H    SER  11           H        SER  11 -15.286  19.916   4.960
   72    HA   SER  11           HA       SER  11 -15.626  22.420   6.311
   73    HB2  SER  11           HB2      SER  11 -14.109  21.652   8.029
   74    HB3  SER  11           HB3      SER  11 -15.249  20.359   7.641
   75    HG   SER  11           HG       SER  11 -13.461  19.438   6.362
   76    H    LYS  12           H        LYS  12 -12.746  20.961   4.515
   77    HA   LYS  12           HA       LYS  12 -11.017  23.117   5.124
   78    HB2  LYS  12           HB2      LYS  12 -10.439  20.919   4.083
   79    HB3  LYS  12           HB3      LYS  12 -11.079  21.478   2.522
   80    HG2  LYS  12           HG2      LYS  12  -8.841  22.878   4.115
   81    HG3  LYS  12           HG3      LYS  12  -8.550  21.597   2.918
   82    HD2  LYS  12           HD2      LYS  12  -9.502  22.960   1.106
   83    HD3  LYS  12           HD3      LYS  12  -9.862  24.296   2.216
   84    HE2  LYS  12           HE2      LYS  12  -7.460  24.538   2.780
   85    HE3  LYS  12           HE3      LYS  12  -7.045  23.219   1.662
   86    HZ1  LYS  12           HZ1      LYS  12  -8.332  25.874   0.918
   87    HZ2  LYS  12           HZ2      LYS  12  -6.707  25.383   0.562
   88    HZ3  LYS  12           HZ3      LYS  12  -8.033  24.577  -0.204
   89    H    GLN  13           H        GLN  13 -13.407  22.674   2.423
   90    HA   GLN  13           HA       GLN  13 -12.888  25.175   1.170
   91    HB2  GLN  13           HB2      GLN  13 -15.438  23.492   1.352
   92    HB3  GLN  13           HB3      GLN  13 -15.337  24.958   0.359
   93    HG2  GLN  13           HG2      GLN  13 -13.578  24.038  -1.048
   94    HG3  GLN  13           HG3      GLN  13 -13.444  22.578  -0.048
   95   HE21  GLN  13          HE21      GLN  13 -15.641  21.892  -3.074
   96   HE22  GLN  13          HE22      GLN  13 -14.100  22.649  -2.964
   97    H    LYS  14           H        LYS  14 -15.213  24.322   3.892
   98    HA   LYS  14           HA       LYS  14 -16.171  27.053   4.001
   99    HB2  LYS  14           HB2      LYS  14 -16.297  24.770   6.032
  100    HB3  LYS  14           HB3      LYS  14 -16.853  26.416   6.411
  101    HG2  LYS  14           HG2      LYS  14 -18.431  26.444   4.584
  102    HG3  LYS  14           HG3      LYS  14 -17.861  24.894   3.942
  103    HD2  LYS  14           HD2      LYS  14 -19.018  25.135   6.765
  104    HD3  LYS  14           HD3      LYS  14 -20.091  24.918   5.363
  105    HE2  LYS  14           HE2      LYS  14 -19.133  22.818   4.736
  106    HE3  LYS  14           HE3      LYS  14 -17.855  22.929   5.947
  107    HZ1  LYS  14           HZ1      LYS  14 -19.789  23.024   7.655
  108    H    ASP  15           H        ASP  15 -13.818  25.329   6.259
  109    HA   ASP  15           HA       ASP  15 -12.809  27.488   7.590
  110    HB2  ASP  15           H32      ASP  15 -11.317  25.152   6.321
  111    HB3  ASP  15           H33      ASP  15 -10.500  26.314   7.368
  112    H    GLU  16           H        GLU  16 -12.162  26.725   4.067
  113    HA   GLU  16           HA       GLU  16 -10.160  28.766   3.832
  114    HB2  GLU  16           HB2      GLU  16 -10.503  26.826   2.189
  115    HB3  GLU  16           HB3      GLU  16 -11.943  27.657   1.566
  116    HG2  GLU  16           HG2      GLU  16 -10.450  29.660   1.013
  117    HG3  GLU  16           HG3      GLU  16  -9.063  28.679   1.555
  118    H    GLN  17           H        GLN  17 -13.711  28.665   3.005
  119    HA   GLN  17           HA       GLN  17 -13.783  31.450   2.216
  120    HB2  GLN  17           H42      GLN  17 -15.430  29.779   1.410
  121    HB3  GLN  17           H43      GLN  17 -16.042  29.552   3.061
  122    HG2  GLN  17           H32      GLN  17 -17.517  31.020   1.788
  123    HG3  GLN  17           H33      GLN  17 -16.786  31.953   3.111
  124   HE21  GLN  17           H61      GLN  17 -14.984  34.193   0.948
  125   HE22  GLN  17           H62      GLN  17 -15.158  33.656   2.571
  126    H    ARG  18           H        ARG  18 -14.936  29.744   5.194
  127    HA   ARG  18           HA       ARG  18 -15.672  31.943   6.688
  128    HB2  ARG  18           H42      ARG  18 -14.196  29.409   7.549
  129    HB3  ARG  18           H43      ARG  18 -14.849  30.546   8.739
  130    HG2  ARG  18           H33      ARG  18 -17.151  30.277   7.878
  131    HG3  ARG  18           H32      ARG  18 -16.595  29.108   6.654
  132    HD2  ARG  18           H52      ARG  18 -15.755  27.610   8.371
  133    HD3  ARG  18           H53      ARG  18 -16.341  28.694   9.674
  134    HE   ARG  18           H10      ARG  18 -18.558  28.235   7.982
  135   HH11  ARG  18           H71      ARG  18 -20.130  26.723   8.506
  136   HH12  ARG  18           H72      ARG  18 -19.773  25.412   9.564
  137   HH21  ARG  18           H81      ARG  18 -16.460  26.348  10.145
  138   HH22  ARG  18           H82      ARG  18 -17.719  25.173  10.489
  139    H    ALA  19           H        ALA  19 -12.257  30.655   6.232
  140    HA   ALA  19           HA       ALA  19 -11.124  32.607   8.005
  141    HB1  ALA  19           H21      ALA  19  -9.853  31.231   5.558
  142    HB2  ALA  19           H22      ALA  19  -8.983  32.197   6.785
  143    HB3  ALA  19           H23      ALA  19  -9.790  30.678   7.259
  144    H    LYS  20           H        LYS  20 -11.769  32.623   4.414
  145    HA   LYS  20           HA       LYS  20 -10.723  35.239   4.051
  146    HB2  LYS  20           H42      LYS  20 -12.791  33.650   2.474
  147    HB3  LYS  20           H43      LYS  20 -12.257  35.246   1.931
  148    HG2  LYS  20           H23      LYS  20  -9.981  34.525   1.623
  149    HG3  LYS  20           H22      LYS  20 -10.224  33.063   2.584
  150    HD2  LYS  20           H33      LYS  20 -10.059  32.497   0.206
  151    HD3  LYS  20           H32      LYS  20 -11.636  32.029   0.868
  152    HE2  LYS  20           H53      LYS  20 -11.825  33.002  -1.398
  153    HE3  LYS  20           H52      LYS  20 -12.772  33.896  -0.193
  154    HZ1  LYS  20           H71      LYS  20 -10.020  34.696  -1.182
  155    HZ2  LYS  20           H72      LYS  20 -11.527  35.314  -1.846
  156    HZ3  LYS  20           H73      LYS  20 -11.095  35.660  -0.184
  157    H    LEU  21           H        LEU  21 -14.005  34.156   5.223
  158    HA   LEU  21           HA       LEU  21 -15.154  36.803   5.045
  159    HB2  LEU  21           HB2      LEU  21 -15.774  34.530   7.029
  160    HB3  LEU  21           HB3      LEU  21 -16.744  36.002   6.837
  161    HG   LEU  21           HG       LEU  21 -16.383  33.860   4.661
  162   HD11  LEU  21          HD11      LEU  21 -18.737  33.275   5.171
  163   HD12  LEU  21          HD12      LEU  21 -17.753  33.082   6.638
  164   HD13  LEU  21          HD13      LEU  21 -18.788  34.517   6.452
  165   HD21  LEU  21          HD21      LEU  21 -18.342  35.116   3.568
  166   HD22  LEU  21          HD22      LEU  21 -18.109  36.425   4.755
  167   HD23  LEU  21          HD23      LEU  21 -16.815  36.019   3.588
  168    H    PHE  22           H        PHE  22 -13.315  35.004   7.639
  169    HA   PHE  22           HA       PHE  22 -13.492  37.079   9.552
  170    HB2  PHE  22           HB2      PHE  22 -12.708  34.839  10.079
  171    HB3  PHE  22           HB3      PHE  22 -11.238  35.053   9.119
  172    HD1  PHE  22           HD1      PHE  22 -13.089  36.308  12.134
  173    HD2  PHE  22           HD2      PHE  22  -9.333  36.295  10.081
  174    HE1  PHE  22           HE1      PHE  22 -11.969  36.947  14.221
  175    HE2  PHE  22           HE2      PHE  22  -8.169  36.719  12.229
  176    HZ   PHE  22           HZ       PHE  22  -9.485  37.174  14.277
  177    H    ILE  23           H        ILE  23 -11.123  36.581   6.787
  178    HA   ILE  23           HA       ILE  23  -9.595  38.912   7.452
  179    HB   ILE  23           HB       ILE  23  -9.921  37.294   4.916
  180   HG12  ILE  23          HG12      ILE  23  -7.413  37.327   4.980
  181   HG13  ILE  23          HG13      ILE  23  -7.468  38.424   6.375
  182   HG21  ILE  23          HG21      ILE  23  -8.773  40.128   4.822
  183   HG22  ILE  23          HG22      ILE  23  -8.628  38.903   3.542
  184   HG23  ILE  23          HG23      ILE  23 -10.226  39.534   3.977
  185   HD11  ILE  23          HD11      ILE  23  -8.588  35.550   6.287
  186   HD12  ILE  23          HD12      ILE  23  -7.056  36.024   7.067
  187   HD13  ILE  23          HD13      ILE  23  -8.598  36.613   7.731
  188    H    GLU  24           H        GLU  24 -12.634  38.588   5.443
  189    HA   GLU  24           HA       GLU  24 -12.600  41.362   4.731
  190    HB2  GLU  24           HB2      GLU  24 -15.020  39.504   5.073
  191    HB3  GLU  24           HB3      GLU  24 -15.078  41.158   4.407
  192    HG2  GLU  24           HG2      GLU  24 -13.494  40.486   2.559
  193    HG3  GLU  24           HG3      GLU  24 -13.450  38.833   3.195
  194    H    TRP  25           H        TRP  25 -13.934  39.618   7.628
  195    HA   TRP  25           HA       TRP  25 -15.056  41.950   8.840
  196    HB2  TRP  25           HB2      TRP  25 -15.636  39.740   9.622
  197    HB3  TRP  25           HB3      TRP  25 -13.955  39.340  10.018
  198    HD1  TRP  25           HD1      TRP  25 -16.857  41.483  11.368
  199    HE1  TRP  25           HE1      TRP  25 -16.477  41.792  13.839
  200    HE3  TRP  25           HE3      TRP  25 -12.148  39.364  11.804
  201    HZ2  TRP  25           HZ2      TRP  25 -14.560  41.374  15.729
  202    HZ3  TRP  25           HZ3      TRP  25 -11.117  39.368  14.083
  203    HH2  TRP  25           HH2      TRP  25 -12.333  40.252  16.023
  204    H    LEU  26           H        LEU  26 -11.693  40.549   9.055
  205    HA   LEU  26           HA       LEU  26 -10.785  42.482  10.952
  206    HB2  LEU  26           HB2      LEU  26  -9.268  41.084   8.693
  207    HB3  LEU  26           HB3      LEU  26  -8.462  42.103   9.901
  208    HG   LEU  26           HG       LEU  26  -9.967  39.497  10.546
  209   HD11  LEU  26          HD11      LEU  26  -7.607  38.605  10.898
  210   HD12  LEU  26          HD12      LEU  26  -7.897  39.088   9.215
  211   HD13  LEU  26          HD13      LEU  26  -6.954  40.145  10.302
  212   HD21  LEU  26          HD21      LEU  26  -8.224  41.315  12.308
  213   HD22  LEU  26          HD22      LEU  26  -9.971  41.036  12.520
  214   HD23  LEU  26          HD23      LEU  26  -8.837  39.699  12.770
  215    H    AIB  27           H        ALA  27 -10.897  42.507   7.338
  216   HB11  AIB  27           H21      ALA  27  -8.853  45.530   8.019
  217   HB12  AIB  27           H22      ALA  27  -8.319  44.356   6.799
  218   HB13  AIB  27           H23      ALA  27  -8.908  45.962   6.303
  219   HB21  AIB  27           H31      ALA  27 -10.609  45.005   4.744
  220   HB22  AIB  27           H32      ALA  27  -9.986  43.374   5.139
  221   HB23  AIB  27           H33      ALA  27 -11.729  43.721   5.273
  222    H    ALA  28           H        ALA  28 -12.967  44.146   7.587
  223    HA   ALA  28           HA       ALA  28 -13.853  46.880   7.254
  224    HB1  ALA  28           H21      ALA  28 -15.116  44.519   8.749
  225    HB2  ALA  28           H22      ALA  28 -15.991  46.014   8.317
  226    HB3  ALA  28           H23      ALA  28 -15.426  44.911   7.036
  227    H    GLY  29           H        GLY  29 -11.914  45.492   9.789
  228    HA2  GLY  29           HA2      GLY  29 -11.489  47.525  11.326
  229    HA3  GLY  29           HA3      GLY  29 -13.144  47.200  11.883
  230    H    GLY  30           H        GLY  30 -12.870  44.146  11.505
  231    HA2  GLY  30           HA2      GLY  30 -12.264  42.411  12.938
  232    HA3  GLY  30           HA3      GLY  30 -10.877  43.398  13.432
  233    HA   PRO  31           HA       PRO  31 -13.798  43.531  17.106
  234    HB2  PRO  31           HB2      PRO  31 -11.194  45.021  17.888
  235    HB3  PRO  31           HB3      PRO  31 -12.256  44.085  18.973
  236    HG2  PRO  31           HG2      PRO  31 -10.101  42.797  18.043
  237    HG3  PRO  31           HG3      PRO  31 -11.680  42.015  17.723
  238    HD2  PRO  31           HD2      PRO  31 -10.147  43.817  15.756
  239    HD3  PRO  31           HD3      PRO  31 -10.764  42.152  15.467
  240    H    SER  32           H        SER  32 -12.021  46.160  15.301
  241    HA   SER  32           HA       SER  32 -13.458  48.290  16.622
  242    HB2  SER  32           HB2      SER  32 -12.012  48.322  13.911
  243    HB3  SER  32           HB3      SER  32 -12.474  49.737  14.893
  244    HG   SER  32           HG       SER  32 -10.217  49.079  15.261
  245    H    SER  33           H        SER  33 -14.219  46.091  13.879
  246    HA   SER  33           HA       SER  33 -15.576  47.892  12.272
  247    HB2  SER  33           HB2      SER  33 -16.948  45.935  11.484
  248    HB3  SER  33           HB3      SER  33 -15.210  45.550  11.558
  249    HG   SER  33           HG       SER  33 -16.559  43.913  12.681
  250    H    GLY  34           H        GLY  34 -16.912  45.890  15.021
  251    HA2  GLY  34           HA2      GLY  34 -18.767  46.908  16.345
  252    HA3  GLY  34           HA3      GLY  34 -19.472  47.483  14.815
  253    H    ALA  35           H        ALA  35 -18.895  45.233  13.078
  254    HA   ALA  35           HA       ALA  35 -21.138  43.608  13.816
  255    HB1  ALA  35           HB1      ALA  35 -19.019  43.088  11.675
  256    HB2  ALA  35           HB2      ALA  35 -20.586  42.239  11.833
  257    HB3  ALA  35           HB3      ALA  35 -20.540  43.979  11.411
  258    HA   PRO  36           HA       PRO  36 -18.477  40.727  16.289
  259    HB2  PRO  36           HB2      PRO  36 -20.550  38.747  15.129
  260    HB3  PRO  36           HB3      PRO  36 -19.939  38.772  16.810
  261    HG2  PRO  36           HG2      PRO  36 -22.342  39.819  16.368
  262    HG3  PRO  36           HG3      PRO  36 -21.158  40.851  17.229
  263    HD2  PRO  36           HD2      PRO  36 -21.839  41.004  14.224
  264    HD3  PRO  36           HD3      PRO  36 -21.799  42.286  15.493
  265    HA   PRO  37           HA       PRO  37 -16.239  38.708  12.864
  266    HB2  PRO  37           HB2      PRO  37 -14.960  36.571  14.083
  267    HB3  PRO  37           HB3      PRO  37 -14.589  38.244  14.541
  268    HG2  PRO  37           HG2      PRO  37 -16.625  36.413  15.893
  269    HG3  PRO  37           HG3      PRO  37 -15.207  37.189  16.662
  270    HD2  PRO  37           HD2      PRO  37 -17.647  38.388  16.809
  271    HD3  PRO  37           HD3      PRO  37 -16.222  39.425  16.432
  272    HA   PRO  38           HA       PRO  38 -19.386  35.831  11.567
  273    HB2  PRO  38           HB2      PRO  38 -18.234  34.517   9.436
  274    HB3  PRO  38           HB3      PRO  38 -18.309  36.294   9.465
  275    HG2  PRO  38           HG2      PRO  38 -15.913  34.658  10.436
  276    HG3  PRO  38           HG3      PRO  38 -15.897  35.864   9.120
  277    HD2  PRO  38           HD2      PRO  38 -15.271  36.643  11.644
  278    HD3  PRO  38           HD3      PRO  38 -16.350  37.681  10.659
  279    H    SER  39           H        SER  39 -18.891  34.821  13.963
  280    HA   SER  39           HA       SER  39 -17.461  32.315  13.944
  281    HB2  SER  39           HB2      SER  39 -19.611  33.026  15.999
  282    HB3  SER  39           HB3      SER  39 -18.284  31.870  16.158
  283    HG   SER  39           HG       SER  39 -16.855  33.806  16.023
  284    HN1  NH2  40           H11      SER  39 -21.542  31.678  13.338
  285    HN2  NH2  40           H12      SER  39 -21.026  33.171  14.008
  286    H93  EVT 101           H93      XXX  40 -19.339  18.622  13.546
  287    H92  EVT 101           H92      XXX  40 -18.093  17.590  12.837
  288   H103  EVT 101          H103      XXX  40 -16.543  19.427  12.640
  289   H102  EVT 101          H102      XXX  40 -17.782  20.650  12.955
  290    H11  EVT 101           H11      XXX  40 -16.940  18.549  15.032
  291   H122  EVT 101          H122      XXX  40 -20.269  20.809  17.208
  292   H123  EVT 101          H123      XXX  40 -21.048  19.847  15.931
  293   H133  EVT 101          H133      XXX  40 -21.166  17.883  17.569
  294   H132  EVT 101          H132      XXX  40 -22.146  19.301  18.005
  295   H143  EVT 101          H143      XXX  40 -20.379  20.097  19.585
  296   H142  EVT 101          H142      XXX  40 -19.394  18.660  19.198
  297   H153  EVT 101          H153      XXX  40 -21.266  17.177  20.015
  298   H152  EVT 101          H152      XXX  40 -22.195  18.628  20.475
  299    H6   EVT 101           H6       XXX  40 -20.171  20.497  12.178
  300   H163  EVT 101          H163      XXX  40 -20.458  19.305  22.100
  301   H162  EVT 101          H162      XXX  40 -19.415  17.954  21.576
  302   H173  EVT 101          H173      XXX  40 -21.228  16.341  22.283
  303   H172  EVT 101          H172      XXX  40 -22.150  17.702  22.967
  304   H183  EVT 101          H183      XXX  40 -20.260  18.248  24.507
  305   H182  EVT 101          H182      XXX  40 -19.280  16.934  23.823
  306   H193  EVT 101          H193      XXX  40 -21.971  16.546  25.263
  307   H192  EVT 101          H192      XXX  40 -20.382  16.369  26.040
  308   H203  EVT 101          H203      XXX  40 -19.776  14.543  24.403
  309   H202  EVT 101          H202      XXX  40 -21.430  14.615  23.739
  310   H213  EVT 101          H213      XXX  40 -22.374  14.087  25.988
  311   H212  EVT 101          H212      XXX  40 -20.726  13.914  26.640
  312   H223  EVT 101          H223      XXX  40 -20.326  12.044  24.981
  313   H222  EVT 101          H222      XXX  40 -21.965  12.269  24.358
  314    H25  EVT 101           H25      XXX  40 -18.827  20.893  15.133
  315   H293  EVT 101          H293      XXX  40 -22.793  11.816  26.840
  316   H292  EVT 101          H292      XXX  40 -21.102  11.403  27.163
  317   H303  EVT 101          H303      XXX  40 -22.033   9.302  26.808
  318   H302  EVT 101          H302      XXX  40 -21.438   9.656  25.165
  319   H313  EVT 101          H313      XXX  40 -24.334   9.974  26.220
  320   H312  EVT 101          H312      XXX  40 -23.741   8.617  25.242
  321   H321  EVT 101          H321      XXX  40 -24.141  11.523  24.320
  322   H323  EVT 101          H323      XXX  40 -24.956  10.060  23.742
  323   H322  EVT 101          H322      XXX  40 -23.231  10.303  23.373
  324   H353  EVT 101          H353      XXX  40 -21.656  19.897   7.423
  325   H352  EVT 101          H352      XXX  40 -21.791  21.531   8.082
  326   H363  EVT 101          H363      XXX  40 -19.384  21.135   9.113
  327   H362  EVT 101          H362      XXX  40 -19.570  19.460   8.583
  328    H37  EVT 101           H37      XXX  40 -21.503  21.011  10.408
  Start of MODEL    5
    1    H1   HIS   1           H1       HIS   1 -10.822   8.742   8.222
    2    H2   HIS   1           H2       HIS   1  -9.914   7.277   8.503
    3    H3   HIS   1           H3       HIS   1  -9.849   8.034   6.977
    4    HA   HIS   1           HA       HIS   1 -11.314   5.982   7.005
    5    HB2  HIS   1           HB2      HIS   1 -13.104   7.841   8.694
    6    HB3  HIS   1           HB3      HIS   1 -13.542   6.195   8.160
    7    HD1  HIS   1           HD1      HIS   1 -11.426   4.419   8.908
    8    HD2  HIS   1           HD2      HIS   1 -12.317   7.816  11.224
    9    HE1  HIS   1           HE1      HIS   1 -10.504   3.944  11.199
   10    H    AIB   2           H        AIB   2 -13.657   6.085   5.800
   11   HB11  AIB   2           H31      AIB   2 -16.050   7.534   3.430
   12   HB12  AIB   2           H32      AIB   2 -15.363   5.943   3.864
   13   HB13  AIB   2           H33      AIB   2 -16.063   6.985   5.129
   14   HB21  AIB   2           H21      AIB   2 -13.052   6.425   2.930
   15   HB22  AIB   2           H22      AIB   2 -13.796   7.888   2.237
   16   HB23  AIB   2           H23      AIB   2 -12.297   8.023   3.193
   17    H    GLN   3           H        GLN   3 -14.925   8.603   6.677
   18    HA   GLN   3           HA       GLN   3 -15.801  11.161   5.855
   19    HB2  GLN   3           H42      GLN   3 -16.297  10.122   8.100
   20    HB3  GLN   3           H43      GLN   3 -14.598  10.368   8.569
   21    HG2  GLN   3           H32      GLN   3 -14.911  12.853   8.202
   22    HG3  GLN   3           H33      GLN   3 -16.639  12.563   7.860
   23   HE21  GLN   3           H61      GLN   3 -16.241  13.570  11.467
   24   HE22  GLN   3           H62      GLN   3 -15.874  14.326   9.967
   25    H    GLY   4           H        GLY   4 -12.544  10.128   7.201
   26    HA2  GLY   4           HA2      GLY   4 -11.119  12.417   7.288
   27    HA3  GLY   4           HA3      GLY   4 -10.443  10.964   6.524
   28    H    THR   5           H        THR   5 -11.630  10.584   4.157
   29    HA   THR   5           HA       THR   5 -10.396  12.499   2.503
   30    HB   THR   5           HB       THR   5 -12.769  10.659   1.845
   31    HG1  THR   5           HG1      THR   5 -10.947   9.311   1.124
   32   HG21  THR   5          HG21      THR   5 -12.003  10.890  -0.533
   33   HG22  THR   5          HG22      THR   5 -12.552  12.456   0.109
   34   HG23  THR   5          HG23      THR   5 -10.807  12.107  -0.030
   35    H    PHE   6           H        PHE   6 -13.945  12.246   3.437
   36    HA   PHE   6           HA       PHE   6 -14.575  14.620   1.898
   37    HB2  PHE   6           HB2      PHE   6 -16.175  13.055   3.993
   38    HB3  PHE   6           HB3      PHE   6 -16.674  14.649   3.379
   39    HD1  PHE   6           HD1      PHE   6 -18.737  13.737   2.504
   40    HD2  PHE   6           HD2      PHE   6 -14.972  12.205   1.081
   41    HE1  PHE   6           HE1      PHE   6 -19.883  12.657   0.607
   42    HE2  PHE   6           HE2      PHE   6 -16.115  11.278  -0.895
   43    HZ   PHE   6           HZ       PHE   6 -18.561  11.524  -1.161
   44    H    THR   7           H        THR   7 -14.615  14.217   5.595
   45    HA   THR   7           HA       THR   7 -14.978  16.919   5.969
   46    HB   THR   7           HB       THR   7 -15.169  15.254   7.783
   47    HG1  THR   7           HG1      THR   7 -14.367  16.816   9.369
   48   HG21  THR   7          HG21      THR   7 -12.900  14.089   7.412
   49   HG22  THR   7          HG22      THR   7 -12.109  15.537   8.076
   50   HG23  THR   7          HG23      THR   7 -13.198  14.569   9.103
   51    H    SER   8           H        SER   8 -11.793  15.266   5.358
   52    HA   SER   8           HA       SER   8 -10.242  17.424   6.285
   53    HB2  SER   8           HB2      SER   8  -8.401  16.717   4.821
   54    HB3  SER   8           HB3      SER   8  -9.109  15.333   5.689
   55    HG   SER   8           HG       SER   8 -10.205  14.814   3.655
   56    H    ASP   9           H        ASP   9 -11.459  16.772   2.874
   57    HA   ASP   9           HA       ASP   9 -10.457  19.370   2.018
   58    HB2  ASP   9           HB2      ASP   9 -10.615  17.468   0.432
   59    HB3  ASP   9           HB3      ASP   9 -12.382  17.456   0.639
   60    H    LEU  10           H        LEU  10 -13.789  18.023   2.742
   61    HA   LEU  10           HA       LEU  10 -15.161  20.384   2.044
   62    HB2  LEU  10           HB2      LEU  10 -15.818  18.459   4.353
   63    HB3  LEU  10           HB3      LEU  10 -16.918  19.699   3.723
   64    HG   LEU  10           HG       LEU  10 -15.969  17.195   2.197
   65   HD11  LEU  10          HD11      LEU  10 -17.694  16.817   3.994
   66   HD12  LEU  10          HD12      LEU  10 -18.745  18.024   3.207
   67   HD13  LEU  10          HD13      LEU  10 -18.352  16.504   2.366
   68   HD21  LEU  10          HD21      LEU  10 -17.740  19.535   1.284
   69   HD22  LEU  10          HD22      LEU  10 -16.232  18.967   0.515
   70   HD23  LEU  10          HD23      LEU  10 -17.688  17.960   0.456
   71    H    SER  11           H        SER  11 -13.404  19.550   5.088
   72    HA   SER  11           HA       SER  11 -14.250  21.980   6.403
   73    HB2  SER  11           HB2      SER  11 -12.583  21.607   8.082
   74    HB3  SER  11           HB3      SER  11 -13.361  20.058   7.730
   75    HG   SER  11           HG       SER  11 -11.407  19.586   6.455
   76    H    LYS  12           H        LYS  12 -11.277  21.071   4.436
   77    HA   LYS  12           HA       LYS  12  -9.965  23.557   4.778
   78    HB2  LYS  12           HB2      LYS  12  -9.108  21.427   3.654
   79    HB3  LYS  12           HB3      LYS  12 -10.068  21.846   2.214
   80    HG2  LYS  12           HG2      LYS  12  -7.755  23.498   3.419
   81    HG3  LYS  12           HG3      LYS  12  -7.656  22.363   2.061
   82    HD2  LYS  12           HD2      LYS  12  -9.498  23.910   0.927
   83    HD3  LYS  12           HD3      LYS  12  -8.970  25.118   2.124
   84    HE2  LYS  12           HE2      LYS  12  -6.549  24.705   1.284
   85    HE3  LYS  12           HE3      LYS  12  -7.263  23.739  -0.032
   86    HZ1  LYS  12           HZ1      LYS  12  -6.811  26.019  -0.774
   87    HZ2  LYS  12           HZ2      LYS  12  -8.535  25.759  -0.743
   88    HZ3  LYS  12           HZ3      LYS  12  -7.807  26.675   0.505
   89    H    GLN  13           H        GLN  13 -12.623  22.591   2.492
   90    HA   GLN  13           HA       GLN  13 -12.714  25.154   1.203
   91    HB2  GLN  13           HB2      GLN  13 -14.892  23.019   1.568
   92    HB3  GLN  13           HB3      GLN  13 -15.111  24.513   0.627
   93    HG2  GLN  13           HG2      GLN  13 -13.263  23.880  -0.914
   94    HG3  GLN  13           HG3      GLN  13 -12.979  22.389   0.004
   95   HE21  GLN  13          HE21      GLN  13 -15.780  20.696  -1.473
   96   HE22  GLN  13          HE22      GLN  13 -14.497  20.575  -0.325
   97    H    LYS  14           H        LYS  14 -14.687  23.819   4.015
   98    HA   LYS  14           HA       LYS  14 -16.092  26.323   4.319
   99    HB2  LYS  14           HB2      LYS  14 -15.572  24.054   6.312
  100    HB3  LYS  14           HB3      LYS  14 -16.481  25.520   6.741
  101    HG2  LYS  14           HG2      LYS  14 -18.168  25.097   5.007
  102    HG3  LYS  14           HG3      LYS  14 -17.254  23.718   4.363
  103    HD2  LYS  14           HD2      LYS  14 -18.143  23.685   7.281
  104    HD3  LYS  14           HD3      LYS  14 -19.329  23.317   6.010
  105    HE2  LYS  14           HE2      LYS  14 -17.944  21.451   5.144
  106    HE3  LYS  14           HE3      LYS  14 -16.661  21.834   6.300
  107    HZ1  LYS  14           HZ1      LYS  14 -17.875  20.763   7.967
  108    H    ASP  15           H        ASP  15 -13.302  25.056   6.329
  109    HA   ASP  15           HA       ASP  15 -12.678  27.339   7.666
  110    HB2  ASP  15           H32      ASP  15 -10.785  25.345   6.304
  111    HB3  ASP  15           H33      ASP  15 -10.167  26.647   7.323
  112    H    GLU  16           H        GLU  16 -11.961  26.768   4.125
  113    HA   GLU  16           HA       GLU  16 -10.327  29.134   3.945
  114    HB2  GLU  16           HB2      GLU  16 -10.252  27.354   2.205
  115    HB3  GLU  16           HB3      GLU  16 -11.914  27.754   1.716
  116    HG2  GLU  16           HG2      GLU  16 -11.113  30.088   1.071
  117    HG3  GLU  16           HG3      GLU  16  -9.488  29.678   1.653
  118    H    GLN  17           H        GLN  17 -13.875  28.572   3.191
  119    HA   GLN  17           HA       GLN  17 -14.361  31.289   2.513
  120    HB2  GLN  17           H42      GLN  17 -16.038  29.478   2.114
  121    HB3  GLN  17           H43      GLN  17 -16.240  29.255   3.866
  122    HG2  GLN  17           H32      GLN  17 -18.112  30.541   2.992
  123    HG3  GLN  17           H33      GLN  17 -17.157  31.629   4.016
  124   HE21  GLN  17           H61      GLN  17 -16.168  33.739   1.242
  125   HE22  GLN  17           H62      GLN  17 -15.749  33.292   2.847
  126    H    ARG  18           H        ARG  18 -14.464  29.532   5.688
  127    HA   ARG  18           HA       ARG  18 -15.545  31.713   7.170
  128    HB2  ARG  18           H42      ARG  18 -13.708  29.455   8.114
  129    HB3  ARG  18           H43      ARG  18 -14.576  30.570   9.182
  130    HG2  ARG  18           H33      ARG  18 -16.773  29.757   8.410
  131    HG3  ARG  18           H32      ARG  18 -16.017  28.698   7.207
  132    HD2  ARG  18           H52      ARG  18 -14.857  27.462   9.023
  133    HD3  ARG  18           H53      ARG  18 -15.764  28.423  10.231
  134    HE   ARG  18           H10      ARG  18 -17.630  27.293   8.410
  135   HH11  ARG  18           H71      ARG  18 -18.759  25.416   8.921
  136   HH12  ARG  18           H72      ARG  18 -18.202  24.363  10.171
  137   HH21  ARG  18           H81      ARG  18 -15.370  26.249  10.951
  138   HH22  ARG  18           H82      ARG  18 -16.309  24.814  11.323
  139    H    ALA  19           H        ALA  19 -12.138  30.752   6.358
  140    HA   ALA  19           HA       ALA  19 -10.942  32.850   7.902
  141    HB1  ALA  19           H21      ALA  19  -9.911  31.427   5.373
  142    HB2  ALA  19           H22      ALA  19  -8.935  32.520   6.395
  143    HB3  ALA  19           H23      ALA  19  -9.563  30.990   7.069
  144    H    LYS  20           H        LYS  20 -11.965  32.671   4.370
  145    HA   LYS  20           HA       LYS  20 -11.037  35.255   3.740
  146    HB2  LYS  20           H42      LYS  20 -13.390  33.664   2.586
  147    HB3  LYS  20           H43      LYS  20 -12.897  35.261   1.967
  148    HG2  LYS  20           H23      LYS  20 -10.688  34.441   1.330
  149    HG3  LYS  20           H22      LYS  20 -10.949  32.898   2.166
  150    HD2  LYS  20           H33      LYS  20 -11.179  32.628  -0.289
  151    HD3  LYS  20           H32      LYS  20 -12.668  32.196   0.593
  152    HE2  LYS  20           H53      LYS  20 -13.152  33.388  -1.510
  153    HE3  LYS  20           H52      LYS  20 -13.737  34.307  -0.110
  154    HZ1  LYS  20           H71      LYS  20 -11.122  34.829  -1.563
  155    HZ2  LYS  20           H72      LYS  20 -12.623  35.698  -1.849
  156    HZ3  LYS  20           H73      LYS  20 -11.832  35.815  -0.289
  157    H    LEU  21           H        LEU  21 -14.190  34.204   5.277
  158    HA   LEU  21           HA       LEU  21 -15.314  36.866   5.242
  159    HB2  LEU  21           HB2      LEU  21 -15.745  34.572   7.252
  160    HB3  LEU  21           HB3      LEU  21 -16.701  36.068   7.239
  161    HG   LEU  21           HG       LEU  21 -16.615  34.179   4.821
  162   HD11  LEU  21          HD11      LEU  21 -18.780  33.258   5.601
  163   HD12  LEU  21          HD12      LEU  21 -17.505  32.928   6.783
  164   HD13  LEU  21          HD13      LEU  21 -18.674  34.231   7.106
  165   HD21  LEU  21          HD21      LEU  21 -18.772  35.342   4.236
  166   HD22  LEU  21          HD22      LEU  21 -18.564  36.433   5.629
  167   HD23  LEU  21          HD23      LEU  21 -17.418  36.493   4.265
  168    H    PHE  22           H        PHE  22 -13.222  35.030   7.600
  169    HA   PHE  22           HA       PHE  22 -13.227  37.069   9.558
  170    HB2  PHE  22           HB2      PHE  22 -12.270  34.671   9.764
  171    HB3  PHE  22           HB3      PHE  22 -10.816  35.285   8.972
  172    HD1  PHE  22           HD1      PHE  22 -13.212  35.843  11.829
  173    HD2  PHE  22           HD2      PHE  22  -9.205  36.488  10.416
  174    HE1  PHE  22           HE1      PHE  22 -12.568  36.687  14.056
  175    HE2  PHE  22           HE2      PHE  22  -8.505  37.069  12.729
  176    HZ   PHE  22           HZ       PHE  22 -10.196  37.215  14.537
  177    H    ILE  23           H        ILE  23 -11.131  36.622   6.600
  178    HA   ILE  23           HA       ILE  23  -9.377  38.801   7.274
  179    HB   ILE  23           HB       ILE  23  -9.962  37.252   4.716
  180   HG12  ILE  23          HG12      ILE  23  -7.433  37.105   4.668
  181   HG13  ILE  23          HG13      ILE  23  -7.369  38.102   6.142
  182   HG21  ILE  23          HG21      ILE  23  -8.622  39.988   4.618
  183   HG22  ILE  23          HG22      ILE  23  -8.544  38.771   3.320
  184   HG23  ILE  23          HG23      ILE  23 -10.108  39.479   3.760
  185   HD11  ILE  23          HD11      ILE  23  -8.688  35.318   5.846
  186   HD12  ILE  23          HD12      ILE  23  -7.149  35.669   6.675
  187   HD13  ILE  23          HD13      ILE  23  -8.679  36.285   7.358
  188    H    GLU  24           H        GLU  24 -12.403  38.689   5.231
  189    HA   GLU  24           HA       GLU  24 -12.229  41.492   4.642
  190    HB2  GLU  24           HB2      GLU  24 -14.701  39.675   4.821
  191    HB3  GLU  24           HB3      GLU  24 -14.737  41.343   4.193
  192    HG2  GLU  24           HG2      GLU  24 -13.140  38.992   2.988
  193    HG3  GLU  24           HG3      GLU  24 -14.626  39.710   2.330
  194    H    TRP  25           H        TRP  25 -13.584  39.664   7.454
  195    HA   TRP  25           HA       TRP  25 -14.879  41.946   8.660
  196    HB2  TRP  25           HB2      TRP  25 -15.392  39.632   9.331
  197    HB3  TRP  25           HB3      TRP  25 -13.715  39.385   9.870
  198    HD1  TRP  25           HD1      TRP  25 -16.752  41.577  10.873
  199    HE1  TRP  25           HE1      TRP  25 -16.626  41.968  13.367
  200    HE3  TRP  25           HE3      TRP  25 -12.179  39.343  11.867
  201    HZ2  TRP  25           HZ2      TRP  25 -14.933  41.526  15.459
  202    HZ3  TRP  25           HZ3      TRP  25 -11.378  39.417  14.231
  203    HH2  TRP  25           HH2      TRP  25 -12.747  40.439  16.002
  204    H    LEU  26           H        LEU  26 -11.490  40.571   9.010
  205    HA   LEU  26           HA       LEU  26 -10.728  42.495  10.998
  206    HB2  LEU  26           HB2      LEU  26  -9.032  41.140   8.833
  207    HB3  LEU  26           HB3      LEU  26  -8.353  42.130  10.144
  208    HG   LEU  26           HG       LEU  26  -9.943  39.534  10.636
  209   HD11  LEU  26          HD11      LEU  26  -7.686  38.490  10.981
  210   HD12  LEU  26          HD12      LEU  26  -7.886  39.066   9.314
  211   HD13  LEU  26          HD13      LEU  26  -6.904  40.005  10.472
  212   HD21  LEU  26          HD21      LEU  26  -8.168  41.231  12.485
  213   HD22  LEU  26          HD22      LEU  26  -9.939  41.045  12.624
  214   HD23  LEU  26          HD23      LEU  26  -8.882  39.648  12.904
  215    H    AIB  27           H        ALA  27 -10.538  42.478   7.350
  216   HB11  AIB  27           H21      ALA  27  -8.510  45.385   8.170
  217   HB12  AIB  27           H22      ALA  27  -7.954  44.245   6.927
  218   HB13  AIB  27           H23      ALA  27  -8.464  45.897   6.469
  219   HB21  AIB  27           H31      ALA  27 -10.126  45.026   4.793
  220   HB22  AIB  27           H32      ALA  27  -9.554  43.372   5.167
  221   HB23  AIB  27           H33      ALA  27 -11.292  43.755   5.242
  222    H    ALA  28           H        ALA  28 -12.658  44.187   7.368
  223    HA   ALA  28           HA       ALA  28 -13.588  46.842   6.958
  224    HB1  ALA  28           H21      ALA  28 -14.738  44.685   8.834
  225    HB2  ALA  28           H22      ALA  28 -15.635  46.092   8.203
  226    HB3  ALA  28           H23      ALA  28 -15.084  44.808   7.090
  227    H    GLY  29           H        GLY  29 -12.017  45.323   9.811
  228    HA2  GLY  29           HA2      GLY  29 -11.474  47.566  11.276
  229    HA3  GLY  29           HA3      GLY  29 -13.179  47.250  11.683
  230    H    GLY  30           H        GLY  30 -12.938  44.190  11.526
  231    HA2  GLY  30           HA2      GLY  30 -12.287  42.507  13.011
  232    HA3  GLY  30           HA3      GLY  30 -10.982  43.574  13.569
  233    HA   PRO  31           HA       PRO  31 -14.233  43.562  16.963
  234    HB2  PRO  31           HB2      PRO  31 -11.811  44.974  18.217
  235    HB3  PRO  31           HB3      PRO  31 -12.947  43.847  19.009
  236    HG2  PRO  31           HG2      PRO  31 -10.540  42.875  18.217
  237    HG3  PRO  31           HG3      PRO  31 -12.006  41.964  17.760
  238    HD2  PRO  31           HD2      PRO  31 -10.456  43.953  16.003
  239    HD3  PRO  31           HD3      PRO  31 -10.995  42.277  15.583
  240    H    SER  32           H        SER  32 -12.177  46.238  15.547
  241    HA   SER  32           HA       SER  32 -13.612  48.387  16.731
  242    HB2  SER  32           HB2      SER  32 -12.260  48.314  13.975
  243    HB3  SER  32           HB3      SER  32 -12.668  49.776  14.902
  244    HG   SER  32           HG       SER  32 -11.105  48.965  16.517
  245    H    SER  33           H        SER  33 -14.298  46.352  13.771
  246    HA   SER  33           HA       SER  33 -15.931  48.203  12.470
  247    HB2  SER  33           HB2      SER  33 -17.040  46.229  11.378
  248    HB3  SER  33           HB3      SER  33 -15.267  46.041  11.406
  249    HG   SER  33           HG       SER  33 -16.351  44.106  12.204
  250    H    GLY  34           H        GLY  34 -16.773  45.973  15.221
  251    HA2  GLY  34           HA2      GLY  34 -18.608  46.479  16.675
  252    HA3  GLY  34           HA3      GLY  34 -19.450  47.321  15.374
  253    H    ALA  35           H        ALA  35 -18.580  44.871  13.441
  254    HA   ALA  35           HA       ALA  35 -21.075  43.483  13.905
  255    HB1  ALA  35           HB1      ALA  35 -18.787  42.810  11.977
  256    HB2  ALA  35           HB2      ALA  35 -20.395  42.037  12.005
  257    HB3  ALA  35           HB3      ALA  35 -20.243  43.771  11.605
  258    HA   PRO  36           HA       PRO  36 -18.940  40.540  16.786
  259    HB2  PRO  36           HB2      PRO  36 -21.214  38.831  15.573
  260    HB3  PRO  36           HB3      PRO  36 -20.617  38.769  17.259
  261    HG2  PRO  36           HG2      PRO  36 -22.846  40.232  16.778
  262    HG3  PRO  36           HG3      PRO  36 -21.510  41.030  17.668
  263    HD2  PRO  36           HD2      PRO  36 -22.171  41.333  14.674
  264    HD3  PRO  36           HD3      PRO  36 -21.821  42.596  15.913
  265    HA   PRO  37           HA       PRO  37 -16.510  38.897  13.502
  266    HB2  PRO  37           HB2      PRO  37 -15.098  36.753  14.646
  267    HB3  PRO  37           HB3      PRO  37 -14.800  38.458  15.067
  268    HG2  PRO  37           HG2      PRO  37 -16.633  36.505  16.532
  269    HG3  PRO  37           HG3      PRO  37 -15.304  37.472  17.238
  270    HD2  PRO  37           HD2      PRO  37 -17.914  38.378  17.377
  271    HD3  PRO  37           HD3      PRO  37 -16.621  39.557  16.909
  272    HA   PRO  38           HA       PRO  38 -18.847  35.325  11.904
  273    HB2  PRO  38           HB2      PRO  38 -17.447  34.736   9.617
  274    HB3  PRO  38           HB3      PRO  38 -18.169  36.349   9.860
  275    HG2  PRO  38           HG2      PRO  38 -15.272  35.576  10.446
  276    HG3  PRO  38           HG3      PRO  38 -15.819  36.899   9.384
  277    HD2  PRO  38           HD2      PRO  38 -15.175  37.349  12.052
  278    HD3  PRO  38           HD3      PRO  38 -16.511  38.236  11.232
  279    H    SER  39           H        SER  39 -18.105  34.333  14.093
  280    HA   SER  39           HA       SER  39 -16.264  32.021  13.630
  281    HB2  SER  39           HB2      SER  39 -15.834  34.243  15.731
  282    HB3  SER  39           HB3      SER  39 -15.026  32.664  15.726
  283    HG   SER  39           HG       SER  39 -14.779  34.548  13.585
  284    HN1  NH2  40           H11      SER  39 -19.250  30.775  15.185
  285    HN2  NH2  40           H12      SER  39 -18.654  31.216  13.631
  286    H93  EVT 101           H93      XXX  40 -19.130  17.553  13.928
  287    H92  EVT 101           H92      XXX  40 -17.557  18.336  13.736
  288   H103  EVT 101          H103      XXX  40 -18.683  20.596  14.154
  289   H102  EVT 101          H102      XXX  40 -20.216  19.732  14.448
  290    H11  EVT 101           H11      XXX  40 -18.992  18.370  16.244
  291   H122  EVT 101          H122      XXX  40 -19.630  21.916  19.128
  292   H123  EVT 101          H123      XXX  40 -21.207  21.192  18.724
  293   H133  EVT 101          H133      XXX  40 -20.807  19.478  20.594
  294   H132  EVT 101          H132      XXX  40 -21.068  21.144  21.141
  295   H143  EVT 101          H143      XXX  40 -18.676  21.523  21.483
  296   H142  EVT 101          H142      XXX  40 -18.271  19.928  20.803
  297   H153  EVT 101          H153      XXX  40 -19.512  18.808  22.657
  298   H152  EVT 101          H152      XXX  40 -19.926  20.385  23.373
  299    H6   EVT 101           H6       XXX  40 -20.947  18.362  12.412
  300   H163  EVT 101          H163      XXX  40 -17.539  20.877  23.800
  301   H162  EVT 101          H162      XXX  40 -17.042  19.411  22.916
  302   H173  EVT 101          H173      XXX  40 -18.271  18.010  24.607
  303   H172  EVT 101          H172      XXX  40 -18.626  19.478  25.556
  304   H183  EVT 101          H183      XXX  40 -16.111  19.907  25.707
  305   H182  EVT 101          H182      XXX  40 -15.828  18.359  24.887
  306   H193  EVT 101          H193      XXX  40 -17.196  18.738  27.617
  307   H192  EVT 101          H192      XXX  40 -15.547  18.140  27.331
  308   H203  EVT 101          H203      XXX  40 -16.575  16.183  26.015
  309   H202  EVT 101          H202      XXX  40 -18.176  16.727  26.564
  310   H213  EVT 101          H213      XXX  40 -17.421  16.499  28.977
  311   H212  EVT 101          H212      XXX  40 -15.859  15.867  28.387
  312   H223  EVT 101          H223      XXX  40 -17.114  13.978  27.232
  313   H222  EVT 101          H222      XXX  40 -18.635  14.618  27.921
  314    H25  EVT 101           H25      XXX  40 -19.573  21.254  16.598
  315   H293  EVT 101          H293      XXX  40 -17.621  14.264  30.253
  316   H292  EVT 101          H292      XXX  40 -16.168  13.620  29.463
  317   H303  EVT 101          H303      XXX  40 -17.400  11.678  30.148
  318   H302  EVT 101          H302      XXX  40 -17.659  11.790  28.401
  319   H313  EVT 101          H313      XXX  40 -19.941  12.884  28.895
  320   H312  EVT 101          H312      XXX  40 -19.601  12.696  30.637
  321   H321  EVT 101          H321      XXX  40 -19.846  10.433  28.567
  322   H323  EVT 101          H323      XXX  40 -21.064  10.850  29.808
  323   H322  EVT 101          H322      XXX  40 -19.477  10.189  30.296
  324   H353  EVT 101          H353      XXX  40 -20.705  18.797   7.517
  325   H352  EVT 101          H352      XXX  40 -21.360  20.293   8.203
  326   H363  EVT 101          H363      XXX  40 -19.417  20.382   9.813
  327   H362  EVT 101          H362      XXX  40 -18.824  18.824   9.121
  328    H37  EVT 101           H37      XXX  40 -21.598  19.264  10.349
  Start of MODEL    6
    1    H1   HIS   1           H1       HIS   1 -13.555   8.150   7.116
    2    H2   HIS   1           H2       HIS   1 -13.210   6.545   7.728
    3    H3   HIS   1           H3       HIS   1 -12.204   7.233   6.519
    4    HA   HIS   1           HA       HIS   1 -13.782   5.568   5.554
    5    HB2  HIS   1           HB2      HIS   1 -15.928   7.648   6.291
    6    HB3  HIS   1           HB3      HIS   1 -16.203   6.145   5.391
    7    HD1  HIS   1           HD1      HIS   1 -16.146   3.963   6.820
    8    HD2  HIS   1           HD2      HIS   1 -15.601   7.513   8.993
    9    HE1  HIS   1           HE1      HIS   1 -16.443   3.327   9.243
   10    H    AIB   2           H        AIB   2 -14.766   5.983   3.286
   11   HB11  AIB   2           H31      AIB   2 -16.203   6.934   1.296
   12   HB12  AIB   2           H32      AIB   2 -15.146   7.691   0.081
   13   HB13  AIB   2           H33      AIB   2 -14.775   6.055   0.690
   14   HB21  AIB   2           H21      AIB   2 -12.441   6.723   1.441
   15   HB22  AIB   2           H22      AIB   2 -12.745   8.297   0.659
   16   HB23  AIB   2           H23      AIB   2 -12.179   8.231   2.347
   17    H    GLN   3           H        GLN   3 -16.501   8.297   3.381
   18    HA   GLN   3           HA       GLN   3 -16.858  10.935   2.457
   19    HB2  GLN   3           H42      GLN   3 -18.658   9.735   3.640
   20    HB3  GLN   3           H43      GLN   3 -17.694   9.695   5.141
   21    HG2  GLN   3           H32      GLN   3 -17.835  12.186   5.330
   22    HG3  GLN   3           H33      GLN   3 -18.573  12.291   3.722
   23   HE21  GLN   3           H61      GLN   3 -20.858  10.739   6.846
   24   HE22  GLN   3           H62      GLN   3 -19.164  10.456   6.880
   25    H    GLY   4           H        GLY   4 -15.187   9.761   5.530
   26    HA2  GLY   4           HA2      GLY   4 -14.331  12.000   6.737
   27    HA3  GLY   4           HA3      GLY   4 -13.205  10.676   6.403
   28    H    THR   5           H        THR   5 -12.735  10.655   3.762
   29    HA   THR   5           HA       THR   5 -10.868  12.780   3.510
   30    HB   THR   5           HB       THR   5 -12.009  10.971   1.304
   31    HG1  THR   5           HG1      THR   5  -9.824  10.559   3.114
   32   HG21  THR   5          HG21      THR   5  -9.825  11.324   0.197
   33   HG22  THR   5          HG22      THR   5 -10.688  12.875   0.375
   34   HG23  THR   5          HG23      THR   5  -9.330  12.475   1.466
   35    H    PHE   6           H        PHE   6 -14.132  12.327   1.849
   36    HA   PHE   6           HA       PHE   6 -13.772  14.868   0.480
   37    HB2  PHE   6           HB2      PHE   6 -16.135  12.949   0.700
   38    HB3  PHE   6           HB3      PHE   6 -16.369  14.631   0.180
   39    HD1  PHE   6           HD1      PHE   6 -17.056  14.118  -2.086
   40    HD2  PHE   6           HD2      PHE   6 -13.287  12.617  -0.641
   41    HE1  PHE   6           HE1      PHE   6 -16.256  13.877  -4.405
   42    HE2  PHE   6           HE2      PHE   6 -12.505  12.361  -2.961
   43    HZ   PHE   6           HZ       PHE   6 -13.964  13.039  -4.855
   44    H    THR   7           H        THR   7 -15.934  13.974   3.358
   45    HA   THR   7           HA       THR   7 -16.810  16.594   3.624
   46    HB   THR   7           HB       THR   7 -17.732  14.656   4.961
   47    HG1  THR   7           HG1      THR   7 -18.284  16.865   5.543
   48   HG21  THR   7          HG21      THR   7 -15.372  15.266   6.861
   49   HG22  THR   7          HG22      THR   7 -16.735  14.161   7.174
   50   HG23  THR   7          HG23      THR   7 -15.563  13.787   5.880
   51    H    SER   8           H        SER   8 -13.628  15.203   4.730
   52    HA   SER   8           HA       SER   8 -12.975  17.477   6.328
   53    HB2  SER   8           HB2      SER   8 -10.660  16.883   6.200
   54    HB3  SER   8           HB3      SER   8 -11.599  15.386   6.378
   55    HG   SER   8           HG       SER   8 -11.270  15.148   4.026
   56    H    ASP   9           H        ASP   9 -12.653  16.792   2.745
   57    HA   ASP   9           HA       ASP   9 -11.429  19.336   2.200
   58    HB2  ASP   9           HB2      ASP   9 -11.291  17.609   0.505
   59    HB3  ASP   9           HB3      ASP   9 -13.057  17.494   0.399
   60    H    LEU  10           H        LEU  10 -14.961  18.289   2.519
   61    HA   LEU  10           HA       LEU  10 -15.973  20.794   1.644
   62    HB2  LEU  10           HB2      LEU  10 -17.136  19.006   3.849
   63    HB3  LEU  10           HB3      LEU  10 -17.938  20.434   3.191
   64    HG   LEU  10           HG       LEU  10 -17.258  17.942   1.536
   65   HD11  LEU  10          HD11      LEU  10 -19.073  17.533   3.260
   66   HD12  LEU  10          HD12      LEU  10 -19.991  18.910   2.593
   67   HD13  LEU  10          HD13      LEU  10 -19.694  17.464   1.598
   68   HD21  LEU  10          HD21      LEU  10 -18.869  19.003  -0.139
   69   HD22  LEU  10          HD22      LEU  10 -18.894  20.469   0.862
   70   HD23  LEU  10          HD23      LEU  10 -17.390  19.955   0.056
   71    H    SER  11           H        SER  11 -14.677  19.776   4.934
   72    HA   SER  11           HA       SER  11 -15.291  22.385   6.012
   73    HB2  SER  11           HB2      SER  11 -13.675  21.808   7.845
   74    HB3  SER  11           HB3      SER  11 -15.014  20.661   7.623
   75    HG   SER  11           HG       SER  11 -12.378  20.176   6.646
   76    H    LYS  12           H        LYS  12 -12.360  21.024   4.256
   77    HA   LYS  12           HA       LYS  12 -10.719  23.286   4.810
   78    HB2  LYS  12           HB2      LYS  12 -10.125  21.063   3.589
   79    HB3  LYS  12           HB3      LYS  12 -10.787  21.792   2.107
   80    HG2  LYS  12           HG2      LYS  12  -8.493  22.949   3.821
   81    HG3  LYS  12           HG3      LYS  12  -8.287  21.877   2.411
   82    HD2  LYS  12           HD2      LYS  12  -9.321  23.550   0.905
   83    HD3  LYS  12           HD3      LYS  12  -9.499  24.683   2.255
   84    HE2  LYS  12           HE2      LYS  12  -7.015  24.646   2.621
   85    HE3  LYS  12           HE3      LYS  12  -6.837  23.557   1.221
   86    HZ1  LYS  12           HZ1      LYS  12  -7.787  25.322  -0.235
   87    HZ2  LYS  12           HZ2      LYS  12  -7.971  26.374   1.131
   88    HZ3  LYS  12           HZ3      LYS  12  -6.379  25.898   0.618
   89    H    GLN  13           H        GLN  13 -13.256  22.669   2.273
   90    HA   GLN  13           HA       GLN  13 -12.970  25.240   1.044
   91    HB2  GLN  13           HB2      GLN  13 -15.345  23.302   1.144
   92    HB3  GLN  13           HB3      GLN  13 -15.363  24.822   0.229
   93    HG2  GLN  13           HG2      GLN  13 -13.448  24.091  -1.156
   94    HG3  GLN  13           HG3      GLN  13 -13.270  22.600  -0.216
   95   HE21  GLN  13          HE21      GLN  13 -16.005  20.932  -1.836
   96   HE22  GLN  13          HE22      GLN  13 -14.892  20.858  -0.527
   97    H    LYS  14           H        LYS  14 -15.165  24.124   3.802
   98    HA   LYS  14           HA       LYS  14 -16.332  26.751   4.004
   99    HB2  LYS  14           HB2      LYS  14 -16.049  24.647   6.185
  100    HB3  LYS  14           HB3      LYS  14 -16.912  26.191   6.395
  101    HG2  LYS  14           HG2      LYS  14 -18.595  25.530   4.715
  102    HG3  LYS  14           HG3      LYS  14 -17.627  24.098   4.277
  103    HD2  LYS  14           HD2      LYS  14 -17.881  23.221   6.623
  104    HD3  LYS  14           HD3      LYS  14 -18.949  24.580   7.027
  105    HE2  LYS  14           HE2      LYS  14 -20.611  23.818   5.359
  106    HE3  LYS  14           HE3      LYS  14 -19.474  22.586   4.747
  107    HZ1  LYS  14           HZ1      LYS  14 -19.724  21.819   7.332
  108    H    ASP  15           H        ASP  15 -13.847  25.196   6.251
  109    HA   ASP  15           HA       ASP  15 -12.988  27.305   7.632
  110    HB2  ASP  15           H32      ASP  15 -11.214  25.250   6.207
  111    HB3  ASP  15           H33      ASP  15 -10.653  26.298   7.525
  112    H    GLU  16           H        GLU  16 -12.064  26.714   4.133
  113    HA   GLU  16           HA       GLU  16 -10.203  28.898   4.082
  114    HB2  GLU  16           HB2      GLU  16 -10.198  27.121   2.342
  115    HB3  GLU  16           HB3      GLU  16 -11.785  27.661   1.743
  116    HG2  GLU  16           HG2      GLU  16 -10.736  29.939   1.213
  117    HG3  GLU  16           HG3      GLU  16  -9.172  29.296   1.763
  118    H    GLN  17           H        GLN  17 -13.697  28.625   2.979
  119    HA   GLN  17           HA       GLN  17 -13.934  31.381   2.341
  120    HB2  GLN  17           H42      GLN  17 -15.629  29.823   1.594
  121    HB3  GLN  17           H43      GLN  17 -16.019  29.352   3.266
  122    HG2  GLN  17           H32      GLN  17 -17.782  30.781   2.475
  123    HG3  GLN  17           H33      GLN  17 -16.899  31.700   3.701
  124   HE21  GLN  17           H61      GLN  17 -15.562  34.082   1.274
  125   HE22  GLN  17           H62      GLN  17 -15.196  33.371   2.795
  126    H    ARG  18           H        ARG  18 -14.735  29.608   5.440
  127    HA   ARG  18           HA       ARG  18 -15.616  31.814   6.879
  128    HB2  ARG  18           H42      ARG  18 -13.944  29.459   7.933
  129    HB3  ARG  18           H43      ARG  18 -14.786  30.638   8.953
  130    HG2  ARG  18           H33      ARG  18 -16.981  29.969   7.822
  131    HG3  ARG  18           H32      ARG  18 -16.109  28.633   7.021
  132    HD2  ARG  18           H52      ARG  18 -15.507  27.665   9.215
  133    HD3  ARG  18           H53      ARG  18 -16.383  29.012  10.028
  134    HE   ARG  18           H10      ARG  18 -18.149  27.741   8.155
  135   HH11  ARG  18           H71      ARG  18 -19.739  26.344   8.916
  136   HH12  ARG  18           H72      ARG  18 -19.608  25.619  10.474
  137   HH21  ARG  18           H81      ARG  18 -16.546  27.092  11.272
  138   HH22  ARG  18           H82      ARG  18 -17.834  26.029  11.813
  139    H    ALA  19           H        ALA  19 -12.157  30.693   6.429
  140    HA   ALA  19           HA       ALA  19 -11.086  32.775   8.081
  141    HB1  ALA  19           H21      ALA  19  -9.807  31.338   5.688
  142    HB2  ALA  19           H22      ALA  19  -8.937  32.401   6.834
  143    HB3  ALA  19           H23      ALA  19  -9.673  30.877   7.407
  144    H    LYS  20           H        LYS  20 -11.763  32.626   4.477
  145    HA   LYS  20           HA       LYS  20 -10.726  35.226   3.977
  146    HB2  LYS  20           H42      LYS  20 -12.915  33.692   2.511
  147    HB3  LYS  20           H43      LYS  20 -12.243  35.242   1.957
  148    HG2  LYS  20           H23      LYS  20 -10.045  34.276   1.577
  149    HG3  LYS  20           H22      LYS  20 -10.443  32.796   2.467
  150    HD2  LYS  20           H33      LYS  20 -10.447  32.369   0.036
  151    HD3  LYS  20           H32      LYS  20 -12.053  32.078   0.743
  152    HE2  LYS  20           H53      LYS  20 -12.889  34.231  -0.129
  153    HE3  LYS  20           H52      LYS  20 -11.246  34.682  -0.675
  154    HZ1  LYS  20           H71      LYS  20 -12.863  32.338  -1.693
  155    HZ2  LYS  20           H72      LYS  20 -12.693  33.887  -2.500
  156    HZ3  LYS  20           H73      LYS  20 -11.290  32.854  -2.283
  157    H    LEU  21           H        LEU  21 -14.008  34.152   5.192
  158    HA   LEU  21           HA       LEU  21 -15.182  36.773   4.978
  159    HB2  LEU  21           HB2      LEU  21 -15.761  34.627   7.118
  160    HB3  LEU  21           HB3      LEU  21 -16.762  36.050   6.789
  161    HG   LEU  21           HG       LEU  21 -16.348  33.731   4.849
  162   HD11  LEU  21          HD11      LEU  21 -18.633  33.045   5.436
  163   HD12  LEU  21          HD12      LEU  21 -17.648  33.105   6.917
  164   HD13  LEU  21          HD13      LEU  21 -18.784  34.430   6.560
  165   HD21  LEU  21          HD21      LEU  21 -18.289  34.756   3.602
  166   HD22  LEU  21          HD22      LEU  21 -18.262  36.154   4.704
  167   HD23  LEU  21          HD23      LEU  21 -16.885  35.844   3.610
  168    H    PHE  22           H        PHE  22 -13.255  35.040   7.538
  169    HA   PHE  22           HA       PHE  22 -13.475  37.099   9.475
  170    HB2  PHE  22           HB2      PHE  22 -12.645  34.788   9.917
  171    HB3  PHE  22           HB3      PHE  22 -11.134  35.173   9.068
  172    HD1  PHE  22           HD1      PHE  22 -13.329  36.156  11.952
  173    HD2  PHE  22           HD2      PHE  22  -9.408  36.527  10.239
  174    HE1  PHE  22           HE1      PHE  22 -12.436  36.806  14.157
  175    HE2  PHE  22           HE2      PHE  22  -8.491  37.061  12.481
  176    HZ   PHE  22           HZ       PHE  22 -10.002  37.244  14.430
  177    H    ILE  23           H        ILE  23 -11.158  36.637   6.662
  178    HA   ILE  23           HA       ILE  23  -9.557  38.927   7.427
  179    HB   ILE  23           HB       ILE  23  -9.780  37.266   4.903
  180   HG12  ILE  23          HG12      ILE  23  -7.284  37.173   5.177
  181   HG13  ILE  23          HG13      ILE  23  -7.389  38.297   6.547
  182   HG21  ILE  23          HG21      ILE  23  -8.488  40.040   4.920
  183   HG22  ILE  23          HG22      ILE  23  -8.283  38.813   3.644
  184   HG23  ILE  23          HG23      ILE  23  -9.882  39.527   3.931
  185   HD11  ILE  23          HD11      ILE  23  -8.582  35.455   6.428
  186   HD12  ILE  23          HD12      ILE  23  -7.137  35.962   7.340
  187   HD13  ILE  23          HD13      ILE  23  -8.736  36.560   7.829
  188    H    GLU  24           H        GLU  24 -12.507  38.605   5.250
  189    HA   GLU  24           HA       GLU  24 -12.492  41.349   4.512
  190    HB2  GLU  24           HB2      GLU  24 -14.945  39.584   5.109
  191    HB3  GLU  24           HB3      GLU  24 -15.002  41.209   4.387
  192    HG2  GLU  24           HG2      GLU  24 -13.663  40.388   2.422
  193    HG3  GLU  24           HG3      GLU  24 -13.675  38.745   3.103
  194    H    TRP  25           H        TRP  25 -13.736  39.645   7.469
  195    HA   TRP  25           HA       TRP  25 -14.913  41.974   8.651
  196    HB2  TRP  25           HB2      TRP  25 -15.457  39.701   9.335
  197    HB3  TRP  25           HB3      TRP  25 -13.792  39.419   9.892
  198    HD1  TRP  25           HD1      TRP  25 -16.780  41.679  10.904
  199    HE1  TRP  25           HE1      TRP  25 -16.600  42.075  13.387
  200    HE3  TRP  25           HE3      TRP  25 -12.218  39.375  11.817
  201    HZ2  TRP  25           HZ2      TRP  25 -14.931  41.492  15.480
  202    HZ3  TRP  25           HZ3      TRP  25 -11.390  39.395  14.167
  203    HH2  TRP  25           HH2      TRP  25 -12.796  40.291  15.995
  204    H    LEU  26           H        LEU  26 -11.518  40.571   8.936
  205    HA   LEU  26           HA       LEU  26 -10.710  42.512  10.877
  206    HB2  LEU  26           HB2      LEU  26  -9.046  41.139   8.700
  207    HB3  LEU  26           HB3      LEU  26  -8.349  42.149   9.990
  208    HG   LEU  26           HG       LEU  26  -9.857  39.493  10.446
  209   HD11  LEU  26          HD11      LEU  26  -6.853  40.162  10.485
  210   HD12  LEU  26          HD12      LEU  26  -7.570  38.589  10.918
  211   HD13  LEU  26          HD13      LEU  26  -7.691  39.180   9.247
  212   HD21  LEU  26          HD21      LEU  26  -8.296  41.263  12.426
  213   HD22  LEU  26          HD22      LEU  26 -10.055  40.964  12.463
  214   HD23  LEU  26          HD23      LEU  26  -8.929  39.632  12.762
  215    H    AIB  27           H        ALA  27 -10.682  42.504   7.244
  216   HB11  AIB  27           H21      ALA  27  -8.175  44.427   6.703
  217   HB12  AIB  27           H22      ALA  27  -8.812  46.014   6.190
  218   HB13  AIB  27           H23      ALA  27  -8.753  45.598   7.912
  219   HB21  AIB  27           H31      ALA  27 -10.478  45.021   4.646
  220   HB22  AIB  27           H32      ALA  27  -9.859  43.388   5.016
  221   HB23  AIB  27           H33      ALA  27 -11.593  43.743   5.178
  222    H    ALA  28           H        ALA  28 -12.836  44.102   7.479
  223    HA   ALA  28           HA       ALA  28 -13.862  46.755   7.132
  224    HB1  ALA  28           H21      ALA  28 -14.956  44.502   8.922
  225    HB2  ALA  28           H22      ALA  28 -15.876  45.900   8.314
  226    HB3  ALA  28           H23      ALA  28 -15.288  44.662   7.174
  227    H    GLY  29           H        GLY  29 -11.886  45.391   9.755
  228    HA2  GLY  29           HA2      GLY  29 -11.372  47.505  11.223
  229    HA3  GLY  29           HA3      GLY  29 -13.048  47.251  11.748
  230    H    GLY  30           H        GLY  30 -12.814  44.152  11.508
  231    HA2  GLY  30           HA2      GLY  30 -12.155  42.457  12.983
  232    HA3  GLY  30           HA3      GLY  30 -10.869  43.526  13.582
  233    HA   PRO  31           HA       PRO  31 -14.213  43.456  16.908
  234    HB2  PRO  31           HB2      PRO  31 -11.769  44.805  18.212
  235    HB3  PRO  31           HB3      PRO  31 -12.973  43.739  18.984
  236    HG2  PRO  31           HG2      PRO  31 -10.610  42.630  18.232
  237    HG3  PRO  31           HG3      PRO  31 -12.118  41.823  17.721
  238    HD2  PRO  31           HD2      PRO  31 -10.405  43.769  16.045
  239    HD3  PRO  31           HD3      PRO  31 -10.983  42.122  15.584
  240    H    SER  32           H        SER  32 -12.059  46.132  15.613
  241    HA   SER  32           HA       SER  32 -13.515  48.276  16.734
  242    HB2  SER  32           HB2      SER  32 -12.145  48.166  13.984
  243    HB3  SER  32           HB3      SER  32 -12.593  49.641  14.883
  244    HG   SER  32           HG       SER  32 -10.328  48.997  15.259
  245    H    SER  33           H        SER  33 -14.106  46.267  13.743
  246    HA   SER  33           HA       SER  33 -15.891  47.937  12.460
  247    HB2  SER  33           HB2      SER  33 -16.946  45.990  11.433
  248    HB3  SER  33           HB3      SER  33 -15.189  45.724  11.486
  249    HG   SER  33           HG       SER  33 -15.643  44.360  13.396
  250    H    GLY  34           H        GLY  34 -16.549  45.880  15.378
  251    HA2  GLY  34           HA2      GLY  34 -18.313  46.473  16.885
  252    HA3  GLY  34           HA3      GLY  34 -19.229  47.229  15.576
  253    H    ALA  35           H        ALA  35 -19.012  45.205  13.509
  254    HA   ALA  35           HA       ALA  35 -21.090  43.473  14.262
  255    HB1  ALA  35           HB1      ALA  35 -18.954  43.089  12.077
  256    HB2  ALA  35           HB2      ALA  35 -20.461  42.144  12.217
  257    HB3  ALA  35           HB3      ALA  35 -20.533  43.896  11.893
  258    HA   PRO  36           HA       PRO  36 -18.360  40.618  16.740
  259    HB2  PRO  36           HB2      PRO  36 -20.694  38.793  15.908
  260    HB3  PRO  36           HB3      PRO  36 -19.848  38.811  17.489
  261    HG2  PRO  36           HG2      PRO  36 -22.252  40.062  17.303
  262    HG3  PRO  36           HG3      PRO  36 -20.887  40.935  18.057
  263    HD2  PRO  36           HD2      PRO  36 -21.937  41.272  15.191
  264    HD3  PRO  36           HD3      PRO  36 -21.479  42.534  16.391
  265    HA   PRO  37           HA       PRO  37 -16.483  38.873  13.150
  266    HB2  PRO  37           HB2      PRO  37 -15.154  36.550  14.021
  267    HB3  PRO  37           HB3      PRO  37 -14.669  38.203  14.484
  268    HG2  PRO  37           HG2      PRO  37 -16.542  36.361  16.047
  269    HG3  PRO  37           HG3      PRO  37 -15.034  37.110  16.650
  270    HD2  PRO  37           HD2      PRO  37 -17.420  38.334  17.148
  271    HD3  PRO  37           HD3      PRO  37 -16.078  39.367  16.521
  272    HA   PRO  38           HA       PRO  38 -19.472  35.895  11.596
  273    HB2  PRO  38           HB2      PRO  38 -18.450  35.314   9.112
  274    HB3  PRO  38           HB3      PRO  38 -18.772  37.003   9.592
  275    HG2  PRO  38           HG2      PRO  38 -16.065  35.586   9.787
  276    HG3  PRO  38           HG3      PRO  38 -16.415  37.102   8.911
  277    HD2  PRO  38           HD2      PRO  38 -15.472  37.161  11.503
  278    HD3  PRO  38           HD3      PRO  38 -16.717  38.331  10.928
  279    H    SER  39           H        SER  39 -18.656  34.440  13.587
  280    HA   SER  39           HA       SER  39 -16.824  32.299  12.788
  281    HB2  SER  39           HB2      SER  39 -18.478  32.363  15.363
  282    HB3  SER  39           HB3      SER  39 -17.141  31.278  14.947
  283    HG   SER  39           HG       SER  39 -16.836  34.109  15.183
  284    HN1  NH2  40           H11      SER  39 -20.762  30.981  12.739
  285    HN2  NH2  40           H12      SER  39 -20.400  32.428  13.605
  286    H93  EVT 101           H93      XXX  40 -24.934  19.019  12.645
  287    H92  EVT 101           H92      XXX  40 -25.465  20.686  12.287
  288   H103  EVT 101          H103      XXX  40 -27.596  19.805  11.327
  289   H102  EVT 101          H102      XXX  40 -27.012  18.135  11.526
  290    H11  EVT 101           H11      XXX  40 -27.049  18.395  14.015
  291   H122  EVT 101          H122      XXX  40 -31.338  17.869  12.497
  292   H123  EVT 101          H123      XXX  40 -30.811  16.230  12.062
  293   H133  EVT 101          H133      XXX  40 -30.830  15.533  14.432
  294   H132  EVT 101          H132      XXX  40 -32.408  16.223  13.996
  295   H143  EVT 101          H143      XXX  40 -31.577  18.468  15.003
  296   H142  EVT 101          H142      XXX  40 -30.151  17.592  15.603
  297   H153  EVT 101          H153      XXX  40 -31.728  16.008  16.836
  298   H152  EVT 101          H152      XXX  40 -33.090  17.015  16.285
  299    H6   EVT 101           H6       XXX  40 -22.980  19.397  11.285
  300   H163  EVT 101          H163      XXX  40 -31.920  19.010  17.473
  301   H162  EVT 101          H162      XXX  40 -30.785  17.826  18.172
  302   H173  EVT 101          H173      XXX  40 -32.755  16.587  19.172
  303   H172  EVT 101          H172      XXX  40 -33.854  17.815  18.490
  304   H183  EVT 101          H183      XXX  40 -32.696  19.598  19.809
  305   H182  EVT 101          H182      XXX  40 -31.679  18.366  20.595
  306   H193  EVT 101          H193      XXX  40 -34.761  18.451  20.706
  307   H192  EVT 101          H192      XXX  40 -33.709  19.168  21.951
  308   H203  EVT 101          H203      XXX  40 -32.797  16.981  22.577
  309   H202  EVT 101          H202      XXX  40 -33.683  16.175  21.267
  310   H213  EVT 101          H213      XXX  40 -35.865  16.794  22.274
  311   H212  EVT 101          H212      XXX  40 -35.035  17.663  23.590
  312   H223  EVT 101          H223      XXX  40 -34.013  15.556  24.398
  313   H222  EVT 101          H222      XXX  40 -34.700  14.664  23.011
  314    H25  EVT 101           H25      XXX  40 -29.707  19.389  13.325
  315   H293  EVT 101          H293      XXX  40 -36.997  15.022  23.820
  316   H292  EVT 101          H292      XXX  40 -36.432  16.154  25.069
  317   H303  EVT 101          H303      XXX  40 -36.990  14.023  26.127
  318   H302  EVT 101          H302      XXX  40 -35.243  14.315  26.266
  319   H313  EVT 101          H313      XXX  40 -34.824  12.726  24.366
  320   H312  EVT 101          H312      XXX  40 -36.582  12.477  24.173
  321   H321  EVT 101          H321      XXX  40 -34.919  11.745  26.663
  322   H323  EVT 101          H323      XXX  40 -35.555  10.599  25.452
  323   H322  EVT 101          H322      XXX  40 -36.686  11.499  26.497
  324   H353  EVT 101          H353      XXX  40 -20.936  19.683   7.324
  325   H352  EVT 101          H352      XXX  40 -22.489  19.585   6.476
  326   H363  EVT 101          H363      XXX  40 -23.542  21.015   8.248
  327   H362  EVT 101          H362      XXX  40 -21.973  21.130   9.079
  328    H37  EVT 101           H37      XXX  40 -23.597  18.559   8.537
  Start of MODEL    7
    1    H1   HIS   1           H1       HIS   1 -13.119   6.663   3.514
    2    H2   HIS   1           H2       HIS   1 -13.743   5.031   3.371
    3    H3   HIS   1           H3       HIS   1 -12.249   5.440   2.643
    4    HA   HIS   1           HA       HIS   1 -14.089   5.294   0.988
    5    HB2  HIS   1           HB2      HIS   1 -15.145   7.769   2.498
    6    HB3  HIS   1           HB3      HIS   1 -15.702   7.247   0.894
    7    HD1  HIS   1           HD1      HIS   1 -15.683   6.066   4.465
    8    HD2  HIS   1           HD2      HIS   1 -17.463   5.245   0.755
    9    HE1  HIS   1           HE1      HIS   1 -17.509   4.391   4.952
   10    H    AIB   2           H        AIB   2 -13.351   6.244  -1.013
   11   HB11  AIB   2           H31      AIB   2 -13.499   7.743  -3.139
   12   HB12  AIB   2           H32      AIB   2 -11.912   8.465  -3.487
   13   HB13  AIB   2           H33      AIB   2 -12.036   6.725  -3.113
   14   HB21  AIB   2           H21      AIB   2 -10.321   6.990  -1.256
   15   HB22  AIB   2           H22      AIB   2 -10.167   8.719  -1.666
   16   HB23  AIB   2           H23      AIB   2 -10.506   8.237   0.007
   17    H    GLN   3           H        GLN   3 -14.765   8.612  -0.951
   18    HA   GLN   3           HA       GLN   3 -14.826  11.311  -1.477
   19    HB2  GLN   3           H42      GLN   3 -16.839   9.974  -0.997
   20    HB3  GLN   3           H43      GLN   3 -16.398   9.861   0.730
   21    HG2  GLN   3           H32      GLN   3 -16.718  12.271   1.053
   22    HG3  GLN   3           H33      GLN   3 -16.842  12.565  -0.691
   23   HE21  GLN   3           H61      GLN   3 -20.228  11.255  -0.993
   24   HE22  GLN   3           H62      GLN   3 -18.746  11.263  -1.865
   25    H    GLY   4           H        GLY   4 -13.579   9.716   1.560
   26    HA2  GLY   4           HA2      GLY   4 -13.198  11.674   3.336
   27    HA3  GLY   4           HA3      GLY   4 -11.833  10.674   2.806
   28    H    THR   5           H        THR   5 -11.255  11.396   0.262
   29    HA   THR   5           HA       THR   5  -9.719  13.737   0.726
   30    HB   THR   5           HB       THR   5 -10.442  12.643  -2.032
   31    HG1  THR   5           HG1      THR   5  -8.822  10.965  -1.514
   32   HG21  THR   5          HG21      THR   5  -8.026  13.131  -2.532
   33   HG22  THR   5          HG22      THR   5  -8.828  14.610  -1.943
   34   HG23  THR   5          HG23      THR   5  -7.770  13.666  -0.856
   35    H    PHE   6           H        PHE   6 -12.822  13.204  -1.152
   36    HA   PHE   6           HA       PHE   6 -12.949  15.971  -2.002
   37    HB2  PHE   6           HB2      PHE   6 -14.969  13.698  -2.092
   38    HB3  PHE   6           HB3      PHE   6 -15.506  15.378  -2.218
   39    HD1  PHE   6           HD1      PHE   6 -16.134  15.558  -4.516
   40    HD2  PHE   6           HD2      PHE   6 -12.298  13.851  -3.567
   41    HE1  PHE   6           HE1      PHE   6 -15.458  15.749  -6.878
   42    HE2  PHE   6           HE2      PHE   6 -11.590  14.186  -5.907
   43    HZ   PHE   6           HZ       PHE   6 -13.140  15.176  -7.555
   44    H    THR   7           H        THR   7 -14.844  14.250   0.687
   45    HA   THR   7           HA       THR   7 -15.960  16.694   1.465
   46    HB   THR   7           HB       THR   7 -16.775  14.518   2.368
   47    HG1  THR   7           HG1      THR   7 -17.334  16.566   3.460
   48   HG21  THR   7          HG21      THR   7 -14.388  14.731   4.305
   49   HG22  THR   7          HG22      THR   7 -15.726  13.557   4.383
   50   HG23  THR   7          HG23      THR   7 -14.583  13.519   3.009
   51    H    SER   8           H        SER   8 -12.680  15.385   2.282
   52    HA   SER   8           HA       SER   8 -12.197  17.383   4.288
   53    HB2  SER   8           HB2      SER   8  -9.800  16.933   3.995
   54    HB3  SER   8           HB3      SER   8 -10.743  15.426   4.065
   55    HG   SER   8           HG       SER   8  -9.746  16.589   1.654
   56    H    ASP   9           H        ASP   9 -11.902  17.299   0.658
   57    HA   ASP   9           HA       ASP   9 -10.748  19.911   0.487
   58    HB2  ASP   9           HB2      ASP   9 -10.763  18.141  -1.359
   59    HB3  ASP   9           HB3      ASP   9 -12.479  18.506  -1.630
   60    H    LEU  10           H        LEU  10 -14.206  18.708   0.630
   61    HA   LEU  10           HA       LEU  10 -15.360  21.259   0.067
   62    HB2  LEU  10           HB2      LEU  10 -16.410  19.023   1.897
   63    HB3  LEU  10           HB3      LEU  10 -17.358  20.442   1.460
   64    HG   LEU  10           HG       LEU  10 -16.367  18.299  -0.513
   65   HD11  LEU  10          HD11      LEU  10 -18.201  17.507   1.056
   66   HD12  LEU  10          HD12      LEU  10 -19.198  18.894   0.552
   67   HD13  LEU  10          HD13      LEU  10 -18.764  17.631  -0.628
   68   HD21  LEU  10          HD21      LEU  10 -17.955  19.429  -2.132
   69   HD22  LEU  10          HD22      LEU  10 -18.206  20.741  -0.945
   70   HD23  LEU  10          HD23      LEU  10 -16.612  20.493  -1.700
   71    H    SER  11           H        SER  11 -14.318  19.718   3.239
   72    HA   SER  11           HA       SER  11 -15.116  22.039   4.722
   73    HB2  SER  11           HB2      SER  11 -13.569  21.125   6.530
   74    HB3  SER  11           HB3      SER  11 -14.837  20.014   5.964
   75    HG   SER  11           HG       SER  11 -12.143  19.877   5.036
   76    H    LYS  12           H        LYS  12 -12.107  21.262   2.826
   77    HA   LYS  12           HA       LYS  12 -10.622  23.475   3.933
   78    HB2  LYS  12           HB2      LYS  12  -9.777  21.508   2.537
   79    HB3  LYS  12           HB3      LYS  12 -10.404  22.327   1.088
   80    HG2  LYS  12           HG2      LYS  12  -8.330  23.504   3.039
   81    HG3  LYS  12           HG3      LYS  12  -7.936  22.561   1.589
   82    HD2  LYS  12           HD2      LYS  12  -9.054  24.239   0.122
   83    HD3  LYS  12           HD3      LYS  12  -9.406  25.252   1.535
   84    HE2  LYS  12           HE2      LYS  12  -6.910  25.382   2.011
   85    HE3  LYS  12           HE3      LYS  12  -6.628  24.486   0.493
   86    HZ1  LYS  12           HZ1      LYS  12  -7.975  27.199   0.745
   87    HZ2  LYS  12           HZ2      LYS  12  -6.376  26.891   0.145
   88    HZ3  LYS  12           HZ3      LYS  12  -7.771  26.328  -0.735
   89    H    GLN  13           H        GLN  13 -13.056  23.197   1.190
   90    HA   GLN  13           HA       GLN  13 -12.825  25.942   0.470
   91    HB2  GLN  13           HB2      GLN  13 -15.463  24.370   0.470
   92    HB3  GLN  13           HB3      GLN  13 -15.135  25.906  -0.358
   93    HG2  GLN  13           HG2      GLN  13 -13.374  24.732  -1.745
   94    HG3  GLN  13           HG3      GLN  13 -13.943  23.184  -1.082
   95   HE21  GLN  13          HE21      GLN  13 -17.217  23.415  -2.742
   96   HE22  GLN  13          HE22      GLN  13 -16.606  23.016  -1.189
   97    H    LYS  14           H        LYS  14 -14.619  24.322   3.173
   98    HA   LYS  14           HA       LYS  14 -16.084  26.780   3.776
   99    HB2  LYS  14           HB2      LYS  14 -15.627  24.325   5.523
  100    HB3  LYS  14           HB3      LYS  14 -16.745  25.649   5.893
  101    HG2  LYS  14           HG2      LYS  14 -18.098  25.153   3.830
  102    HG3  LYS  14           HG3      LYS  14 -16.915  23.930   3.342
  103    HD2  LYS  14           HD2      LYS  14 -17.374  22.649   5.465
  104    HD3  LYS  14           HD3      LYS  14 -18.683  23.798   5.845
  105    HE2  LYS  14           HE2      LYS  14 -19.851  23.171   3.726
  106    HE3  LYS  14           HE3      LYS  14 -18.536  22.043   3.301
  107    HZ1  LYS  14           HZ1      LYS  14 -19.167  21.111   5.731
  108    H    ASP  15           H        ASP  15 -13.326  25.059   5.483
  109    HA   ASP  15           HA       ASP  15 -12.695  27.113   7.242
  110    HB2  ASP  15           H32      ASP  15 -10.880  25.203   5.650
  111    HB3  ASP  15           H33      ASP  15 -10.234  26.274   6.903
  112    H    GLU  16           H        GLU  16 -11.970  26.920   3.667
  113    HA   GLU  16           HA       GLU  16 -10.204  29.203   3.762
  114    HB2  GLU  16           HB2      GLU  16 -10.172  27.563   1.868
  115    HB3  GLU  16           HB3      GLU  16 -11.776  28.127   1.353
  116    HG2  GLU  16           HG2      GLU  16 -10.742  30.497   1.170
  117    HG3  GLU  16           HG3      GLU  16  -9.158  29.754   1.482
  118    H    GLN  17           H        GLN  17 -13.698  28.754   2.762
  119    HA   GLN  17           HA       GLN  17 -14.215  31.466   2.235
  120    HB2  GLN  17           H42      GLN  17 -15.817  29.577   1.741
  121    HB3  GLN  17           H43      GLN  17 -16.090  29.369   3.491
  122    HG2  GLN  17           H32      GLN  17 -17.958  30.604   2.513
  123    HG3  GLN  17           H33      GLN  17 -17.075  31.685   3.613
  124   HE21  GLN  17           H61      GLN  17 -15.951  33.856   0.930
  125   HE22  GLN  17           H62      GLN  17 -15.656  33.426   2.571
  126    H    ARG  18           H        ARG  18 -14.298  29.621   5.338
  127    HA   ARG  18           HA       ARG  18 -15.534  31.780   6.795
  128    HB2  ARG  18           H42      ARG  18 -14.046  29.239   7.672
  129    HB3  ARG  18           H43      ARG  18 -14.831  30.352   8.816
  130    HG2  ARG  18           H33      ARG  18 -17.033  29.963   7.891
  131    HG3  ARG  18           H32      ARG  18 -16.407  29.138   6.442
  132    HD2  ARG  18           H52      ARG  18 -15.586  27.270   7.774
  133    HD3  ARG  18           H53      ARG  18 -16.205  28.045   9.283
  134    HE   ARG  18           H10      ARG  18 -18.372  27.885   7.454
  135   HH11  ARG  18           H71      ARG  18 -19.873  26.208   7.555
  136   HH12  ARG  18           H72      ARG  18 -19.482  24.723   8.344
  137   HH21  ARG  18           H81      ARG  18 -16.264  25.689   9.295
  138   HH22  ARG  18           H82      ARG  18 -17.464  24.415   9.335
  139    H    ALA  19           H        ALA  19 -12.083  30.650   6.350
  140    HA   ALA  19           HA       ALA  19 -11.010  32.646   8.106
  141    HB1  ALA  19           H21      ALA  19  -9.782  31.308   5.624
  142    HB2  ALA  19           H22      ALA  19  -8.883  32.419   6.703
  143    HB3  ALA  19           H23      ALA  19  -9.516  30.867   7.342
  144    H    LYS  20           H        LYS  20 -11.757  32.627   4.524
  145    HA   LYS  20           HA       LYS  20 -10.837  35.235   4.024
  146    HB2  LYS  20           H42      LYS  20 -13.135  33.698   2.711
  147    HB3  LYS  20           H43      LYS  20 -12.579  35.304   2.173
  148    HG2  LYS  20           H23      LYS  20 -10.353  34.480   1.608
  149    HG3  LYS  20           H22      LYS  20 -10.655  32.918   2.393
  150    HD2  LYS  20           H33      LYS  20 -10.812  32.669  -0.057
  151    HD3  LYS  20           H32      LYS  20 -12.393  32.340   0.686
  152    HE2  LYS  20           H53      LYS  20 -13.248  34.533   0.012
  153    HE3  LYS  20           H52      LYS  20 -11.622  35.063  -0.511
  154    HZ1  LYS  20           H71      LYS  20 -13.217  32.796  -1.716
  155    HZ2  LYS  20           H72      LYS  20 -13.032  34.402  -2.411
  156    HZ3  LYS  20           H73      LYS  20 -11.642  33.346  -2.254
  157    H    LEU  21           H        LEU  21 -14.115  34.145   5.269
  158    HA   LEU  21           HA       LEU  21 -15.197  36.801   5.217
  159    HB2  LEU  21           HB2      LEU  21 -15.781  34.465   7.112
  160    HB3  LEU  21           HB3      LEU  21 -16.726  35.966   7.119
  161    HG   LEU  21           HG       LEU  21 -16.555  34.082   4.697
  162   HD11  LEU  21          HD11      LEU  21 -18.854  33.337   5.396
  163   HD12  LEU  21          HD12      LEU  21 -17.637  32.950   6.628
  164   HD13  LEU  21          HD13      LEU  21 -18.719  34.341   6.870
  165   HD21  LEU  21          HD21      LEU  21 -18.559  35.325   3.884
  166   HD22  LEU  21          HD22      LEU  21 -18.463  36.429   5.277
  167   HD23  LEU  21          HD23      LEU  21 -17.180  36.428   4.049
  168    H    PHE  22           H        PHE  22 -13.281  34.935   7.707
  169    HA   PHE  22           HA       PHE  22 -13.403  36.959   9.675
  170    HB2  PHE  22           HB2      PHE  22 -12.563  34.640  10.061
  171    HB3  PHE  22           HB3      PHE  22 -11.080  35.037   9.184
  172    HD1  PHE  22           HD1      PHE  22 -13.027  35.575  12.305
  173    HD2  PHE  22           HD2      PHE  22  -9.504  36.775  10.162
  174    HE1  PHE  22           HE1      PHE  22 -12.005  36.340  14.420
  175    HE2  PHE  22           HE2      PHE  22  -8.463  37.484  12.299
  176    HZ   PHE  22           HZ       PHE  22  -9.721  37.307  14.419
  177    H    ILE  23           H        ILE  23 -11.173  36.535   6.811
  178    HA   ILE  23           HA       ILE  23  -9.541  38.797   7.575
  179    HB   ILE  23           HB       ILE  23  -9.775  37.180   5.008
  180   HG12  ILE  23          HG12      ILE  23  -7.295  36.972   5.308
  181   HG13  ILE  23          HG13      ILE  23  -7.377  38.000   6.765
  182   HG21  ILE  23          HG21      ILE  23  -8.310  39.855   5.224
  183   HG22  ILE  23          HG22      ILE  23  -8.174  38.705   3.869
  184   HG23  ILE  23          HG23      ILE  23  -9.714  39.516   4.179
  185   HD11  ILE  23          HD11      ILE  23  -8.649  35.221   6.408
  186   HD12  ILE  23          HD12      ILE  23  -7.198  35.599   7.368
  187   HD13  ILE  23          HD13      ILE  23  -8.786  36.224   7.883
  188    H    GLU  24           H        GLU  24 -12.501  38.459   5.426
  189    HA   GLU  24           HA       GLU  24 -12.428  41.184   4.605
  190    HB2  GLU  24           HB2      GLU  24 -14.921  39.443   5.108
  191    HB3  GLU  24           HB3      GLU  24 -14.901  41.033   4.309
  192    HG2  GLU  24           HG2      GLU  24 -13.335  40.055   2.532
  193    HG3  GLU  24           HG3      GLU  24 -13.635  38.452   3.240
  194    H    TRP  25           H        TRP  25 -13.733  39.542   7.542
  195    HA   TRP  25           HA       TRP  25 -14.944  41.883   8.697
  196    HB2  TRP  25           HB2      TRP  25 -15.516  39.622   9.415
  197    HB3  TRP  25           HB3      TRP  25 -13.844  39.288   9.894
  198    HD1  TRP  25           HD1      TRP  25 -16.871  41.307  11.130
  199    HE1  TRP  25           HE1      TRP  25 -16.616  41.570  13.631
  200    HE3  TRP  25           HE3      TRP  25 -12.064  39.442  11.713
  201    HZ2  TRP  25           HZ2      TRP  25 -14.756  41.143  15.591
  202    HZ3  TRP  25           HZ3      TRP  25 -11.114  39.446  14.017
  203    HH2  TRP  25           HH2      TRP  25 -12.489  40.156  15.952
  204    H    LEU  26           H        LEU  26 -11.547  40.487   8.969
  205    HA   LEU  26           HA       LEU  26 -10.664  42.493  10.819
  206    HB2  LEU  26           HB2      LEU  26  -9.131  41.043   8.591
  207    HB3  LEU  26           HB3      LEU  26  -8.360  42.194   9.691
  208    HG   LEU  26           HG       LEU  26  -9.666  39.552  10.565
  209   HD11  LEU  26          HD11      LEU  26  -6.734  40.411  10.137
  210   HD12  LEU  26          HD12      LEU  26  -7.212  38.895  10.927
  211   HD13  LEU  26          HD13      LEU  26  -7.626  39.170   9.220
  212   HD21  LEU  26          HD21      LEU  26  -8.102  41.691  12.144
  213   HD22  LEU  26          HD22      LEU  26  -9.774  41.146  12.456
  214   HD23  LEU  26          HD23      LEU  26  -8.426  40.042  12.750
  215    H    AIB  27           H        ALA  27 -10.759  42.398   7.193
  216   HB11  AIB  27           H21      ALA  27  -8.221  44.234   6.655
  217   HB12  AIB  27           H22      ALA  27  -8.791  45.835   6.110
  218   HB13  AIB  27           H23      ALA  27  -8.782  45.436   7.838
  219   HB21  AIB  27           H31      ALA  27 -10.492  44.853   4.534
  220   HB22  AIB  27           H32      ALA  27  -9.838  43.238   4.941
  221   HB23  AIB  27           H33      ALA  27 -11.586  43.556   5.068
  222    H    ALA  28           H        ALA  28 -12.884  44.048   7.304
  223    HA   ALA  28           HA       ALA  28 -13.891  46.690   6.869
  224    HB1  ALA  28           H21      ALA  28 -14.936  44.517   8.807
  225    HB2  ALA  28           H22      ALA  28 -15.873  45.907   8.196
  226    HB3  ALA  28           H23      ALA  28 -15.345  44.624   7.077
  227    H    GLY  29           H        GLY  29 -12.166  45.170   9.635
  228    HA2  GLY  29           HA2      GLY  29 -11.538  47.459  11.018
  229    HA3  GLY  29           HA3      GLY  29 -13.180  47.090  11.580
  230    H    GLY  30           H        GLY  30 -12.898  44.079  11.461
  231    HA2  GLY  30           HA2      GLY  30 -12.035  42.411  12.872
  232    HA3  GLY  30           HA3      GLY  30 -10.803  43.558  13.457
  233    HA   PRO  31           HA       PRO  31 -14.186  43.316  16.747
  234    HB2  PRO  31           HB2      PRO  31 -11.913  44.947  18.012
  235    HB3  PRO  31           HB3      PRO  31 -13.012  43.799  18.828
  236    HG2  PRO  31           HG2      PRO  31 -10.532  42.898  18.125
  237    HG3  PRO  31           HG3      PRO  31 -11.951  41.905  17.674
  238    HD2  PRO  31           HD2      PRO  31 -10.403  43.870  15.884
  239    HD3  PRO  31           HD3      PRO  31 -10.912  42.179  15.511
  240    H    SER  32           H        SER  32 -12.329  46.121  15.333
  241    HA   SER  32           HA       SER  32 -13.982  48.149  16.423
  242    HB2  SER  32           HB2      SER  32 -12.510  48.167  13.724
  243    HB3  SER  32           HB3      SER  32 -13.018  49.600  14.674
  244    HG   SER  32           HG       SER  32 -10.737  48.957  15.053
  245    H    SER  33           H        SER  33 -14.473  45.995  13.515
  246    HA   SER  33           HA       SER  33 -16.331  47.787  12.292
  247    HB2  SER  33           HB2      SER  33 -17.056  45.817  10.924
  248    HB3  SER  33           HB3      SER  33 -15.296  46.088  10.942
  249    HG   SER  33           HG       SER  33 -15.775  43.829  11.340
  250    H    GLY  34           H        GLY  34 -16.817  45.887  15.234
  251    HA2  GLY  34           HA2      GLY  34 -18.811  46.651  16.423
  252    HA3  GLY  34           HA3      GLY  34 -19.747  46.505  14.935
  253    H    ALA  35           H        ALA  35 -19.220  44.133  13.803
  254    HA   ALA  35           HA       ALA  35 -20.870  42.553  15.475
  255    HB1  ALA  35           HB1      ALA  35 -19.298  41.732  12.984
  256    HB2  ALA  35           HB2      ALA  35 -20.579  40.749  13.744
  257    HB3  ALA  35           HB3      ALA  35 -20.981  42.339  13.026
  258    HA   PRO  36           HA       PRO  36 -17.552  39.996  17.524
  259    HB2  PRO  36           HB2      PRO  36 -19.789  37.906  17.059
  260    HB3  PRO  36           HB3      PRO  36 -18.750  38.070  18.513
  261    HG2  PRO  36           HG2      PRO  36 -21.266  39.068  18.638
  262    HG3  PRO  36           HG3      PRO  36 -19.912  40.140  19.120
  263    HD2  PRO  36           HD2      PRO  36 -21.338  40.156  16.378
  264    HD3  PRO  36           HD3      PRO  36 -20.982  41.518  17.512
  265    HA   PRO  37           HA       PRO  37 -16.024  38.496  13.703
  266    HB2  PRO  37           HB2      PRO  37 -14.551  36.126  14.282
  267    HB3  PRO  37           HB3      PRO  37 -14.031  37.792  14.654
  268    HG2  PRO  37           HG2      PRO  37 -15.505  35.891  16.541
  269    HG3  PRO  37           HG3      PRO  37 -13.994  36.793  16.861
  270    HD2  PRO  37           HD2      PRO  37 -16.397  37.768  17.737
  271    HD3  PRO  37           HD3      PRO  37 -15.248  38.923  16.957
  272    HA   PRO  38           HA       PRO  38 -19.126  35.883  12.092
  273    HB2  PRO  38           HB2      PRO  38 -18.189  35.190   9.579
  274    HB3  PRO  38           HB3      PRO  38 -18.410  36.881  10.089
  275    HG2  PRO  38           HG2      PRO  38 -15.775  35.320  10.245
  276    HG3  PRO  38           HG3      PRO  38 -16.065  36.840   9.351
  277    HD2  PRO  38           HD2      PRO  38 -15.064  36.908  11.909
  278    HD3  PRO  38           HD3      PRO  38 -16.334  38.079  11.404
  279    H    SER  39           H        SER  39 -18.842  34.192  13.912
  280    HA   SER  39           HA       SER  39 -17.294  31.862  13.556
  281    HB2  SER  39           HB2      SER  39 -20.137  31.901  14.743
  282    HB3  SER  39           HB3      SER  39 -18.900  30.652  14.982
  283    HG   SER  39           HG       SER  39 -17.640  32.302  16.092
  284    HN1  NH2  40           H11      SER  39 -20.668  31.203  11.207
  285    HN2  NH2  40           H12      SER  39 -20.715  32.487  12.356
  286    H93  EVT 101           H93      XXX  40 -24.125  19.313  11.623
  287    H92  EVT 101           H92      XXX  40 -25.154  20.200  10.471
  288   H103  EVT 101          H103      XXX  40 -26.457  18.083  10.007
  289   H102  EVT 101          H102      XXX  40 -25.445  17.215  11.186
  290    H11  EVT 101           H11      XXX  40 -26.300  18.723  13.016
  291   H122  EVT 101          H122      XXX  40 -28.754  15.002  11.874
  292   H123  EVT 101          H123      XXX  40 -27.706  14.264  13.096
  293   H133  EVT 101          H133      XXX  40 -29.059  15.275  14.920
  294   H132  EVT 101          H132      XXX  40 -30.027  14.217  13.873
  295   H143  EVT 101          H143      XXX  40 -30.836  16.339  12.631
  296   H142  EVT 101          H142      XXX  40 -30.018  17.286  13.901
  297   H153  EVT 101          H153      XXX  40 -31.407  15.995  15.632
  298   H152  EVT 101          H152      XXX  40 -32.305  15.249  14.283
  299    H6   EVT 101           H6       XXX  40 -23.280  20.613   8.967
  300   H163  EVT 101          H163      XXX  40 -33.033  17.565  13.539
  301   H162  EVT 101          H162      XXX  40 -32.158  18.260  14.929
  302   H173  EVT 101          H173      XXX  40 -33.600  16.759  16.446
  303   H172  EVT 101          H172      XXX  40 -34.579  16.354  15.011
  304   H183  EVT 101          H183      XXX  40 -35.012  18.849  14.687
  305   H182  EVT 101          H182      XXX  40 -34.146  19.147  16.214
  306   H193  EVT 101          H193      XXX  40 -36.732  17.500  15.902
  307   H192  EVT 101          H192      XXX  40 -36.620  19.169  16.505
  308   H203  EVT 101          H203      XXX  40 -35.175  18.342  18.435
  309   H202  EVT 101          H202      XXX  40 -35.464  16.667  17.880
  310   H213  EVT 101          H213      XXX  40 -37.955  17.056  18.121
  311   H212  EVT 101          H212      XXX  40 -37.613  18.669  18.803
  312   H223  EVT 101          H223      XXX  40 -36.349  17.597  20.700
  313   H222  EVT 101          H222      XXX  40 -36.646  15.993  19.970
  314    H25  EVT 101           H25      XXX  40 -28.633  17.474  11.658
  315   H293  EVT 101          H293      XXX  40 -39.114  16.320  20.227
  316   H292  EVT 101          H292      XXX  40 -38.832  17.940  20.907
  317   H303  EVT 101          H303      XXX  40 -39.363  16.334  22.686
  318   H302  EVT 101          H302      XXX  40 -37.698  16.927  22.895
  319   H313  EVT 101          H313      XXX  40 -36.760  14.814  22.035
  320   H312  EVT 101          H312      XXX  40 -38.369  14.247  21.522
  321   H321  EVT 101          H321      XXX  40 -37.582  14.806  24.453
  322   H323  EVT 101          H323      XXX  40 -37.612  13.189  23.693
  323   H322  EVT 101          H322      XXX  40 -39.126  14.110  23.877
  324   H353  EVT 101          H353      XXX  40 -20.475  19.067   5.723
  325   H352  EVT 101          H352      XXX  40 -22.039  19.081   4.888
  326   H363  EVT 101          H363      XXX  40 -22.895  20.840   6.410
  327   H362  EVT 101          H362      XXX  40 -21.315  20.981   7.208
  328    H37  EVT 101           H37      XXX  40 -22.973  18.414   7.117
  Start of MODEL    8
    1    H1   HIS   1           H1       HIS   1 -10.625   8.229   9.409
    2    H2   HIS   1           H2       HIS   1 -10.165   6.769  10.196
    3    H3   HIS   1           H3       HIS   1  -9.383   7.229   8.699
    4    HA   HIS   1           HA       HIS   1 -11.012   5.462   8.231
    5    HB2  HIS   1           HB2      HIS   1 -13.036   7.456   9.431
    6    HB3  HIS   1           HB3      HIS   1 -13.489   5.948   8.620
    7    HD1  HIS   1           HD1      HIS   1 -14.020   6.830  11.611
    8    HD2  HIS   1           HD2      HIS   1 -11.168   4.058  10.235
    9    HE1  HIS   1           HE1      HIS   1 -13.545   5.278  13.558
   10    H    AIB   2           H        AIB   2 -12.597   5.567   6.331
   11   HB11  AIB   2           H31      AIB   2 -14.602   6.195   4.770
   12   HB12  AIB   2           H32      AIB   2 -14.003   6.866   3.230
   13   HB13  AIB   2           H33      AIB   2 -13.317   5.346   3.865
   14   HB21  AIB   2           H21      AIB   2 -10.943   6.216   3.884
   15   HB22  AIB   2           H22      AIB   2 -11.570   7.672   3.059
   16   HB23  AIB   2           H23      AIB   2 -10.579   7.837   4.533
   17    H    GLN   3           H        GLN   3 -14.523   7.844   6.607
   18    HA   GLN   3           HA       GLN   3 -15.230  10.309   5.440
   19    HB2  GLN   3           H42      GLN   3 -16.659   9.224   7.143
   20    HB3  GLN   3           H43      GLN   3 -15.438   9.550   8.402
   21    HG2  GLN   3           H32      GLN   3 -15.699  12.024   8.022
   22    HG3  GLN   3           H33      GLN   3 -16.915  11.703   6.764
   23   HE21  GLN   3           H61      GLN   3 -18.797  12.527   9.819
   24   HE22  GLN   3           H62      GLN   3 -17.810  13.346   8.674
   25    H    GLY   4           H        GLY   4 -12.983   9.599   8.273
   26    HA2  GLY   4           HA2      GLY   4 -12.212  12.070   9.022
   27    HA3  GLY   4           HA3      GLY   4 -11.012  10.774   8.803
   28    H    THR   5           H        THR   5 -10.915  10.364   6.091
   29    HA   THR   5           HA       THR   5  -9.320  12.630   5.337
   30    HB   THR   5           HB       THR   5 -10.226  10.263   3.618
   31    HG1  THR   5           HG1      THR   5  -7.910  10.578   5.264
   32   HG21  THR   5          HG21      THR   5  -9.301  12.153   2.231
   33   HG22  THR   5          HG22      THR   5  -7.889  12.265   3.320
   34   HG23  THR   5          HG23      THR   5  -8.135  10.808   2.320
   35    H    PHE   6           H        PHE   6 -12.619  11.407   4.176
   36    HA   PHE   6           HA       PHE   6 -12.834  13.462   2.205
   37    HB2  PHE   6           HB2      PHE   6 -15.069  11.959   3.665
   38    HB3  PHE   6           HB3      PHE   6 -15.325  13.160   2.390
   39    HD1  PHE   6           HD1      PHE   6 -14.051  12.795   0.113
   40    HD2  PHE   6           HD2      PHE   6 -14.749   9.661   2.972
   41    HE1  PHE   6           HE1      PHE   6 -14.002  11.127  -1.703
   42    HE2  PHE   6           HE2      PHE   6 -14.637   7.991   1.159
   43    HZ   PHE   6           HZ       PHE   6 -14.300   8.717  -1.185
   44    H    THR   7           H        THR   7 -14.276  13.418   5.606
   45    HA   THR   7           HA       THR   7 -15.285  15.999   5.310
   46    HB   THR   7           HB       THR   7 -15.943  14.459   7.200
   47    HG1  THR   7           HG1      THR   7 -16.389  16.767   7.385
   48   HG21  THR   7          HG21      THR   7 -14.589  14.357   9.251
   49   HG22  THR   7          HG22      THR   7 -13.581  13.748   7.929
   50   HG23  THR   7          HG23      THR   7 -13.318  15.386   8.556
   51    H    SER   8           H        SER   8 -11.902  14.994   6.191
   52    HA   SER   8           HA       SER   8 -11.193  17.547   7.232
   53    HB2  SER   8           HB2      SER   8  -8.874  17.082   6.769
   54    HB3  SER   8           HB3      SER   8  -9.628  15.586   7.365
   55    HG   SER   8           HG       SER   8  -9.723  14.963   5.069
   56    H    ASP   9           H        ASP   9 -11.461  16.304   3.824
   57    HA   ASP   9           HA       ASP   9 -10.409  18.717   2.668
   58    HB2  ASP   9           HB2      ASP   9 -10.638  16.517   1.470
   59    HB3  ASP   9           HB3      ASP   9 -12.390  16.786   1.387
   60    H    LEU  10           H        LEU  10 -13.823  17.647   3.558
   61    HA   LEU  10           HA       LEU  10 -15.091  19.957   2.563
   62    HB2  LEU  10           HB2      LEU  10 -15.736  18.436   5.150
   63    HB3  LEU  10           HB3      LEU  10 -16.760  19.726   4.525
   64    HG   LEU  10           HG       LEU  10 -16.209  17.116   3.012
   65   HD11  LEU  10          HD11      LEU  10 -17.584  16.816   5.162
   66   HD12  LEU  10          HD12      LEU  10 -18.746  17.997   4.512
   67   HD13  LEU  10          HD13      LEU  10 -18.492  16.444   3.687
   68   HD21  LEU  10          HD21      LEU  10 -18.254  17.887   1.653
   69   HD22  LEU  10          HD22      LEU  10 -18.164  19.460   2.464
   70   HD23  LEU  10          HD23      LEU  10 -16.852  18.942   1.393
   71    H    SER  11           H        SER  11 -13.524  19.514   5.867
   72    HA   SER  11           HA       SER  11 -14.151  22.211   6.604
   73    HB2  SER  11           HB2      SER  11 -12.314  21.956   8.316
   74    HB3  SER  11           HB3      SER  11 -13.520  20.638   8.357
   75    HG   SER  11           HG       SER  11 -11.315  19.790   8.347
   76    H    LYS  12           H        LYS  12 -11.370  20.745   4.782
   77    HA   LYS  12           HA       LYS  12  -9.746  23.082   4.911
   78    HB2  LYS  12           HB2      LYS  12  -9.393  20.588   3.752
   79    HB3  LYS  12           HB3      LYS  12  -9.776  21.515   2.292
   80    HG2  LYS  12           HG2      LYS  12  -7.548  22.077   4.376
   81    HG3  LYS  12           HG3      LYS  12  -7.329  21.132   2.885
   82    HD2  LYS  12           HD2      LYS  12  -7.924  23.139   1.499
   83    HD3  LYS  12           HD3      LYS  12  -8.106  24.089   2.998
   84    HE2  LYS  12           HE2      LYS  12  -5.682  23.557   3.579
   85    HE3  LYS  12           HE3      LYS  12  -5.526  22.757   2.005
   86    HZ1  LYS  12           HZ1      LYS  12  -4.701  25.103   1.968
   87    HZ2  LYS  12           HZ2      LYS  12  -6.051  24.915   0.903
   88    HZ3  LYS  12           HZ3      LYS  12  -6.265  25.686   2.445
   89    H    GLN  13           H        GLN  13 -12.631  22.246   2.888
   90    HA   GLN  13           HA       GLN  13 -12.423  24.763   1.421
   91    HB2  GLN  13           HB2      GLN  13 -14.858  22.908   1.683
   92    HB3  GLN  13           HB3      GLN  13 -14.640  24.273   0.563
   93    HG2  GLN  13           HG2      GLN  13 -12.491  22.990  -0.277
   94    HG3  GLN  13           HG3      GLN  13 -13.173  21.573   0.549
   95   HE21  GLN  13          HE21      GLN  13 -15.986  21.240  -1.697
   96   HE22  GLN  13          HE22      GLN  13 -15.552  20.985  -0.048
   97    H    LYS  14           H        LYS  14 -14.316  23.638   4.387
   98    HA   LYS  14           HA       LYS  14 -15.803  26.093   4.480
   99    HB2  LYS  14           HB2      LYS  14 -15.006  24.478   6.944
  100    HB3  LYS  14           HB3      LYS  14 -16.212  25.770   6.842
  101    HG2  LYS  14           HG2      LYS  14 -17.604  24.297   5.303
  102    HG3  LYS  14           HG3      LYS  14 -16.361  23.033   5.454
  103    HD2  LYS  14           HD2      LYS  14 -16.653  23.068   7.956
  104    HD3  LYS  14           HD3      LYS  14 -18.029  24.179   7.766
  105    HE2  LYS  14           HE2      LYS  14 -19.408  22.525   6.754
  106    HE3  LYS  14           HE3      LYS  14 -18.029  21.505   6.310
  107    HZ1  LYS  14           HZ1      LYS  14 -17.644  21.003   8.686
  108    H    ASP  15           H        ASP  15 -12.842  25.056   6.437
  109    HA   ASP  15           HA       ASP  15 -11.950  27.326   7.492
  110    HB2  ASP  15           H32      ASP  15 -10.300  25.425   5.720
  111    HB3  ASP  15           H33      ASP  15  -9.574  26.596   6.829
  112    H    GLU  16           H        GLU  16 -11.687  26.547   3.915
  113    HA   GLU  16           HA       GLU  16 -10.092  28.788   3.326
  114    HB2  GLU  16           HB2      GLU  16 -10.596  26.843   1.738
  115    HB3  GLU  16           HB3      GLU  16 -12.173  27.569   1.399
  116    HG2  GLU  16           HG2      GLU  16 -10.979  29.682   0.622
  117    HG3  GLU  16           HG3      GLU  16  -9.434  28.850   0.932
  118    H    GLN  17           H        GLN  17 -13.700  28.360   3.081
  119    HA   GLN  17           HA       GLN  17 -14.186  31.093   2.357
  120    HB2  GLN  17           H42      GLN  17 -15.849  29.312   1.936
  121    HB3  GLN  17           H43      GLN  17 -15.950  28.959   3.672
  122    HG2  GLN  17           H32      GLN  17 -17.923  30.196   3.071
  123    HG3  GLN  17           H33      GLN  17 -16.932  31.293   4.042
  124   HE21  GLN  17           H61      GLN  17 -16.223  33.493   1.237
  125   HE22  GLN  17           H62      GLN  17 -15.594  33.003   2.758
  126    H    ARG  18           H        ARG  18 -14.274  29.339   5.559
  127    HA   ARG  18           HA       ARG  18 -15.273  31.431   7.072
  128    HB2  ARG  18           H42      ARG  18 -13.111  29.444   7.957
  129    HB3  ARG  18           H43      ARG  18 -14.031  30.503   9.048
  130    HG2  ARG  18           H33      ARG  18 -16.179  29.354   8.397
  131    HG3  ARG  18           H32      ARG  18 -15.264  28.239   7.358
  132    HD2  ARG  18           H52      ARG  18 -13.911  27.495   9.240
  133    HD3  ARG  18           H53      ARG  18 -14.867  28.539  10.372
  134    HE   ARG  18           H10      ARG  18 -16.659  26.848   8.947
  135   HH11  ARG  18           H71      ARG  18 -17.422  24.957   9.892
  136   HH12  ARG  18           H72      ARG  18 -16.607  24.238  11.227
  137   HH21  ARG  18           H81      ARG  18 -14.061  26.625  11.388
  138   HH22  ARG  18           H82      ARG  18 -14.719  25.153  12.075
  139    H    ALA  19           H        ALA  19 -11.791  30.756   6.193
  140    HA   ALA  19           HA       ALA  19 -10.767  32.903   7.770
  141    HB1  ALA  19           H21      ALA  19  -9.602  31.709   5.181
  142    HB2  ALA  19           H22      ALA  19  -8.727  32.764   6.332
  143    HB3  ALA  19           H23      ALA  19  -9.276  31.148   6.849
  144    H    LYS  20           H        LYS  20 -11.815  32.692   4.272
  145    HA   LYS  20           HA       LYS  20 -11.049  35.372   3.689
  146    HB2  LYS  20           H42      LYS  20 -13.188  33.572   2.444
  147    HB3  LYS  20           H43      LYS  20 -12.765  35.193   1.815
  148    HG2  LYS  20           H23      LYS  20 -10.511  34.565   1.265
  149    HG3  LYS  20           H22      LYS  20 -10.555  33.118   2.280
  150    HD2  LYS  20           H33      LYS  20 -10.620  32.514  -0.102
  151    HD3  LYS  20           H32      LYS  20 -12.109  31.973   0.743
  152    HE2  LYS  20           H53      LYS  20 -13.389  33.862  -0.197
  153    HE3  LYS  20           H52      LYS  20 -11.895  34.597  -0.877
  154    HZ1  LYS  20           H71      LYS  20 -13.300  33.340  -2.536
  155    HZ2  LYS  20           H72      LYS  20 -11.668  32.727  -2.411
  156    HZ3  LYS  20           H73      LYS  20 -12.987  31.872  -1.649
  157    H    LEU  21           H        LEU  21 -14.052  34.087   5.267
  158    HA   LEU  21           HA       LEU  21 -15.374  36.654   5.178
  159    HB2  LEU  21           HB2      LEU  21 -15.675  34.440   7.299
  160    HB3  LEU  21           HB3      LEU  21 -16.785  35.804   7.094
  161    HG   LEU  21           HG       LEU  21 -16.337  33.600   4.980
  162   HD11  LEU  21          HD11      LEU  21 -18.506  32.665   5.701
  163   HD12  LEU  21          HD12      LEU  21 -17.357  32.655   7.053
  164   HD13  LEU  21          HD13      LEU  21 -18.623  33.907   6.983
  165   HD21  LEU  21          HD21      LEU  21 -18.426  34.503   3.954
  166   HD22  LEU  21          HD22      LEU  21 -18.466  35.812   5.172
  167   HD23  LEU  21          HD23      LEU  21 -17.159  35.740   3.965
  168    H    PHE  22           H        PHE  22 -13.225  34.938   7.562
  169    HA   PHE  22           HA       PHE  22 -13.379  36.952   9.550
  170    HB2  PHE  22           HB2      PHE  22 -12.404  34.584   9.769
  171    HB3  PHE  22           HB3      PHE  22 -10.927  35.177   8.994
  172    HD1  PHE  22           HD1      PHE  22 -13.304  35.633  11.854
  173    HD2  PHE  22           HD2      PHE  22  -9.374  36.557  10.387
  174    HE1  PHE  22           HE1      PHE  22 -12.697  36.557  14.067
  175    HE2  PHE  22           HE2      PHE  22  -8.677  37.148  12.704
  176    HZ   PHE  22           HZ       PHE  22 -10.345  37.227  14.518
  177    H    ILE  23           H        ILE  23 -11.237  36.624   6.656
  178    HA   ILE  23           HA       ILE  23  -9.612  38.907   7.387
  179    HB   ILE  23           HB       ILE  23  -9.904  37.213   4.888
  180   HG12  ILE  23          HG12      ILE  23  -7.418  37.162   5.034
  181   HG13  ILE  23          HG13      ILE  23  -7.452  38.351   6.363
  182   HG21  ILE  23          HG21      ILE  23  -8.771  40.059   4.783
  183   HG22  ILE  23          HG22      ILE  23  -8.488  38.815   3.542
  184   HG23  ILE  23          HG23      ILE  23 -10.142  39.386   3.861
  185   HD11  ILE  23          HD11      ILE  23  -8.573  35.492   6.431
  186   HD12  ILE  23          HD12      ILE  23  -7.063  36.059   7.201
  187   HD13  ILE  23          HD13      ILE  23  -8.637  36.651   7.801
  188    H    GLU  24           H        GLU  24 -12.540  38.614   5.280
  189    HA   GLU  24           HA       GLU  24 -12.611  41.350   4.623
  190    HB2  GLU  24           HB2      GLU  24 -14.866  39.291   5.031
  191    HB3  GLU  24           HB3      GLU  24 -15.229  40.969   4.560
  192    HG2  GLU  24           HG2      GLU  24 -14.060  40.779   2.471
  193    HG3  GLU  24           HG3      GLU  24 -13.174  39.322   2.990
  194    H    TRP  25           H        TRP  25 -13.769  39.589   7.603
  195    HA   TRP  25           HA       TRP  25 -15.007  41.925   8.774
  196    HB2  TRP  25           HB2      TRP  25 -15.577  39.671   9.466
  197    HB3  TRP  25           HB3      TRP  25 -13.914  39.350   9.990
  198    HD1  TRP  25           HD1      TRP  25 -16.830  41.673  11.032
  199    HE1  TRP  25           HE1      TRP  25 -16.626  42.106  13.517
  200    HE3  TRP  25           HE3      TRP  25 -12.316  39.326  11.945
  201    HZ2  TRP  25           HZ2      TRP  25 -14.934  41.617  15.574
  202    HZ3  TRP  25           HZ3      TRP  25 -11.457  39.423  14.279
  203    HH2  TRP  25           HH2      TRP  25 -12.768  40.479  16.081
  204    H    LEU  26           H        LEU  26 -11.653  40.488   9.108
  205    HA   LEU  26           HA       LEU  26 -10.793  42.391  11.073
  206    HB2  LEU  26           HB2      LEU  26  -9.236  40.941   8.877
  207    HB3  LEU  26           HB3      LEU  26  -8.462  41.996  10.096
  208    HG   LEU  26           HG       LEU  26 -10.028  39.422  10.761
  209   HD11  LEU  26          HD11      LEU  26  -7.018  39.968  10.342
  210   HD12  LEU  26          HD12      LEU  26  -7.637  38.492  11.114
  211   HD13  LEU  26          HD13      LEU  26  -8.057  38.838   9.419
  212   HD21  LEU  26          HD21      LEU  26  -8.132  41.134  12.475
  213   HD22  LEU  26          HD22      LEU  26  -9.913  41.037  12.677
  214   HD23  LEU  26          HD23      LEU  26  -8.911  39.605  12.970
  215    H    AIB  27           H        ALA  27 -10.785  42.407   7.432
  216   HB11  AIB  27           H21      ALA  27  -8.221  44.200   6.834
  217   HB12  AIB  27           H22      ALA  27  -8.744  45.846   6.403
  218   HB13  AIB  27           H23      ALA  27  -8.682  45.361   8.103
  219   HB21  AIB  27           H31      ALA  27 -10.510  44.919   4.823
  220   HB22  AIB  27           H32      ALA  27  -9.921  43.278   5.207
  221   HB23  AIB  27           H33      ALA  27 -11.654  43.672   5.386
  222    H    ALA  28           H        ALA  28 -12.876  44.121   7.660
  223    HA   ALA  28           HA       ALA  28 -13.758  46.832   7.279
  224    HB1  ALA  28           H21      ALA  28 -14.991  44.606   9.007
  225    HB2  ALA  28           H22      ALA  28 -15.823  46.082   8.428
  226    HB3  ALA  28           H23      ALA  28 -15.294  44.833   7.262
  227    H    GLY  29           H        GLY  29 -11.728  45.591   9.856
  228    HA2  GLY  29           HA2      GLY  29 -11.228  47.569  11.423
  229    HA3  GLY  29           HA3      GLY  29 -12.943  47.466  11.833
  230    H    GLY  30           H        GLY  30 -12.802  44.268  11.464
  231    HA2  GLY  30           HA2      GLY  30 -12.414  42.531  12.966
  232    HA3  GLY  30           HA3      GLY  30 -11.020  43.462  13.542
  233    HA   PRO  31           HA       PRO  31 -14.183  43.713  16.995
  234    HB2  PRO  31           HB2      PRO  31 -11.675  45.131  18.104
  235    HB3  PRO  31           HB3      PRO  31 -12.826  44.101  18.995
  236    HG2  PRO  31           HG2      PRO  31 -10.488  42.971  18.161
  237    HG3  PRO  31           HG3      PRO  31 -12.014  42.104  17.801
  238    HD2  PRO  31           HD2      PRO  31 -10.431  43.946  15.905
  239    HD3  PRO  31           HD3      PRO  31 -11.051  42.278  15.583
  240    H    SER  32           H        SER  32 -12.107  46.316  15.463
  241    HA   SER  32           HA       SER  32 -13.612  48.473  16.631
  242    HB2  SER  32           HB2      SER  32 -11.876  48.462  14.101
  243    HB3  SER  32           HB3      SER  32 -12.386  49.894  15.041
  244    HG   SER  32           HG       SER  32 -10.239  49.090  15.699
  245    H    SER  33           H        SER  33 -14.255  46.341  13.788
  246    HA   SER  33           HA       SER  33 -15.547  48.227  12.167
  247    HB2  SER  33           HB2      SER  33 -16.785  46.311  11.173
  248    HB3  SER  33           HB3      SER  33 -15.065  45.904  11.415
  249    HG   SER  33           HG       SER  33 -16.502  44.213  12.264
  250    H    GLY  34           H        GLY  34 -16.879  46.235  14.927
  251    HA2  GLY  34           HA2      GLY  34 -18.773  47.297  16.165
  252    HA3  GLY  34           HA3      GLY  34 -19.512  47.683  14.599
  253    H    ALA  35           H        ALA  35 -18.874  45.322  13.078
  254    HA   ALA  35           HA       ALA  35 -21.084  43.763  13.922
  255    HB1  ALA  35           HB1      ALA  35 -20.430  42.166  12.101
  256    HB2  ALA  35           HB2      ALA  35 -20.467  43.855  11.530
  257    HB3  ALA  35           HB3      ALA  35 -18.906  43.070  11.887
  258    HA   PRO  36           HA       PRO  36 -18.657  40.919  16.649
  259    HB2  PRO  36           HB2      PRO  36 -20.714  38.937  15.497
  260    HB3  PRO  36           HB3      PRO  36 -20.201  39.066  17.206
  261    HG2  PRO  36           HG2      PRO  36 -22.563  40.142  16.587
  262    HG3  PRO  36           HG3      PRO  36 -21.393  41.132  17.502
  263    HD2  PRO  36           HD2      PRO  36 -21.917  41.281  14.464
  264    HD3  PRO  36           HD3      PRO  36 -21.865  42.609  15.692
  265    HA   PRO  37           HA       PRO  37 -16.316  38.925  13.374
  266    HB2  PRO  37           HB2      PRO  37 -15.185  36.639  14.571
  267    HB3  PRO  37           HB3      PRO  37 -14.714  38.297  15.041
  268    HG2  PRO  37           HG2      PRO  37 -16.839  36.548  16.345
  269    HG3  PRO  37           HG3      PRO  37 -15.435  37.316  17.152
  270    HD2  PRO  37           HD2      PRO  37 -17.864  38.514  17.236
  271    HD3  PRO  37           HD3      PRO  37 -16.430  39.543  16.874
  272    HA   PRO  38           HA       PRO  38 -19.208  35.906  11.738
  273    HB2  PRO  38           HB2      PRO  38 -17.867  34.947   9.510
  274    HB3  PRO  38           HB3      PRO  38 -18.199  36.684   9.690
  275    HG2  PRO  38           HG2      PRO  38 -15.578  35.318  10.514
  276    HG3  PRO  38           HG3      PRO  38 -15.819  36.669   9.354
  277    HD2  PRO  38           HD2      PRO  38 -15.181  37.124  11.994
  278    HD3  PRO  38           HD3      PRO  38 -16.370  38.179  11.143
  279    H    SER  39           H        SER  39 -18.752  34.732  13.992
  280    HA   SER  39           HA       SER  39 -17.116  32.311  13.702
  281    HB2  SER  39           HB2      SER  39 -18.943  32.932  16.083
  282    HB3  SER  39           HB3      SER  39 -17.529  31.862  16.002
  283    HG   SER  39           HG       SER  39 -16.295  33.888  15.584
  284    HN1  NH2  40           H11      SER  39 -21.204  31.487  13.640
  285    HN2  NH2  40           H12      SER  39 -20.699  32.929  14.424
  286    H93  EVT 101           H93      XXX  40 -24.565  18.884  13.709
  287    H92  EVT 101           H92      XXX  40 -25.218  18.030  12.294
  288   H103  EVT 101          H103      XXX  40 -24.345  15.887  13.087
  289   H102  EVT 101          H102      XXX  40 -23.401  16.667  14.370
  290    H11  EVT 101           H11      XXX  40 -25.392  17.153  15.665
  291   H122  EVT 101          H122      XXX  40 -25.203  12.523  15.574
  292   H123  EVT 101          H123      XXX  40 -23.606  12.763  16.298
  293   H133  EVT 101          H133      XXX  40 -24.737  13.511  18.456
  294   H132  EVT 101          H132      XXX  40 -25.032  11.807  18.053
  295   H143  EVT 101          H143      XXX  40 -27.281  12.266  17.236
  296   H142  EVT 101          H142      XXX  40 -27.011  14.024  17.288
  297   H153  EVT 101          H153      XXX  40 -26.746  13.907  19.778
  298   H152  EVT 101          H152      XXX  40 -27.113  12.163  19.736
  299    H6   EVT 101           H6       XXX  40 -22.169  19.246  13.795
  300   H163  EVT 101          H163      XXX  40 -29.396  12.666  18.779
  301   H162  EVT 101          H162      XXX  40 -28.987  14.401  18.745
  302   H173  EVT 101          H173      XXX  40 -28.645  14.289  21.263
  303   H172  EVT 101          H172      XXX  40 -29.288  12.624  21.240
  304   H183  EVT 101          H183      XXX  40 -31.417  13.540  20.147
  305   H182  EVT 101          H182      XXX  40 -30.764  15.186  20.348
  306   H193  EVT 101          H193      XXX  40 -31.513  13.218  22.595
  307   H192  EVT 101          H192      XXX  40 -32.380  14.690  22.128
  308   H203  EVT 101          H203      XXX  40 -30.374  16.079  22.779
  309   H202  EVT 101          H202      XXX  40 -29.564  14.593  23.352
  310   H213  EVT 101          H213      XXX  40 -31.367  14.204  25.017
  311   H212  EVT 101          H212      XXX  40 -32.208  15.671  24.458
  312   H223  EVT 101          H223      XXX  40 -30.191  17.045  25.058
  313   H222  EVT 101          H222      XXX  40 -29.359  15.576  25.619
  314    H25  EVT 101           H25      XXX  40 -26.297  14.521  14.791
  315   H293  EVT 101          H293      XXX  40 -30.884  15.311  27.514
  316   H292  EVT 101          H292      XXX  40 -32.039  16.481  26.833
  317   H303  EVT 101          H303      XXX  40 -30.864  17.582  28.659
  318   H302  EVT 101          H302      XXX  40 -30.340  18.318  27.126
  319   H313  EVT 101          H313      XXX  40 -28.241  16.826  27.227
  320   H312  EVT 101          H312      XXX  40 -28.796  16.271  28.826
  321   H321  EVT 101          H321      XXX  40 -28.658  18.656  29.663
  322   H323  EVT 101          H323      XXX  40 -28.157  19.204  28.043
  323   H322  EVT 101          H322      XXX  40 -27.094  18.125  28.975
  324   H353  EVT 101          H353      XXX  40 -18.769  20.501  10.805
  325   H352  EVT 101          H352      XXX  40 -19.389  19.184   9.778
  326   H363  EVT 101          H363      XXX  40 -21.741  19.873  10.367
  327   H362  EVT 101          H362      XXX  40 -21.101  21.131  11.451
  328    H37  EVT 101           H37      XXX  40 -20.500  18.121  11.730
  Start of MODEL    9
    1    H1   HIS   1           H1       HIS   1 -10.959   6.444   5.230
    2    H2   HIS   1           H2       HIS   1 -10.491   7.529   3.959
    3    H3   HIS   1           H3       HIS   1 -11.668   8.020   5.126
    4    HA   HIS   1           HA       HIS   1 -12.040   5.785   3.109
    5    HB2  HIS   1           HB2      HIS   1 -14.118   7.219   4.860
    6    HB3  HIS   1           HB3      HIS   1 -14.424   5.821   3.813
    7    HD1  HIS   1           HD1      HIS   1 -14.808   6.225   6.977
    8    HD2  HIS   1           HD2      HIS   1 -11.900   3.938   4.978
    9    HE1  HIS   1           HE1      HIS   1 -14.056   4.483   8.632
   10    H    AIB   2           H        AIB   2 -13.908   6.490   1.471
   11   HB11  AIB   2           H31      AIB   2 -16.153   7.650   0.601
   12   HB12  AIB   2           H32      AIB   2 -15.758   8.821  -0.677
   13   HB13  AIB   2           H33      AIB   2 -15.078   7.176  -0.742
   14   HB21  AIB   2           H21      AIB   2 -12.649   7.994  -0.802
   15   HB22  AIB   2           H22      AIB   2 -13.348   9.635  -0.965
   16   HB23  AIB   2           H23      AIB   2 -12.141   9.292   0.300
   17    H    GLN   3           H        GLN   3 -15.574   8.480   2.911
   18    HA   GLN   3           HA       GLN   3 -16.268  11.237   2.952
   19    HB2  GLN   3           H42      GLN   3 -17.494   9.564   4.262
   20    HB3  GLN   3           H43      GLN   3 -16.086   9.274   5.312
   21    HG2  GLN   3           H32      GLN   3 -16.138  11.637   6.119
   22    HG3  GLN   3           H33      GLN   3 -17.502  12.004   5.042
   23   HE21  GLN   3           H61      GLN   3 -19.879   9.968   6.933
   24   HE22  GLN   3           H62      GLN   3 -19.514  10.405   5.312
   25    H    GLY   4           H        GLY   4 -13.679   9.532   5.002
   26    HA2  GLY   4           HA2      GLY   4 -12.733  11.695   6.297
   27    HA3  GLY   4           HA3      GLY   4 -11.625  10.459   5.680
   28    H    THR   5           H        THR   5 -11.398  10.766   3.019
   29    HA   THR   5           HA       THR   5  -9.822  13.112   2.760
   30    HB   THR   5           HB       THR   5 -11.154  11.468   0.532
   31    HG1  THR   5           HG1      THR   5  -8.570  11.188   1.739
   32   HG21  THR   5          HG21      THR   5 -10.329  13.606  -0.405
   33   HG22  THR   5          HG22      THR   5  -8.747  13.383   0.398
   34   HG23  THR   5          HG23      THR   5  -9.258  12.270  -0.893
   35    H    PHE   6           H        PHE   6 -13.255  12.414   1.720
   36    HA   PHE   6           HA       PHE   6 -13.406  14.942   0.290
   37    HB2  PHE   6           HB2      PHE   6 -15.683  13.088   1.177
   38    HB3  PHE   6           HB3      PHE   6 -15.794  14.461   0.053
   39    HD1  PHE   6           HD1      PHE   6 -16.761  11.727  -0.559
   40    HD2  PHE   6           HD2      PHE   6 -12.807  13.299  -1.192
   41    HE1  PHE   6           HE1      PHE   6 -16.547  10.377  -2.607
   42    HE2  PHE   6           HE2      PHE   6 -12.614  11.951  -3.233
   43    HZ   PHE   6           HZ       PHE   6 -14.511  10.553  -4.004
   44    H    THR   7           H        THR   7 -14.952  13.897   3.487
   45    HA   THR   7           HA       THR   7 -15.897  16.498   3.908
   46    HB   THR   7           HB       THR   7 -16.650  14.435   5.237
   47    HG1  THR   7           HG1      THR   7 -17.238  16.603   5.951
   48   HG21  THR   7          HG21      THR   7 -14.196  15.116   6.952
   49   HG22  THR   7          HG22      THR   7 -15.431  13.888   7.312
   50   HG23  THR   7          HG23      THR   7 -14.323  13.656   5.933
   51    H    SER   8           H        SER   8 -12.568  15.122   4.409
   52    HA   SER   8           HA       SER   8 -11.759  17.300   6.081
   53    HB2  SER   8           HB2      SER   8  -9.413  16.842   5.385
   54    HB3  SER   8           HB3      SER   8 -10.258  15.430   6.046
   55    HG   SER   8           HG       SER   8  -9.819  15.845   3.258
   56    H    ASP   9           H        ASP   9 -11.888  16.837   2.460
   57    HA   ASP   9           HA       ASP   9 -10.801  19.474   1.920
   58    HB2  ASP   9           HB2      ASP   9 -10.800  17.870   0.110
   59    HB3  ASP   9           HB3      ASP   9 -12.531  17.542   0.277
   60    H    LEU  10           H        LEU  10 -14.176  18.285   2.707
   61    HA   LEU  10           HA       LEU  10 -15.302  20.853   2.155
   62    HB2  LEU  10           HB2      LEU  10 -16.251  18.865   4.257
   63    HB3  LEU  10           HB3      LEU  10 -17.154  20.289   3.723
   64    HG   LEU  10           HG       LEU  10 -16.481  17.934   1.896
   65   HD11  LEU  10          HD11      LEU  10 -18.208  17.391   3.679
   66   HD12  LEU  10          HD12      LEU  10 -19.178  18.785   3.147
   67   HD13  LEU  10          HD13      LEU  10 -18.910  17.415   2.048
   68   HD21  LEU  10          HD21      LEU  10 -18.114  19.006   0.332
   69   HD22  LEU  10          HD22      LEU  10 -18.203  20.426   1.410
   70   HD23  LEU  10          HD23      LEU  10 -16.690  20.022   0.552
   71    H    SER  11           H        SER  11 -13.557  19.565   5.092
   72    HA   SER  11           HA       SER  11 -14.250  21.867   6.644
   73    HB2  SER  11           HB2      SER  11 -12.517  21.345   8.193
   74    HB3  SER  11           HB3      SER  11 -13.248  19.795   7.723
   75    HG   SER  11           HG       SER  11 -11.319  19.591   6.314
   76    H    LYS  12           H        LYS  12 -11.425  21.070   4.414
   77    HA   LYS  12           HA       LYS  12  -9.996  23.478   4.995
   78    HB2  LYS  12           HB2      LYS  12  -9.100  21.477   3.854
   79    HB3  LYS  12           HB3      LYS  12 -10.097  21.768   2.428
   80    HG2  LYS  12           HG2      LYS  12  -7.968  23.664   3.576
   81    HG3  LYS  12           HG3      LYS  12  -7.661  22.482   2.283
   82    HD2  LYS  12           HD2      LYS  12  -9.508  24.922   2.021
   83    HD3  LYS  12           HD3      LYS  12  -7.870  24.766   1.379
   84    HE2  LYS  12           HE2      LYS  12  -8.574  22.968  -0.151
   85    HE3  LYS  12           HE3      LYS  12 -10.224  22.995   0.519
   86    HZ1  LYS  12           HZ1      LYS  12 -10.439  25.372  -0.188
   87    HZ2  LYS  12           HZ2      LYS  12  -8.899  25.258  -0.976
   88    HZ3  LYS  12           HZ3      LYS  12 -10.241  24.278  -1.509
   89    H    GLN  13           H        GLN  13 -12.487  22.698   2.451
   90    HA   GLN  13           HA       GLN  13 -12.491  25.329   1.373
   91    HB2  GLN  13           HB2      GLN  13 -14.616  23.132   1.445
   92    HB3  GLN  13           HB3      GLN  13 -14.920  24.684   0.648
   93    HG2  GLN  13           HG2      GLN  13 -13.043  24.398  -0.903
   94    HG3  GLN  13           HG3      GLN  13 -12.513  22.928  -0.069
   95   HE21  GLN  13          HE21      GLN  13 -15.112  20.799  -1.322
   96   HE22  GLN  13          HE22      GLN  13 -14.083  21.042   0.033
   97    H    LYS  14           H        LYS  14 -14.500  23.931   4.110
   98    HA   LYS  14           HA       LYS  14 -15.939  26.410   4.468
   99    HB2  LYS  14           HB2      LYS  14 -15.437  24.029   6.310
  100    HB3  LYS  14           HB3      LYS  14 -16.057  25.544   6.993
  101    HG2  LYS  14           HG2      LYS  14 -17.986  25.585   5.609
  102    HG3  LYS  14           HG3      LYS  14 -17.442  24.249   4.587
  103    HD2  LYS  14           HD2      LYS  14 -17.997  23.883   7.586
  104    HD3  LYS  14           HD3      LYS  14 -19.271  23.739   6.349
  105    HE2  LYS  14           HE2      LYS  14 -18.061  21.885   5.245
  106    HE3  LYS  14           HE3      LYS  14 -16.751  21.998   6.427
  107    HZ1  LYS  14           HZ1      LYS  14 -18.138  21.015   8.052
  108    H    ASP  15           H        ASP  15 -13.111  25.103   6.419
  109    HA   ASP  15           HA       ASP  15 -12.467  27.400   7.749
  110    HB2  ASP  15           H32      ASP  15 -10.609  25.352   6.446
  111    HB3  ASP  15           H33      ASP  15 -10.009  26.622   7.523
  112    H    GLU  16           H        GLU  16 -11.823  26.820   4.208
  113    HA   GLU  16           HA       GLU  16 -10.128  29.140   3.990
  114    HB2  GLU  16           HB2      GLU  16 -10.085  27.335   2.279
  115    HB3  GLU  16           HB3      GLU  16 -11.741  27.729   1.788
  116    HG2  GLU  16           HG2      GLU  16 -10.938  30.090   1.213
  117    HG3  GLU  16           HG3      GLU  16  -9.275  29.540   1.567
  118    H    GLN  17           H        GLN  17 -13.616  28.574   2.987
  119    HA   GLN  17           HA       GLN  17 -14.208  31.270   2.379
  120    HB2  GLN  17           H42      GLN  17 -15.707  29.267   1.931
  121    HB3  GLN  17           H43      GLN  17 -16.034  29.156   3.675
  122    HG2  GLN  17           H32      GLN  17 -17.899  30.292   2.554
  123    HG3  GLN  17           H33      GLN  17 -17.068  31.479   3.581
  124   HE21  GLN  17           H61      GLN  17 -16.125  33.525   0.781
  125   HE22  GLN  17           H62      GLN  17 -16.032  33.326   2.488
  126    H    ARG  18           H        ARG  18 -14.319  29.531   5.543
  127    HA   ARG  18           HA       ARG  18 -15.474  31.694   6.989
  128    HB2  ARG  18           H42      ARG  18 -13.646  29.416   7.895
  129    HB3  ARG  18           H43      ARG  18 -14.451  30.521   9.012
  130    HG2  ARG  18           H33      ARG  18 -16.693  29.803   8.259
  131    HG3  ARG  18           H32      ARG  18 -16.002  28.734   7.021
  132    HD2  ARG  18           H52      ARG  18 -14.855  27.401   8.758
  133    HD3  ARG  18           H53      ARG  18 -15.604  28.436  10.030
  134    HE   ARG  18           H10      ARG  18 -17.683  27.438   8.361
  135   HH11  ARG  18           H71      ARG  18 -18.910  25.673   9.022
  136   HH12  ARG  18           H72      ARG  18 -18.308  24.561  10.194
  137   HH21  ARG  18           H81      ARG  18 -15.275  26.223  10.693
  138   HH22  ARG  18           H82      ARG  18 -16.262  24.841  11.129
  139    H    ALA  19           H        ALA  19 -11.994  30.793   6.307
  140    HA   ALA  19           HA       ALA  19 -10.978  32.976   7.867
  141    HB1  ALA  19           H21      ALA  19  -9.722  31.491   5.498
  142    HB2  ALA  19           H22      ALA  19  -8.869  32.711   6.479
  143    HB3  ALA  19           H23      ALA  19  -9.434  31.193   7.226
  144    H    LYS  20           H        LYS  20 -12.102  32.716   4.395
  145    HA   LYS  20           HA       LYS  20 -11.152  35.294   3.650
  146    HB2  LYS  20           H42      LYS  20 -13.712  33.981   2.597
  147    HB3  LYS  20           H43      LYS  20 -12.870  35.387   1.907
  148    HG2  LYS  20           H23      LYS  20 -10.830  33.855   1.514
  149    HG3  LYS  20           H22      LYS  20 -11.837  32.503   2.074
  150    HD2  LYS  20           H33      LYS  20 -12.016  32.299  -0.248
  151    HD3  LYS  20           H32      LYS  20 -13.532  33.086   0.239
  152    HE2  LYS  20           H53      LYS  20 -12.481  35.329  -0.448
  153    HE3  LYS  20           H52      LYS  20 -11.012  34.447  -0.926
  154    HZ1  LYS  20           H71      LYS  20 -12.442  34.912  -2.848
  155    HZ2  LYS  20           H72      LYS  20 -12.353  33.179  -2.567
  156    HZ3  LYS  20           H73      LYS  20 -13.785  34.076  -2.083
  157    H    LEU  21           H        LEU  21 -14.279  34.164   5.178
  158    HA   LEU  21           HA       LEU  21 -15.486  36.766   5.254
  159    HB2  LEU  21           HB2      LEU  21 -15.800  34.434   7.236
  160    HB3  LEU  21           HB3      LEU  21 -16.854  35.861   7.181
  161    HG   LEU  21           HG       LEU  21 -16.620  33.830   4.885
  162   HD11  LEU  21          HD11      LEU  21 -18.805  32.958   5.686
  163   HD12  LEU  21          HD12      LEU  21 -17.585  32.766   6.960
  164   HD13  LEU  21          HD13      LEU  21 -18.770  34.080   7.074
  165   HD21  LEU  21          HD21      LEU  21 -17.425  36.107   4.149
  166   HD22  LEU  21          HD22      LEU  21 -18.703  34.884   4.055
  167   HD23  LEU  21          HD23      LEU  21 -18.692  36.045   5.400
  168    H    PHE  22           H        PHE  22 -13.252  34.998   7.517
  169    HA   PHE  22           HA       PHE  22 -13.331  37.010   9.536
  170    HB2  PHE  22           HB2      PHE  22 -12.360  34.646   9.754
  171    HB3  PHE  22           HB3      PHE  22 -10.943  35.215   8.849
  172    HD1  PHE  22           HD1      PHE  22 -13.137  36.016  11.797
  173    HD2  PHE  22           HD2      PHE  22  -9.172  36.328  10.194
  174    HE1  PHE  22           HE1      PHE  22 -12.320  36.735  14.005
  175    HE2  PHE  22           HE2      PHE  22  -8.311  36.840  12.471
  176    HZ   PHE  22           HZ       PHE  22  -9.878  37.070  14.372
  177    H    ILE  23           H        ILE  23 -11.286  36.683   6.542
  178    HA   ILE  23           HA       ILE  23  -9.683  38.987   7.242
  179    HB   ILE  23           HB       ILE  23 -10.007  37.326   4.730
  180   HG12  ILE  23          HG12      ILE  23  -7.509  37.359   4.816
  181   HG13  ILE  23          HG13      ILE  23  -7.560  38.518   6.160
  182   HG21  ILE  23          HG21      ILE  23  -8.821  40.160   4.662
  183   HG22  ILE  23          HG22      ILE  23  -8.700  38.946   3.361
  184   HG23  ILE  23          HG23      ILE  23 -10.280  39.612   3.793
  185   HD11  ILE  23          HD11      ILE  23  -8.546  35.591   6.211
  186   HD12  ILE  23          HD12      ILE  23  -7.097  36.225   7.024
  187   HD13  ILE  23          HD13      ILE  23  -8.704  36.713   7.593
  188    H    GLU  24           H        GLU  24 -12.803  38.636   5.365
  189    HA   GLU  24           HA       GLU  24 -12.855  41.370   4.586
  190    HB2  GLU  24           HB2      GLU  24 -15.319  39.706   5.423
  191    HB3  GLU  24           HB3      GLU  24 -15.306  41.249   4.528
  192    HG2  GLU  24           HG2      GLU  24 -13.934  40.017   2.706
  193    HG3  GLU  24           HG3      GLU  24 -14.358  38.502   3.535
  194    H    TRP  25           H        TRP  25 -13.876  39.662   7.606
  195    HA   TRP  25           HA       TRP  25 -14.925  41.998   8.908
  196    HB2  TRP  25           HB2      TRP  25 -15.522  39.731   9.555
  197    HB3  TRP  25           HB3      TRP  25 -13.846  39.336   9.987
  198    HD1  TRP  25           HD1      TRP  25 -16.801  41.456  11.245
  199    HE1  TRP  25           HE1      TRP  25 -16.497  41.790  13.738
  200    HE3  TRP  25           HE3      TRP  25 -12.112  39.329  11.842
  201    HZ2  TRP  25           HZ2      TRP  25 -14.609  41.416  15.672
  202    HZ3  TRP  25           HZ3      TRP  25 -11.152  39.326  14.156
  203    HH2  TRP  25           HH2      TRP  25 -12.376  40.334  16.031
  204    H    LEU  26           H        LEU  26 -11.583  40.471   9.050
  205    HA   LEU  26           HA       LEU  26 -10.594  42.295  11.014
  206    HB2  LEU  26           HB2      LEU  26  -9.137  40.964   8.663
  207    HB3  LEU  26           HB3      LEU  26  -8.301  41.924   9.902
  208    HG   LEU  26           HG       LEU  26  -9.871  39.357  10.544
  209   HD11  LEU  26          HD11      LEU  26  -7.942  38.848   9.039
  210   HD12  LEU  26          HD12      LEU  26  -6.851  39.806  10.075
  211   HD13  LEU  26          HD13      LEU  26  -7.572  38.300  10.687
  212   HD21  LEU  26          HD21      LEU  26  -7.860  40.996  12.201
  213   HD22  LEU  26          HD22      LEU  26  -9.612  40.875  12.541
  214   HD23  LEU  26          HD23      LEU  26  -8.583  39.441  12.688
  215    H    AIB  27           H        ALA  27 -10.673  42.426   7.404
  216   HB11  AIB  27           H21      ALA  27  -8.540  45.796   6.459
  217   HB12  AIB  27           H22      ALA  27  -8.557  45.350   8.178
  218   HB13  AIB  27           H23      ALA  27  -8.047  44.155   6.964
  219   HB21  AIB  27           H31      ALA  27 -10.327  44.958   4.859
  220   HB22  AIB  27           H32      ALA  27  -9.739  43.307   5.204
  221   HB23  AIB  27           H33      ALA  27 -11.467  43.696   5.401
  222    H    ALA  28           H        ALA  28 -12.713  44.149   7.700
  223    HA   ALA  28           HA       ALA  28 -13.576  46.867   7.326
  224    HB1  ALA  28           H21      ALA  28 -14.837  44.619   9.002
  225    HB2  ALA  28           H22      ALA  28 -15.664  46.107   8.462
  226    HB3  ALA  28           H23      ALA  28 -15.125  44.897   7.264
  227    H    GLY  29           H        GLY  29 -11.526  45.669   9.901
  228    HA2  GLY  29           HA2      GLY  29 -11.179  47.588  11.575
  229    HA3  GLY  29           HA3      GLY  29 -12.909  47.365  11.938
  230    H    GLY  30           H        GLY  30 -12.684  44.269  11.431
  231    HA2  GLY  30           HA2      GLY  30 -12.291  42.460  12.833
  232    HA3  GLY  30           HA3      GLY  30 -10.876  43.361  13.414
  233    HA   PRO  31           HA       PRO  31 -13.881  43.424  17.019
  234    HB2  PRO  31           HB2      PRO  31 -11.396  44.980  17.981
  235    HB3  PRO  31           HB3      PRO  31 -12.445  43.897  18.936
  236    HG2  PRO  31           HG2      PRO  31 -10.122  42.838  17.988
  237    HG3  PRO  31           HG3      PRO  31 -11.640  41.960  17.664
  238    HD2  PRO  31           HD2      PRO  31 -10.204  43.908  15.750
  239    HD3  PRO  31           HD3      PRO  31 -10.744  42.215  15.434
  240    H    SER  32           H        SER  32 -12.118  46.200  15.402
  241    HA   SER  32           HA       SER  32 -13.818  48.181  16.657
  242    HB2  SER  32           HB2      SER  32 -12.037  48.426  14.171
  243    HB3  SER  32           HB3      SER  32 -12.760  49.771  15.100
  244    HG   SER  32           HG       SER  32 -10.550  49.280  15.819
  245    H    SER  33           H        SER  33 -14.308  46.048  13.812
  246    HA   SER  33           HA       SER  33 -15.609  47.829  12.126
  247    HB2  SER  33           HB2      SER  33 -16.866  45.885  11.194
  248    HB3  SER  33           HB3      SER  33 -15.144  45.495  11.451
  249    HG   SER  33           HG       SER  33 -16.632  43.849  12.357
  250    H    GLY  34           H        GLY  34 -16.983  46.010  14.959
  251    HA2  GLY  34           HA2      GLY  34 -18.911  46.882  16.144
  252    HA3  GLY  34           HA3      GLY  34 -19.563  47.542  14.637
  253    H    ALA  35           H        ALA  35 -18.997  45.251  12.854
  254    HA   ALA  35           HA       ALA  35 -21.302  43.662  13.540
  255    HB1  ALA  35           HB1      ALA  35 -20.734  42.320  11.545
  256    HB2  ALA  35           HB2      ALA  35 -20.678  44.066  11.186
  257    HB3  ALA  35           HB3      ALA  35 -19.160  43.150  11.407
  258    HA   PRO  36           HA       PRO  36 -18.755  40.918  16.264
  259    HB2  PRO  36           HB2      PRO  36 -20.879  38.949  15.178
  260    HB3  PRO  36           HB3      PRO  36 -20.244  38.992  16.844
  261    HG2  PRO  36           HG2      PRO  36 -22.626  40.144  16.389
  262    HG3  PRO  36           HG3      PRO  36 -21.392  41.099  17.263
  263    HD2  PRO  36           HD2      PRO  36 -22.145  41.340  14.293
  264    HD3  PRO  36           HD3      PRO  36 -21.879  42.629  15.522
  265    HA   PRO  37           HA       PRO  37 -16.370  38.815  13.088
  266    HB2  PRO  37           HB2      PRO  37 -15.194  36.626  14.430
  267    HB3  PRO  37           HB3      PRO  37 -14.736  38.321  14.755
  268    HG2  PRO  37           HG2      PRO  37 -16.810  36.656  16.235
  269    HG3  PRO  37           HG3      PRO  37 -15.408  37.503  16.950
  270    HD2  PRO  37           HD2      PRO  37 -17.881  38.674  16.977
  271    HD3  PRO  37           HD3      PRO  37 -16.472  39.702  16.525
  272    HA   PRO  38           HA       PRO  38 -19.188  35.605  11.625
  273    HB2  PRO  38           HB2      PRO  38 -17.657  34.298   9.746
  274    HB3  PRO  38           HB3      PRO  38 -18.009  36.041   9.582
  275    HG2  PRO  38           HG2      PRO  38 -15.494  34.873  10.916
  276    HG3  PRO  38           HG3      PRO  38 -15.538  35.905   9.456
  277    HD2  PRO  38           HD2      PRO  38 -15.219  37.008  11.946
  278    HD3  PRO  38           HD3      PRO  38 -16.374  37.793  10.821
  279    H    SER  39           H        SER  39 -18.993  34.792  14.048
  280    HA   SER  39           HA       SER  39 -17.973  32.017  14.050
  281    HB2  SER  39           HB2      SER  39 -16.773  34.156  15.918
  282    HB3  SER  39           HB3      SER  39 -16.487  32.398  15.995
  283    HG   SER  39           HG       SER  39 -15.655  34.086  13.834
  284    HN1  NH2  40           H11      SER  39 -21.079  32.163  15.907
  285    HN2  NH2  40           H12      SER  39 -20.502  32.054  14.287
  286    H93  EVT 101           H93      XXX  40 -25.894  17.438   6.168
  287    H92  EVT 101           H92      XXX  40 -24.792  16.244   5.448
  288   H103  EVT 101          H103      XXX  40 -25.395  14.611   7.281
  289   H102  EVT 101          H102      XXX  40 -26.511  15.817   7.964
  290    H11  EVT 101           H11      XXX  40 -27.892  15.766   5.893
  291   H122  EVT 101          H122      XXX  40 -30.031  12.303   7.392
  292   H123  EVT 101          H123      XXX  40 -28.680  12.114   8.529
  293   H133  EVT 101          H133      XXX  40 -29.879  13.602  10.187
  294   H132  EVT 101          H132      XXX  40 -30.738  12.097   9.802
  295   H143  EVT 101          H143      XXX  40 -32.187  13.383   8.152
  296   H142  EVT 101          H142      XXX  40 -31.457  14.893   8.740
  297   H153  EVT 101          H153      XXX  40 -32.223  14.289  11.099
  298   H152  EVT 101          H152      XXX  40 -33.010  12.836  10.437
  299    H6   EVT 101           H6       XXX  40 -24.710  18.983   7.480
  300   H163  EVT 101          H163      XXX  40 -34.424  14.317   8.953
  301   H162  EVT 101          H162      XXX  40 -33.689  15.753   9.713
  302   H173  EVT 101          H173      XXX  40 -34.569  15.020  11.946
  303   H172  EVT 101          H172      XXX  40 -35.300  13.584  11.188
  304   H183  EVT 101          H183      XXX  40 -36.714  15.016   9.730
  305   H182  EVT 101          H182      XXX  40 -36.040  16.489  10.464
  306   H193  EVT 101          H193      XXX  40 -37.486  14.343  12.119
  307   H192  EVT 101          H192      XXX  40 -38.366  15.667  11.323
  308   H203  EVT 101          H203      XXX  40 -37.112  17.367  12.594
  309   H202  EVT 101          H202      XXX  40 -36.120  16.121  13.380
  310   H213  EVT 101          H213      XXX  40 -38.106  15.138  14.484
  311   H212  EVT 101          H212      XXX  40 -39.181  16.286  13.642
  312   H223  EVT 101          H223      XXX  40 -38.041  18.194  14.825
  313   H222  EVT 101          H222      XXX  40 -36.979  17.028  15.660
  314    H25  EVT 101           H25      XXX  40 -27.595  12.892   6.411
  315   H293  EVT 101          H293      XXX  40 -38.974  16.006  16.794
  316   H292  EVT 101          H292      XXX  40 -40.054  17.048  15.854
  317   H303  EVT 101          H303      XXX  40 -39.861  17.926  18.110
  318   H302  EVT 101          H302      XXX  40 -39.124  19.083  16.969
  319   H313  EVT 101          H313      XXX  40 -36.842  18.353  17.664
  320   H312  EVT 101          H312      XXX  40 -37.541  17.059  18.667
  321   H321  EVT 101          H321      XXX  40 -37.977  20.093  19.105
  322   H323  EVT 101          H323      XXX  40 -36.882  19.059  20.063
  323   H322  EVT 101          H322      XXX  40 -38.642  18.799  20.134
  324   H353  EVT 101          H353      XXX  40 -20.799  20.781   8.845
  325   H352  EVT 101          H352      XXX  40 -20.024  19.285   8.275
  326   H363  EVT 101          H363      XXX  40 -21.781  18.966   6.566
  327   H362  EVT 101          H362      XXX  40 -22.588  20.478   7.063
  328    H37  EVT 101           H37      XXX  40 -22.224  17.997   8.854
  Start of MODEL   10
    1    H1   HIS   1           H1       HIS   1 -11.416   6.462   4.899
    2    H2   HIS   1           H2       HIS   1 -11.770   5.232   6.057
    3    H3   HIS   1           H3       HIS   1 -12.752   5.420   4.653
    4    HA   HIS   1           HA       HIS   1 -13.884   6.381   6.695
    5    HB2  HIS   1           HB2      HIS   1 -11.470   8.278   6.665
    6    HB3  HIS   1           HB3      HIS   1 -12.930   8.477   7.658
    7    HD1  HIS   1           HD1      HIS   1 -10.255   8.317   8.947
    8    HD2  HIS   1           HD2      HIS   1 -12.725   4.979   8.307
    9    HE1  HIS   1           HE1      HIS   1  -9.584   6.601  10.688
   10    H    AIB   2           H        AIB   2 -15.073   6.349   4.539
   11   HB11  AIB   2           H31      AIB   2 -17.444   7.177   3.789
   12   HB12  AIB   2           H32      AIB   2 -17.338   7.962   2.191
   13   HB13  AIB   2           H33      AIB   2 -16.531   6.395   2.481
   14   HB21  AIB   2           H21      AIB   2 -14.194   7.186   1.859
   15   HB22  AIB   2           H22      AIB   2 -15.056   8.651   1.299
   16   HB23  AIB   2           H23      AIB   2 -13.668   8.794   2.411
   17    H    GLN   3           H        GLN   3 -16.825   8.729   5.552
   18    HA   GLN   3           HA       GLN   3 -17.483  11.419   4.920
   19    HB2  GLN   3           H42      GLN   3 -18.610  10.299   6.728
   20    HB3  GLN   3           H43      GLN   3 -17.099  10.078   7.638
   21    HG2  GLN   3           H32      GLN   3 -16.886  12.522   8.007
   22    HG3  GLN   3           H33      GLN   3 -18.209  12.860   6.876
   23   HE21  GLN   3           H61      GLN   3 -19.241  11.208  10.547
   24   HE22  GLN   3           H62      GLN   3 -17.725  10.756   9.880
   25    H    GLY   4           H        GLY   4 -14.737  10.023   6.959
   26    HA2  GLY   4           HA2      GLY   4 -13.424  12.221   7.766
   27    HA3  GLY   4           HA3      GLY   4 -12.529  10.837   7.118
   28    H    THR   5           H        THR   5 -12.826  10.739   4.469
   29    HA   THR   5           HA       THR   5 -11.021  12.738   3.622
   30    HB   THR   5           HB       THR   5 -12.973  11.089   1.922
   31    HG1  THR   5           HG1      THR   5 -10.228  10.617   2.584
   32   HG21  THR   5          HG21      THR   5 -10.532  12.776   1.098
   33   HG22  THR   5          HG22      THR   5 -11.348  11.561   0.070
   34   HG23  THR   5          HG23      THR   5 -12.229  13.023   0.589
   35    H    PHE   6           H        PHE   6 -14.651  12.512   3.164
   36    HA   PHE   6           HA       PHE   6 -14.648  15.047   1.774
   37    HB2  PHE   6           HB2      PHE   6 -16.893  13.259   2.773
   38    HB3  PHE   6           HB3      PHE   6 -17.230  14.954   2.404
   39    HD1  PHE   6           HD1      PHE   6 -17.549  15.692   0.194
   40    HD2  PHE   6           HD2      PHE   6 -15.568  11.928   0.877
   41    HE1  PHE   6           HE1      PHE   6 -17.491  15.289  -2.231
   42    HE2  PHE   6           HE2      PHE   6 -15.541  11.521  -1.574
   43    HZ   PHE   6           HZ       PHE   6 -16.482  13.207  -3.124
   44    H    THR   7           H        THR   7 -16.188  14.344   5.097
   45    HA   THR   7           HA       THR   7 -16.653  16.939   5.652
   46    HB   THR   7           HB       THR   7 -17.195  15.044   7.191
   47    HG1  THR   7           HG1      THR   7 -17.112  16.509   9.008
   48   HG21  THR   7          HG21      THR   7 -15.607  14.428   8.948
   49   HG22  THR   7          HG22      THR   7 -14.821  14.110   7.382
   50   HG23  THR   7          HG23      THR   7 -14.379  15.557   8.328
   51    H    SER   8           H        SER   8 -13.327  15.457   5.832
   52    HA   SER   8           HA       SER   8 -12.214  17.786   7.102
   53    HB2  SER   8           HB2      SER   8 -10.028  16.955   6.600
   54    HB3  SER   8           HB3      SER   8 -11.050  15.627   7.203
   55    HG   SER   8           HG       SER   8 -11.216  14.959   4.922
   56    H    ASP   9           H        ASP   9 -12.417  16.711   3.586
   57    HA   ASP   9           HA       ASP   9 -11.074  19.117   2.653
   58    HB2  ASP   9           HB2      ASP   9 -11.150  17.028   1.294
   59    HB3  ASP   9           HB3      ASP   9 -12.923  17.160   1.175
   60    H    LEU  10           H        LEU  10 -14.553  18.169   3.131
   61    HA   LEU  10           HA       LEU  10 -15.636  20.533   1.945
   62    HB2  LEU  10           HB2      LEU  10 -16.691  18.875   4.300
   63    HB3  LEU  10           HB3      LEU  10 -17.621  20.125   3.459
   64    HG   LEU  10           HG       LEU  10 -16.586  17.563   2.069
   65   HD11  LEU  10          HD11      LEU  10 -18.211  16.926   3.826
   66   HD12  LEU  10          HD12      LEU  10 -19.352  18.155   3.231
   67   HD13  LEU  10          HD13      LEU  10 -18.967  16.734   2.229
   68   HD21  LEU  10          HD21      LEU  10 -18.278  18.175   0.306
   69   HD22  LEU  10          HD22      LEU  10 -18.672  19.654   1.218
   70   HD23  LEU  10          HD23      LEU  10 -17.065  19.452   0.474
   71    H    SER  11           H        SER  11 -14.337  19.781   5.286
   72    HA   SER  11           HA       SER  11 -15.014  22.415   6.237
   73    HB2  SER  11           HB2      SER  11 -13.346  22.037   8.052
   74    HB3  SER  11           HB3      SER  11 -14.616  20.807   7.967
   75    HG   SER  11           HG       SER  11 -12.007  20.417   6.889
   76    H    LYS  12           H        LYS  12 -12.075  21.004   4.498
   77    HA   LYS  12           HA       LYS  12 -10.473  23.318   4.849
   78    HB2  LYS  12           HB2      LYS  12  -9.775  21.124   3.836
   79    HB3  LYS  12           HB3      LYS  12 -10.667  21.504   2.356
   80    HG2  LYS  12           HG2      LYS  12  -8.330  23.126   3.517
   81    HG3  LYS  12           HG3      LYS  12  -8.205  21.877   2.253
   82    HD2  LYS  12           HD2      LYS  12  -9.566  24.614   1.963
   83    HD3  LYS  12           HD3      LYS  12  -8.065  24.043   1.224
   84    HE2  LYS  12           HE2      LYS  12  -9.417  22.272  -0.027
   85    HE3  LYS  12           HE3      LYS  12 -10.902  23.041   0.598
   86    HZ1  LYS  12           HZ1      LYS  12  -8.807  24.371  -1.136
   87    HZ2  LYS  12           HZ2      LYS  12 -10.401  23.873  -1.621
   88    HZ3  LYS  12           HZ3      LYS  12 -10.201  25.163  -0.456
   89    H    GLN  13           H        GLN  13 -13.090  22.554   2.379
   90    HA   GLN  13           HA       GLN  13 -12.755  25.098   1.111
   91    HB2  GLN  13           HB2      GLN  13 -15.266  23.322   1.196
   92    HB3  GLN  13           HB3      GLN  13 -15.043  24.767   0.182
   93    HG2  GLN  13           HG2      GLN  13 -12.942  23.602  -0.810
   94    HG3  GLN  13           HG3      GLN  13 -13.545  22.107  -0.058
   95   HE21  GLN  13          HE21      GLN  13 -16.503  21.961  -2.212
   96   HE22  GLN  13          HE22      GLN  13 -15.976  21.560  -0.622
   97    H    LYS  14           H        LYS  14 -15.079  24.019   3.777
   98    HA   LYS  14           HA       LYS  14 -16.308  26.620   3.858
   99    HB2  LYS  14           HB2      LYS  14 -16.108  24.435   5.977
  100    HB3  LYS  14           HB3      LYS  14 -16.906  25.994   6.289
  101    HG2  LYS  14           HG2      LYS  14 -18.529  25.646   4.567
  102    HG3  LYS  14           HG3      LYS  14 -17.729  24.198   3.926
  103    HD2  LYS  14           HD2      LYS  14 -18.630  24.192   6.826
  104    HD3  LYS  14           HD3      LYS  14 -19.854  23.970   5.558
  105    HE2  LYS  14           HE2      LYS  14 -18.759  21.992   4.666
  106    HE3  LYS  14           HE3      LYS  14 -17.351  22.190   5.717
  107    HZ1  LYS  14           HZ1      LYS  14 -19.192  22.032   7.603
  108    H    ASP  15           H        ASP  15 -13.789  25.205   6.154
  109    HA   ASP  15           HA       ASP  15 -12.977  27.467   7.401
  110    HB2  ASP  15           H32      ASP  15 -11.185  25.278   6.232
  111    HB3  ASP  15           H33      ASP  15 -10.627  26.513   7.362
  112    H    GLU  16           H        GLU  16 -12.157  26.691   3.926
  113    HA   GLU  16           HA       GLU  16 -10.279  28.840   3.691
  114    HB2  GLU  16           HB2      GLU  16 -10.538  26.998   1.998
  115    HB3  GLU  16           HB3      GLU  16 -12.090  27.683   1.470
  116    HG2  GLU  16           HG2      GLU  16 -10.948  29.812   0.803
  117    HG3  GLU  16           HG3      GLU  16  -9.394  29.113   1.330
  118    H    GLN  17           H        GLN  17 -13.838  28.609   2.995
  119    HA   GLN  17           HA       GLN  17 -14.123  31.389   2.396
  120    HB2  GLN  17           H42      GLN  17 -15.780  29.649   1.760
  121    HB3  GLN  17           H43      GLN  17 -16.147  29.342   3.468
  122    HG2  GLN  17           H32      GLN  17 -17.943  30.677   2.570
  123    HG3  GLN  17           H33      GLN  17 -17.020  31.751   3.639
  124   HE21  GLN  17           H61      GLN  17 -15.859  33.804   0.865
  125   HE22  GLN  17           H62      GLN  17 -15.491  33.368   2.486
  126    H    ARG  18           H        ARG  18 -14.237  29.551   5.555
  127    HA   ARG  18           HA       ARG  18 -15.347  31.739   7.015
  128    HB2  ARG  18           H42      ARG  18 -13.490  29.580   8.129
  129    HB3  ARG  18           H43      ARG  18 -14.470  30.722   9.052
  130    HG2  ARG  18           H33      ARG  18 -16.585  29.669   8.024
  131    HG3  ARG  18           H32      ARG  18 -15.551  28.423   7.280
  132    HD2  ARG  18           H52      ARG  18 -14.702  27.865   9.669
  133    HD3  ARG  18           H53      ARG  18 -15.822  29.062  10.246
  134    HE   ARG  18           H10      ARG  18 -17.645  27.719   9.999
  135   HH11  ARG  18           H71      ARG  18 -18.567  25.668   9.923
  136   HH12  ARG  18           H72      ARG  18 -17.731  24.353   9.184
  137   HH21  ARG  18           H81      ARG  18 -14.899  26.189   8.314
  138   HH22  ARG  18           H82      ARG  18 -15.645  24.611   8.343
  139    H    ALA  19           H        ALA  19 -11.909  30.704   6.321
  140    HA   ALA  19           HA       ALA  19 -10.704  32.709   7.959
  141    HB1  ALA  19           H21      ALA  19  -9.628  31.442   5.373
  142    HB2  ALA  19           H22      ALA  19  -8.693  32.466   6.506
  143    HB3  ALA  19           H23      ALA  19  -9.304  30.880   7.032
  144    H    LYS  20           H        LYS  20 -11.623  32.658   4.402
  145    HA   LYS  20           HA       LYS  20 -10.724  35.287   3.868
  146    HB2  LYS  20           H42      LYS  20 -13.035  33.676   2.684
  147    HB3  LYS  20           H43      LYS  20 -12.581  35.284   2.069
  148    HG2  LYS  20           H23      LYS  20 -10.383  34.575   1.381
  149    HG3  LYS  20           H22      LYS  20 -10.487  33.052   2.268
  150    HD2  LYS  20           H33      LYS  20 -10.788  32.728  -0.184
  151    HD3  LYS  20           H32      LYS  20 -12.155  32.128   0.789
  152    HE2  LYS  20           H53      LYS  20 -12.991  33.220  -1.262
  153    HE3  LYS  20           H52      LYS  20 -13.522  34.117   0.166
  154    HZ1  LYS  20           H71      LYS  20 -12.740  35.580  -1.647
  155    HZ2  LYS  20           H72      LYS  20 -11.757  35.765  -0.209
  156    HZ3  LYS  20           H73      LYS  20 -11.149  34.830  -1.569
  157    H    LEU  21           H        LEU  21 -14.012  34.151   5.064
  158    HA   LEU  21           HA       LEU  21 -15.159  36.768   5.112
  159    HB2  LEU  21           HB2      LEU  21 -15.628  34.319   6.914
  160    HB3  LEU  21           HB3      LEU  21 -16.568  35.806   7.095
  161    HG   LEU  21           HG       LEU  21 -16.494  34.303   4.436
  162   HD11  LEU  21          HD11      LEU  21 -18.702  33.263   5.138
  163   HD12  LEU  21          HD12      LEU  21 -17.342  32.692   6.114
  164   HD13  LEU  21          HD13      LEU  21 -18.458  33.920   6.777
  165   HD21  LEU  21          HD21      LEU  21 -18.686  35.515   4.061
  166   HD22  LEU  21          HD22      LEU  21 -18.504  36.313   5.642
  167   HD23  LEU  21          HD23      LEU  21 -17.357  36.659   4.323
  168    H    PHE  22           H        PHE  22 -13.101  34.977   7.509
  169    HA   PHE  22           HA       PHE  22 -13.352  36.952   9.519
  170    HB2  PHE  22           HB2      PHE  22 -12.339  34.610   9.778
  171    HB3  PHE  22           HB3      PHE  22 -10.853  35.229   9.063
  172    HD1  PHE  22           HD1      PHE  22 -13.394  35.768  11.786
  173    HD2  PHE  22           HD2      PHE  22  -9.375  36.598  10.507
  174    HE1  PHE  22           HE1      PHE  22 -12.815  36.473  14.079
  175    HE2  PHE  22           HE2      PHE  22  -8.754  37.157  12.844
  176    HZ   PHE  22           HZ       PHE  22 -10.463  37.070  14.637
  177    H    ILE  23           H        ILE  23 -10.979  36.595   6.751
  178    HA   ILE  23           HA       ILE  23  -9.480  38.944   7.493
  179    HB   ILE  23           HB       ILE  23  -9.615  37.287   4.970
  180   HG12  ILE  23          HG12      ILE  23  -7.110  37.241   5.332
  181   HG13  ILE  23          HG13      ILE  23  -7.263  38.374   6.692
  182   HG21  ILE  23          HG21      ILE  23  -8.377  40.081   5.047
  183   HG22  ILE  23          HG22      ILE  23  -8.147  38.856   3.764
  184   HG23  ILE  23          HG23      ILE  23  -9.758  39.546   4.043
  185   HD11  ILE  23          HD11      ILE  23  -8.434  35.550   6.599
  186   HD12  ILE  23          HD12      ILE  23  -6.942  36.081   7.437
  187   HD13  ILE  23          HD13      ILE  23  -8.534  36.652   8.009
  188    H    GLU  24           H        GLU  24 -12.501  38.502   5.462
  189    HA   GLU  24           HA       GLU  24 -12.511  41.234   4.588
  190    HB2  GLU  24           HB2      GLU  24 -14.954  39.472   5.155
  191    HB3  GLU  24           HB3      GLU  24 -14.936  41.019   4.283
  192    HG2  GLU  24           HG2      GLU  24 -13.262  39.902   2.610
  193    HG3  GLU  24           HG3      GLU  24 -13.717  38.353   3.350
  194    H    TRP  25           H        TRP  25 -13.734  39.554   7.552
  195    HA   TRP  25           HA       TRP  25 -14.989  41.894   8.687
  196    HB2  TRP  25           HB2      TRP  25 -15.535  39.629   9.382
  197    HB3  TRP  25           HB3      TRP  25 -13.868  39.321   9.921
  198    HD1  TRP  25           HD1      TRP  25 -16.864  41.586  10.953
  199    HE1  TRP  25           HE1      TRP  25 -16.693  41.987  13.440
  200    HE3  TRP  25           HE3      TRP  25 -12.328  39.247  11.890
  201    HZ2  TRP  25           HZ2      TRP  25 -14.968  41.535  15.513
  202    HZ3  TRP  25           HZ3      TRP  25 -11.484  39.325  14.247
  203    HH2  TRP  25           HH2      TRP  25 -12.806  40.399  16.034
  204    H    LEU  26           H        LEU  26 -11.600  40.511   9.025
  205    HA   LEU  26           HA       LEU  26 -10.786  42.519  10.916
  206    HB2  LEU  26           HB2      LEU  26  -9.124  41.069   8.776
  207    HB3  LEU  26           HB3      LEU  26  -8.441  42.139  10.016
  208    HG   LEU  26           HG       LEU  26  -9.982  39.513  10.599
  209   HD11  LEU  26          HD11      LEU  26  -7.852  39.076   9.407
  210   HD12  LEU  26          HD12      LEU  26  -6.953  40.096  10.568
  211   HD13  LEU  26          HD13      LEU  26  -7.662  38.550  11.091
  212   HD21  LEU  26          HD21      LEU  26  -8.380  41.353  12.445
  213   HD22  LEU  26          HD22      LEU  26 -10.133  41.009  12.556
  214   HD23  LEU  26          HD23      LEU  26  -8.962  39.715  12.871
  215    H    AIB  27           H        ALA  27 -10.776  42.402   7.293
  216   HB11  AIB  27           H21      ALA  27  -8.219  44.225   6.821
  217   HB12  AIB  27           H22      ALA  27  -8.791  45.801   6.183
  218   HB13  AIB  27           H23      ALA  27  -8.839  45.478   7.933
  219   HB21  AIB  27           H31      ALA  27 -10.456  44.824   4.609
  220   HB22  AIB  27           H32      ALA  27  -9.845  43.207   5.047
  221   HB23  AIB  27           H33      ALA  27 -11.587  43.573   5.174
  222    H    ALA  28           H        ALA  28 -12.914  44.050   7.374
  223    HA   ALA  28           HA       ALA  28 -13.910  46.710   6.964
  224    HB1  ALA  28           H21      ALA  28 -14.953  44.516   8.864
  225    HB2  ALA  28           H22      ALA  28 -15.869  45.946   8.330
  226    HB3  ALA  28           H23      ALA  28 -15.408  44.695   7.145
  227    H    GLY  29           H        GLY  29 -12.178  45.160   9.703
  228    HA2  GLY  29           HA2      GLY  29 -11.311  47.326  11.025
  229    HA3  GLY  29           HA3      GLY  29 -13.000  47.285  11.593
  230    H    GLY  30           H        GLY  30 -12.978  44.098  11.500
  231    HA2  GLY  30           HA2      GLY  30 -12.294  42.420  12.958
  232    HA3  GLY  30           HA3      GLY  30 -10.958  43.470  13.492
  233    HA   PRO  31           HA       PRO  31 -14.117  43.500  17.002
  234    HB2  PRO  31           HB2      PRO  31 -11.648  45.041  18.017
  235    HB3  PRO  31           HB3      PRO  31 -12.768  44.020  18.959
  236    HG2  PRO  31           HG2      PRO  31 -10.453  42.877  18.153
  237    HG3  PRO  31           HG3      PRO  31 -11.973  42.005  17.788
  238    HD2  PRO  31           HD2      PRO  31 -10.389  43.825  15.872
  239    HD3  PRO  31           HD3      PRO  31 -10.994  42.152  15.563
  240    H    SER  32           H        SER  32 -12.192  46.181  15.392
  241    HA   SER  32           HA       SER  32 -13.755  48.308  16.513
  242    HB2  SER  32           HB2      SER  32 -12.175  48.272  13.893
  243    HB3  SER  32           HB3      SER  32 -12.658  49.711  14.828
  244    HG   SER  32           HG       SER  32 -11.244  48.833  16.557
  245    H    SER  33           H        SER  33 -14.324  46.148  13.615
  246    HA   SER  33           HA       SER  33 -15.875  48.028  12.207
  247    HB2  SER  33           HB2      SER  33 -16.838  46.129  10.941
  248    HB3  SER  33           HB3      SER  33 -15.071  45.998  11.134
  249    HG   SER  33           HG       SER  33 -16.155  43.976  11.612
  250    H    GLY  34           H        GLY  34 -16.857  46.404  15.223
  251    HA2  GLY  34           HA2      GLY  34 -18.937  46.608  16.312
  252    HA3  GLY  34           HA3      GLY  34 -19.358  47.839  15.095
  253    H    ALA  35           H        ALA  35 -18.433  44.304  14.983
  254    HA   ALA  35           HA       ALA  35 -21.168  43.565  14.121
  255    HB1  ALA  35           HB1      ALA  35 -18.718  43.363  12.267
  256    HB2  ALA  35           HB2      ALA  35 -20.308  42.607  11.960
  257    HB3  ALA  35           HB3      ALA  35 -20.164  44.386  12.024
  258    HA   PRO  36           HA       PRO  36 -19.217  40.287  16.732
  259    HB2  PRO  36           HB2      PRO  36 -21.509  38.801  15.318
  260    HB3  PRO  36           HB3      PRO  36 -20.937  38.501  16.975
  261    HG2  PRO  36           HG2      PRO  36 -23.105  40.097  16.640
  262    HG3  PRO  36           HG3      PRO  36 -21.781  40.732  17.654
  263    HD2  PRO  36           HD2      PRO  36 -22.373  41.436  14.726
  264    HD3  PRO  36           HD3      PRO  36 -21.928  42.518  16.084
  265    HA   PRO  37           HA       PRO  37 -16.762  38.896  13.328
  266    HB2  PRO  37           HB2      PRO  37 -15.406  36.615  14.331
  267    HB3  PRO  37           HB3      PRO  37 -15.067  38.298  14.835
  268    HG2  PRO  37           HG2      PRO  37 -16.964  36.329  16.174
  269    HG3  PRO  37           HG3      PRO  37 -15.598  37.214  16.943
  270    HD2  PRO  37           HD2      PRO  37 -18.163  38.159  17.147
  271    HD3  PRO  37           HD3      PRO  37 -16.845  39.344  16.762
  272    HA   PRO  38           HA       PRO  38 -19.537  36.367  11.146
  273    HB2  PRO  38           HB2      PRO  38 -18.083  35.319   9.035
  274    HB3  PRO  38           HB3      PRO  38 -18.321  37.076   9.280
  275    HG2  PRO  38           HG2      PRO  38 -15.891  35.476  10.191
  276    HG3  PRO  38           HG3      PRO  38 -15.895  36.938   9.161
  277    HD2  PRO  38           HD2      PRO  38 -15.490  37.195  11.845
  278    HD3  PRO  38           HD3      PRO  38 -16.625  38.343  11.027
  279    H    SER  39           H        SER  39 -19.975  34.922  13.019
  280    HA   SER  39           HA       SER  39 -19.462  32.096  12.360
  281    HB2  SER  39           HB2      SER  39 -18.380  31.681  14.600
  282    HB3  SER  39           HB3      SER  39 -17.353  32.457  13.377
  283    HG   SER  39           HG       SER  39 -17.810  34.514  14.512
  284    HN1  NH2  40           H11      SER  39 -21.909  31.429  15.003
  285    HN2  NH2  40           H12      SER  39 -20.570  30.694  14.202
  286    H93  EVT 101           H93      XXX  40 -25.690  17.499  11.078
  287    H92  EVT 101           H92      XXX  40 -25.816  18.794   9.875
  288   H103  EVT 101          H103      XXX  40 -26.012  17.146   8.028
  289   H102  EVT 101          H102      XXX  40 -25.686  15.799   9.140
  290    H11  EVT 101           H11      XXX  40 -27.692  16.312  10.454
  291   H122  EVT 101          H122      XXX  40 -30.026  14.282   7.116
  292   H123  EVT 101          H123      XXX  40 -29.378  12.984   8.148
  293   H133  EVT 101          H133      XXX  40 -31.408  13.131   9.616
  294   H132  EVT 101          H132      XXX  40 -31.870  12.760   7.947
  295   H143  EVT 101          H143      XXX  40 -32.565  15.069   7.525
  296   H142  EVT 101          H142      XXX  40 -31.873  15.624   9.064
  297   H153  EVT 101          H153      XXX  40 -33.499  14.197  10.333
  298   H152  EVT 101          H152      XXX  40 -34.233  13.673   8.795
  299    H6   EVT 101           H6       XXX  40 -23.819  19.272   8.552
  300   H163  EVT 101          H163      XXX  40 -34.877  16.053   8.303
  301   H162  EVT 101          H162      XXX  40 -34.050  16.584   9.796
  302   H173  EVT 101          H173      XXX  40 -35.648  15.170  11.143
  303   H172  EVT 101          H172      XXX  40 -36.515  14.753   9.633
  304   H183  EVT 101          H183      XXX  40 -36.975  17.195   9.233
  305   H182  EVT 101          H182      XXX  40 -36.099  17.614  10.723
  306   H193  EVT 101          H193      XXX  40 -38.707  15.976  10.579
  307   H192  EVT 101          H192      XXX  40 -38.530  17.674  11.053
  308   H203  EVT 101          H203      XXX  40 -36.893  16.779  12.918
  309   H202  EVT 101          H202      XXX  40 -37.585  15.175  12.580
  310   H213  EVT 101          H213      XXX  40 -39.901  16.127  13.083
  311   H212  EVT 101          H212      XXX  40 -39.129  17.700  13.413
  312   H223  EVT 101          H223      XXX  40 -37.766  16.618  15.256
  313   H222  EVT 101          H222      XXX  40 -38.640  15.091  14.965
  314    H25  EVT 101           H25      XXX  40 -28.082  15.657   7.586
  315   H293  EVT 101          H293      XXX  40 -40.806  16.209  15.573
  316   H292  EVT 101          H292      XXX  40 -39.959  17.765  15.736
  317   H303  EVT 101          H303      XXX  40 -40.254  17.017  17.985
  318   H302  EVT 101          H302      XXX  40 -38.537  16.747  17.603
  319   H313  EVT 101          H313      XXX  40 -39.109  14.292  17.149
  320   H312  EVT 101          H312      XXX  40 -40.782  14.632  17.637
  321   H321  EVT 101          H321      XXX  40 -38.270  14.930  19.409
  322   H323  EVT 101          H323      XXX  40 -39.507  13.650  19.518
  323   H322  EVT 101          H322      XXX  40 -39.927  15.335  19.936
  324   H353  EVT 101          H353      XXX  40 -19.320  19.871   8.744
  325   H352  EVT 101          H352      XXX  40 -19.426  18.417   7.742
  326   H363  EVT 101          H363      XXX  40 -21.737  19.185   6.951
  327   H362  EVT 101          H362      XXX  40 -21.598  20.565   8.067
  328    H37  EVT 101           H37      XXX  40 -21.497  17.577   8.828