*HEADER    HORMONE                                 24-MAR-17   5NIQ              
*TITLE     EXENDIN-4 VARIANT WITH DUAL GLP-1 / GLUCAGON RECEPTOR ACTIVITY        
*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    EXENDIN-4 ANALOGUE, DUAL GLP-1 / GLUCAGON AGONIST, HORMONE            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    A.EVERS,M.KURZ                                                        
*REVDAT   1   28-FEB-18 5NIQ    0                                                
# Restraints file 1: Peptide14_restraints.txt
ATOM1	ATOM2	LOWER	UPPER
ALA19.H	GLN20.H	2.69	3.28
ALA19.H	ILE23.QD1	4.69	6.73
ALA19.H	ALA19.QB	2.25	3.75
ALA19.H	PHE22.HB3	4.3	5.26
ALA19.H	PHE22.HB2	4.43	5.42
ALA19.H	ARG18.QD	3.75	5.49
ALA19.H	ARG18.QB	2.49	3.94
ALA19.HA	ILE23.H	3.48	4.25
ALA19.HA	PHE22.H	2.91	3.55
ALA19.HA	PHE22.CG	3.31	6.05
ALA35.H	ALA35.HA	2.76	3.38
ALA35.H	PRO36.HD2	3.98	4.86
ALA35.H	ALA35.QB	2.37	3.9
ALA35.HA	PRO36.HD3	2.2	2.69
ALA35.HA	PRO36.HD2	2.26	2.76
ARG17.H	ARG18.H	2.78	3.4
ARG17.H	ARG17.HG3	3.06	3.75
ARG17.H	ARG17.HG2	3.06	3.75
ARG17.H	ARG17.QD	3.43	5.09
ARG17.HA	ASP21.H	3.3	4.03
ARG17.HA	ARG17.H	2.47	3.02
ARG17.HA	GLN20.HE22	4.72	6.13
ARG17.HA	GLN20.HE21	4.72	6.13
ARG17.HB2	ARG17.H	2.37	3.03
ARG17.HB3	ARG17.H	2.37	3.03
ARG18.H	ALA19.H	2.66	3.25
ARG18.H	ALA19.QB	3.23	4.95
ARG18.H	ASP21.HB3	3.95	5.3
ARG18.H	ASP21.HB2	3.95	5.3
ARG18.HA	ASP21.H	2.85	3.48
ASN28.H	GLY30.H	3.51	4.29
ASN28.H	GLY29.H	2.63	3.22
ASN28.H	ASN28.HA	2.43	2.97
ASN28.H	ASN28.HB3	2.44	2.98
ASN28.H	ASN28.HB2	2.68	3.28
ASN28.H	GLU24.QG	4.4	6.27
ASN28.H	ILE23.QG2	5.2	7.36
ASN28.H	LYS27.QD	3.53	5.21
ASN28.H	LEU26.QD2	5.15	7.29
ASN28.HA	GLY29.H	2.81	3.44
ASN28.HA	LYS27.QD	4.23	6.07
ASN28.HB2	GLY29.H	3.61	4.41
ASN28.HB3	GLY29.H	2.83	3.46
ASN28.HD21	GLU24.QG	3.29	5.01
ASN28.HD22	GLU24.QG	3.29	5.01
ASP15.H	SER16.H	2.81	3.44
ASP15.H	LYS14.H	2.8	3.42
ASP15.H	ALA19.QB	4.02	5.91
ASP15.H	LYS14.QB	2.53	3.99
ASP15.H	LYS14.HG2	3.43	4.45
ASP15.H	LYS14.HG3	3.43	4.45
ASP15.H	LYS14.QD	3.64	5.35
ASP15.HB2	ALA19.H	4.05	5.78
ASP15.HB3	ALA19.H	4.05	5.78
ASP21.H	ILE23.H	3.53	4.32
ASP21.H	PHE22.H	2.51	3.07
ASP21.H	ALA19.QB	3.64	5.44
ASP21.H	ILE23.QD1	4.7	6.74
ASP21.H	PHE22.HB3	3.87	4.73
ASP21.H	ARG18.QB	3.36	5.01
ASP21.H	PHE22.HB2	3.79	4.63
ASP21.HA	ILE23.H	3.86	4.72
ASP21.HA	GLU24.H	3.03	3.7
ASP21.HA	ASP21.H	2.52	3.08
ASP21.HA	GLU24.HB3	2.51	3.23
ASP21.HA	GLU24.HB2	2.51	3.23
ASP21.HA	ILE23.QG2	4.91	7
ASP21.HA	GLU24.QG	2.8	4.33
ASP21.HB2	ILE23.H	4.24	5.66
ASP21.HB2	ASP21.H	2.54	3.25
ASP21.HB2	PHE22.H	2.8	3.81
ASP21.HB3	ILE23.H	4.24	5.66
ASP21.HB3	ASP21.H	2.54	3.25
ASP21.HB3	PHE22.H	2.8	3.81
ASP9.H	LEU10.H	2.85	3.49
ASP9.H	THR7.QG2	4.28	6.23
ASP9.H	LEU10.QD1	5.56	7.79
ASP9.H	LEU10.QD2	5.23	7.4
ASP9.HB2	LEU10.H	3.05	3.93
ASP9.HB3	LEU10.H	3.05	3.93
GLN13.H	ASP15.H	3.79	4.64
GLN13.H	LYS14.H	2.6	3.18
GLN13.H	LEU10.QD2	4.83	6.9
GLN13.H	LEU10.QD1	4.97	7.08
GLN13.H	GLN13.HA	2.6	3.18
GLN13.H	SER16.HB3	4.29	5.43
GLN13.H	SER16.HB2	4.29	5.43
GLN13.H	GLN13.HB3	2.53	3.3
GLN13.H	GLN13.HB2	2.53	3.3
GLN13.H	LYS12.QD	3.89	5.65
GLN13.H	LYS14.QB	3.4	5.05
GLN13.H	GLN13.QG	2.71	4.21
GLN13.HA	SER16.H	3.37	4.11
GLN13.HB2	LYS14.H	2.83	3.63
GLN13.HB3	LYS14.H	2.83	3.63
GLN20.H	ILE23.H	4.2	5.13
GLN20.H	ASP21.H	2.65	3.24
GLN20.H	ALA19.QB	2.51	4.06
GLN20.H	ILE23.QD1	4.06	5.96
GLN20.H	ILE23.QG2	4.76	6.82
GLN20.H	ASP21.HB3	3.66	5.19
GLN20.H	ASP21.HB2	3.66	5.19
GLN20.H	GLN20.HG3	2.95	3.86
GLN20.H	GLN20.HG2	2.95	3.86
GLN20.HA	ILE23.H	2.99	3.65
GLN20.HA	ASP21.H	3.01	3.68
GLN20.HA	PHE22.H	3.43	4.19
GLN20.HA	ILE23.HB	2.34	2.86
GLN20.HA	ILE23.QG2	2.9	4.55
GLN20.HA	ILE23.QD1	2.71	4.32
GLN20.HA	GLN20.H	2.61	3.18
GLN20.HA	ALA19.QB	3.01	4.68
GLN20.HB2	GLN20.H	2.43	3.21
GLN20.HB2	ASP21.H	2.75	3.47
GLN20.HB3	GLN20.H	2.43	3.21
GLN20.HB3	ASP21.H	2.75	3.47
GLN20.HG2	ASP21.H	3.61	4.81
GLN20.HG2	ILE23.QD1	3.99	6.29
GLN20.HG3	ASP21.H	3.61	4.81
GLN20.HG3	ILE23.QD1	3.99	6.29
GLN3.H	GLY4.H	3.54	4.32
GLU1'.HA	LYS14.ENH	3.57	4.37
GLU1'.HB2	LYS14.ENH	3.8	4.77
GLU1'.HB3	LYS14.ENH	3.8	4.77
GLU24.H	LYS27.H	4.48	5.48
GLU24.H	TRP25.H	2.73	3.33
GLU24.H	ILE23.QG2	3.07	4.75
GLU24.H	ILE23.QD1	3.77	5.61
GLU24.H	GLU24.HA	2.48	3.03
GLU24.H	GLU24.HB3	2.44	3.17
GLU24.H	GLU24.HB2	2.44	3.17
GLU24.H	LEU26.QD1	4.89	6.98
GLU24.H	LEU26.QD2	5.99	8.33
GLU24.H	GLU24.QG	2.65	4.14
GLU24.HA	LYS27.H	3	3.67
GLU24.HA	LEU26.H	3.92	4.79
GLU24.HA	TRP25.H	3.24	3.96
GLU24.HA	ASN28.H	3.52	4.3
GLU24.HA	ASN28.HD21	3.82	4.91
GLU24.HB2	LYS27.H	4.54	5.85
GLU24.HB2	TRP25.H	2.8	3.43
GLU24.HB2	ASN28.HD21	3.87	5.71
GLU24.HB3	LYS27.H	4.54	5.85
GLU24.HB3	TRP25.H	2.8	3.43
GLU24.HB3	ASN28.HD22	3.87	5.71
GLU24.HB3	ASN28.HD21	3.87	5.71
GLY29.H	GLY30.H	2.53	3.1
GLY29.H	LEU26.QD2	4.16	6.09
GLY29.HA2	GLY30.H	2.94	3.76
GLY29.HA3	GLY30.H	2.94	3.76
GLY30.H	LEU26.QD2	3.74	5.57
GLY30.H	GLY30.HA3	2.71	3.32
GLY30.H	GLY30.HA2	2.46	3.01
GLY30.HA2	SER33.H	3.51	4.29
GLY30.HA2	LEU26.QD1	3.67	5.48
GLY30.HA2	LEU26.QD2	2.96	4.62
GLY30.HA2	PRO31.HD3	2.82	3.44
GLY30.HA3	SER33.H	4.18	5.1
GLY30.HA3	PRO31.HD2	2.44	2.98
GLY30.HA3	LEU26.QD1	3.83	5.68
GLY30.HA3	LEU26.QD2	2.97	4.63
GLY30.HA3	PRO31.HD3	2.49	3.05
GLY34.H	ALA35.H	2.62	3.2
GLY34.H	ALA35.QB	3.65	5.46
ILE23.H	GLU24.H	2.73	3.34
ILE23.H	ILE23.QD1	3.09	4.78
ILE23.H	ILE23.QG2	2.94	4.59
ILE23.H	ILE23.HB	2.4	2.93
ILE23.H	ALA19.QB	3.9	5.77
ILE23.H	ILE23.HA	2.76	3.38
ILE23.HA	LYS27.H	3.27	4
ILE23.HA	GLU24.H	3.05	3.73
ILE23.HA	LEU26.QD1	2.64	4.22
ILE23.HA	ILE23.QG2	2.4	3.94
ILE23.HA	LEU26.HG	2.83	3.46
ILE23.HB	GLU24.H	2.65	3.24
ILE23.HB	ALA19.QB	3.85	5.71
ILE23.HB	ILE23.QD1	2.39	3.93
LEU10.H	LYS12.H	3.59	4.39
LEU10.H	LEU10.QD1	3.51	5.29
LEU10.H	LEU10.QD2	3.5	5.28
LEU10.H	LEU10.HA	2.63	3.21
LEU10.HA	SER11.H	2.98	3.64
LEU10.HA	GLN13.H	3.2	3.91
LEU10.HA	LYS12.H	3.74	4.57
LEU10.HA	LEU10.QD1	2.76	4.37
LEU10.HA	LEU10.QD2	2.61	4.19
LEU10.QD1	GLN13.QG	4	6.79
LEU10.QD2	GLN13.QG	4.24	7.08
LEU26.H	LYS27.H	2.75	3.37
LEU26.H	ASN28.H	3.93	4.8
LEU26.H	GLY29.H	4.88	5.97
LEU26.H	LEU26.HG	2.57	3.14
LEU26.H	LEU26.QD1	3.24	4.96
LEU26.H	LEU26.QD2	3.18	4.89
LEU26.H	LEU26.HA	2.67	3.27
LEU26.H	ASN28.HB3	4.4	5.37
LEU26.H	ASN28.HB2	4.63	5.66
LEU26.H	GLU24.QG	4.9	6.89
LEU26.HA	LYS27.H	3.24	3.96
LEU26.HA	GLY30.H	2.67	3.27
LEU26.HA	GLY29.H	3.13	3.82
LEU26.HA	ASN28.H	3.75	4.59
LEU26.HA	GLY30.HA2	2.78	3.39
LEU26.HA	LEU26.QD1	2.84	4.48
LEU26.HA	LEU26.QD2	2.32	3.83
LEU26.HA	LEU26.HG	2.8	3.42
LEU26.HA	GLY30.HA3	2.88	3.52
LYS12.H	GLN13.H	2.66	3.25
LYS12.H	LEU10.QD1	5.65	7.9
LYS12.H	LEU10.QD2	5.69	7.95
LYS12.H	LYS12.HA	2.55	3.12
LYS12.H	ASP15.HB3	3.99	4.93
LYS12.H	ASP15.HB2	3.99	4.93
LYS12.H	LYS12.HB3	2.52	3.26
LYS12.H	LYS12.HB2	2.52	3.26
LYS12.H	THR7.QG2	5.2	7.36
LYS12.H	LYS12.QE	4.75	6.7
LYS12.H	GLN13.QG	4.01	5.8
LYS12.HA	ASP15.H	3	3.67
LYS12.HA	GLN13.H	2.77	3.39
LYS12.HB2	GLN13.H	2.97	3.69
LYS12.HB3	GLN13.H	2.97	3.69
LYS14.ENH	GLU1'.QG	2.38	3.8
LYS14.ENH	LEU10.QD1	6.07	8.42
LYS14.ENH	LEU10.QD2	5.12	7.26
LYS14.H	GLN13.QG	3.4	5.05
LYS14.H	LYS14.QD	3.27	4.9
LYS14.HA	LYS14.H	2.7	3.3
LYS14.HE2	LEU10.QD2	4.36	6.35
LYS14.HE3	LEU10.QD2	4.36	6.35
LYS14.HE3	LEU10.QD1	4.08	6.21
LYS27.H	GLY30.H	4.44	5.43
LYS27.H	GLY29.H	3.7	4.52
LYS27.H	ASN28.H	2.7	3.3
LYS27.H	ILE23.QG2	3.52	5.31
LYS27.H	GLU24.QG	4.64	6.57
LYS27.H	LYS27.QE	4.61	6.53
LYS27.H	LEU26.QD1	3.82	5.66
LYS27.H	LEU26.QD2	3.89	5.76
LYS27.H	ASN28.HB2	4.33	5.3
LYS27.H	ASN28.HB3	3.9	4.77
LYS27.H	LYS27.HA	2.58	3.16
LYS27.H	LYS27.QG	3.37	5.02
LYS27.HA	ASN28.H	3.08	3.76
LYS27.HA	ILE23.QG2	3.92	5.8
LYS27.HA	LYS27.QE	4	5.79
LYS27.HB2	ASN28.H	2.81	3.73
LYS27.HB3	ASN28.H	2.81	3.73
PHE22.CG	LEU26.H	4.34	7.3
PHE22.CG	ILE23.H	3.54	6.33
PHE22.CG	PHE22.H	3.81	6.66
PHE22.CG	LEU26.QD1	3.14	6.83
PHE22.CG	LEU26.QD2	3.45	7.21
PHE22.CG	PRO38.HD3	3.86	6.71
PHE22.CG	PRO38.HD2	3.36	6.11
PHE22.CG	PRO37.HA	4.33	7.3
PHE22.CG	ALA19.QB	3.62	7.42
PHE22.CG	ILE23.QG2	3.53	7.32
PHE22.CG	ILE23.QD1	3.5	7.28
PHE22.CG	PRO38.QG	3.31	6.94
PHE22.CG	LEU26.HG	3.53	6.31
PHE22.CG	ILE23.HA	3.21	5.92
PHE22.CG	PRO38.HB3	4.68	7.72
PHE22.CG	PRO38.HB2	3.24	5.97
PHE22.H	ILE23.H	2.73	3.33
PHE22.H	GLU24.H	3.44	4.21
PHE22.H	ILE23.HB	4.14	5.05
PHE22.H	ALA19.QB	3.77	5.61
PHE22.H	ILE23.QD1	5.16	7.31
PHE22.H	ILE23.QG2	5.02	7.14
PHE22.H	PHE22.HB3	2.48	3.03
PHE22.H	PHE22.HB2	2.47	3.02
PHE22.H	PHE22.HA	2.67	3.26
PHE22.HA	ILE23.H	3.2	3.91
PHE22.HA	GLU24.H	3.74	4.57
PHE22.HA	LEU26.H	3.18	3.89
PHE22.HB2	ILE23.H	3.03	3.7
PHE22.HB3	ILE23.H	2.78	3.4
PHE22.HB3	GLU24.H	3.95	4.83
PHE22.HB3	ILE23.QD1	3.8	5.65
PHE22.HB3	ALA19.QB	3.12	4.82
PHE6.CG	PHE6.H	3.7	6.52
PHE6.CG	THR7.H	4.22	7.16
PHE6.H	PHE6.HB2	2.81	3.6
PHE6.H	PHE6.HB3	2.81	3.6
PHE6.H	THR5.QG2	3.9	5.77
PHE6.H	THR7.QG2	4.45	6.44
PHE6.H	THR7.H	3.5	4.28
PHE6.HA	ASP9.HB3	3.46	4.3
PHE6.HA	ASP9.HB2	3.46	4.3
PHE6.HA	THR5.QG2	4.44	6.43
PHE6.HA	LEU10.QD1	4.45	6.44
PHE6.HA	THR7.QG2	4.4	6.38
PHE6.HA	LEU10.QD2	4.92	7.01
PHE6.HB2	THR7.H	3.16	4.22
PHE6.HB3	THR7.H	3.16	4.22
PRO31.HA	SER33.H	3.14	3.84
PRO31.HA	GLY34.H	3.5	4.28
PRO31.HA	SER32.H	2.99	3.66
PRO31.HB3	SER32.H	3.61	4.41
PRO31.HB3	SER33.H	4.63	5.66
PRO31.HD2	LEU26.QD2	3.42	5.18
PRO31.HD2	SER32.H	2.9	3.54
PRO31.HD3	LEU26.QD2	3.37	5.12
PRO31.HD3	SER32.H	3.17	3.87
PRO31.HG2	SER32.H	3.44	4.2
PRO36.HD2	ALA35.QB	2.55	4.12
PRO36.HD3	ALA35.QB	2.81	4.44
PRO37.HA	PRO38.HD2	2.34	2.86
PRO37.HB2	SER39.H	3.89	4.75
PRO37.HB3	SER39.H	4.98	6.09
PRO38.HB2	SER39.H	3.22	3.93
PRO38.HB3	SER39.H	3.32	4.06
PRO38.HD2	SER39.H	4.2	5.13
PRO38.HD3	SER39.H	4.14	5.06
SER11.H	LYS12.H	2.69	3.29
SER11.H	LEU10.QD1	4.22	6.16
SER11.H	LEU10.QD2	4.12	6.03
SER11.H	SER11.HB3	2.7	3.39
SER11.H	SER11.HB2	2.7	3.39
SER11.H	SER11.HA	2.37	2.89
SER11.HA	ASP15.H	3.31	4.05
SER11.HA	LYS12.H	2.85	3.49
SER11.HB2	LYS12.H	3.23	4.05
SER11.HB3	LYS12.H	3.23	4.05
SER16.H	ARG17.H	2.91	3.56
SER16.H	ALA19.H	3.76	4.6
SER16.H	ARG18.H	3.54	4.33
SER16.H	ALA19.QB	3.77	5.61
SER16.H	ARG17.HB3	3.31	4.69
SER16.H	ARG17.HB2	3.31	4.69
SER16.HA	ARG17.H	2.87	3.51
SER16.HA	ALA19.H	3.18	3.89
SER16.HA	SER16.H	2.6	3.18
SER16.HB2	SER16.H	2.7	3.25
SER16.HB2	ARG17.H	3.02	3.79
SER16.HB3	SER16.H	2.7	3.25
SER16.HB3	ARG17.H	3.02	3.79
SER32.H	SER33.H	2.62	3.2
SER32.H	GLY34.H	3.81	4.65
SER32.H	SER32.HB3	2.56	3.24
SER32.H	SER32.HB2	2.56	3.24
SER32.H	SER32.HA	2.66	3.25
SER32.HA	SER33.H	2.97	3.63
SER32.HA	GLY34.H	3.29	4.03
SER33.H	GLY34.H	2.66	3.25
SER33.H	SER33.HA	2.78	3.4
SER33.HA	GLY34.H	3.05	3.72
SER39.H	SER39.HB3	3.24	4.15
SER39.H	SER39.HB2	3.24	4.15
SER39.H	SER39.H11	3.96	5.24
SER39.H	SER39.H12	3.96	5.24
SER8.H	THR7.QG2	3.66	5.48
SER8.H	THR5.QG2	4.91	7
SER8.HA	SER11.H	3.25	3.97
SER8.HA	LEU10.H	3.75	4.58
SER8.HA	LYS12.H	4.01	4.9
SER8.HB2	ASP9.H	3.08	4.18
SER8.HB3	ASP9.H	3.08	4.18
THR5.H	PHE6.H	3.54	4.32
THR5.HA	PHE6.H	2.73	3.34
THR5.HA	THR7.H	4.02	4.91
THR7.H	SER8.H	3.18	3.89
THR7.H	THR5.QG2	4.33	6.3
THR7.H	LEU10.QD1	5.08	7.21
THR7.H	LEU10.QD2	6.21	8.59
THR7.H	THR7.QG2	3.01	4.68
THR7.HA	LEU10.QD1	3.5	5.28
THR7.HA	LEU10.QD2	3.67	5.49
TRP25.H	LYS27.H	3.97	4.86
TRP25.H	LEU26.H	2.72	3.32
TRP25.H	ILE23.QG2	4.38	6.35
TRP25.H	ILE23.QD1	5.43	7.64
TRP25.H	LEU26.QD1	5.12	7.26
TRP25.H	LEU26.QD2	4.91	7.01
TRP25.H	GLU24.QG	3.42	5.08
TRP25.H	TRP25.HB3	2.41	2.95
TRP25.H	TRP25.HB2	2.37	2.9
TRP25.HE1	ALA35.H	3.63	4.44
TRP25.HE1	ALA35.HA	4.48	5.48
TRP25.HE1	PRO31.HA	3.66	4.48
TRP25.HE1	PRO37.QD	3.75	5.48
TRP25.HE1	PRO37.HA	3.14	3.83
TRP25.HE1	ALA35.QB	2.98	4.65
TRP25.HE1	PRO37.HB3	4.44	5.43
TRP25.HE1	PRO37.HB2	4.89	5.97
TRP25.HE1	PRO36.QG	4.78	6.74
TRP25.HE1	LEU26.QD2	5.7	7.97
TRP25.HE1	PRO38.HD3	4.27	5.22
TRP25.HE1	PRO38.HD2	4.29	5.24
TRP25.HE1	GLY30.HA2	3.87	4.73
TRP25.HD1	LEU26.H	4.62	5.65
TRP25.HD1	ALA35.H	4.43	5.42
TRP25.HD1	PRO37.HA	3.36	4.11
TRP25.HD1	PRO38.QG	3.98	5.77
TRP25.HD1	ALA35.QB	2.82	4.45
TRP25.HD1	PRO38.HD3	3.32	4.05
TRP25.HD1	PRO38.HD2	3.72	4.54
TRP25.HD1	GLY30.HA2	3.99	4.88
TRP25.HE3	LEU26.H	2.91	3.56
TRP25.HE3	GLY30.HA2	3.5	4.28
TRP25.HE3	GLY30.HA3	3.71	4.54
TRP25.HZ3	PRO31.HA	4.21	5.15
TRP25.HZ3	LEU26.QD2	2.74	4.35
TRP25.HZ3	PRO38.HD2	4.56	5.57
TRP25.HZ3	PRO38.HD3	5.09	6.22
TRP25.HZ3	PRO37.HA	4.26	5.2
TRP25.HZ3	LEU26.HA	3.75	4.58
TRP25.HZ3	LEU26.HG	3.4	4.15
TRP25.HZ3	PRO37.HG2	5.31	6.49
TRP25.HZ3	PRO37.HG3	4.3	5.25
TRP25.HZ3	PRO31.HG2	4.26	5.21
TRP25.HZ3	PRO31.HG3	3.87	4.73
TRP25.HZ3	PRO31.HD3	3.34	4.08
TRP25.HZ3	GLY30.HA2	3.6	4.4
TRP25.HZ3	LEU26.H	4.19	5.12
TRP25.HZ3	PRO37.QD	4.22	6.06
TRP25.HZ3	PRO31.HD2	3.65	4.46
TRP25.HZ3	GLY30.HA3	3.67	4.49
TRP25.HZ3	PRO37.HB2	4.01	4.9
TRP25.HZ3	PRO37.HB3	3.8	4.65
TRP25.HZ3	LEU26.QD1	3.46	5.23
TRP25.HH2	PRO31.HA	3.17	3.87
TRP25.HH2	PRO37.HA	3.95	4.83
TRP25.HH2	PRO37.QD	3.58	5.28
TRP25.HH2	LEU26.QD2	3.48	5.26
TRP25.HH2	PRO37.HG2	4.5	5.51
TRP25.HH2	PRO37.HG3	3.62	4.43
TRP25.HH2	PRO37.HB3	3.6	4.41
TRP25.HH2	PRO37.HB2	3.97	4.85
TRP25.HH2	PRO31.HG2	3.61	4.41
TRP25.HH2	PRO31.HD3	2.93	3.58
TRP25.HH2	GLY30.HA2	3.66	4.47
TRP25.HH2	PRO38.HD2	4.73	5.78
TRP25.HH2	PRO38.HD3	5.12	6.26
TRP25.HH2	GLY30.HA3	3.6	4.4
TRP25.HH2	PRO31.HD2	3.2	3.91
TRP25.HH2	PRO31.HB3	3.45	4.21
TRP25.HZ2	PRO31.HA	2.64	3.23
TRP25.HZ2	PRO31.HD3	3.51	4.29
TRP25.HZ2	PRO37.HA	3.66	4.47
TRP25.HZ2	LEU26.QD2	4.28	6.23
TRP25.HZ2	GLY30.HA2	3.63	4.44
TRP25.HZ2	PRO37.QD	2.98	4.55
TRP25.HZ2	GLY30.HA3	3.78	4.62
TRP25.HZ2	PRO37.HG3	3.82	4.67
TRP25.HZ2	PRO37.HB3	3.68	4.5
TRP25.HZ2	PRO31.HB3	3.47	4.24
TRP25.HA	LYS27.H	3.97	4.85
TRP25.HA	LEU26.H	3.44	4.2
TRP25.HA	ASN28.H	3.1	3.79
TRP25.HA	TRP25.HD1	2.68	3.28
TRP25.HA	ASN28.HD22	3.8	4.91
TRP25.HA	ASN28.HD21	3.8	4.91
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   HIS   1           H1       HIS   1 -33.462  18.295  -3.610
    2    H2   HIS   1           H2       HIS   1 -34.113  19.110  -2.236
    3    H3   HIS   1           H3       HIS   1 -34.428  19.677  -3.803
    4    HA   HIS   1           HA       HIS   1 -36.421  18.471  -2.882
    5    HB2  HIS   1           HB2      HIS   1 -35.923  18.421  -5.406
    6    HB3  HIS   1           HB3      HIS   1 -35.113  16.857  -5.160
    7    HD1  HIS   1           HD1      HIS   1 -36.758  14.924  -4.221
    8    HD2  HIS   1           HD2      HIS   1 -38.522  18.401  -5.793
    9    HE1  HIS   1           HE1      HIS   1 -39.155  14.304  -4.702
   10    H    DSN   2           HN       DSN   2 -37.314  16.355  -1.995
   11    HA   DSN   2           HA       DSN   2 -35.400  14.181  -1.596
   12    HB2  DSN   2           HB1      DSN   2 -37.182  13.114  -0.280
   13    HB3  DSN   2           HB2      DSN   2 -37.843  13.740  -1.824
   14    HG   DSN   2           HOG      DSN   2 -39.183  14.360   0.037
   15    H    GLN   3           H        GLN   3 -34.819  13.371   0.698
   16    HA   GLN   3           HA       GLN   3 -34.065  13.784   2.870
   17    HB2  GLN   3           HB2      GLN   3 -33.219  16.431   1.536
   18    HB3  GLN   3           HB3      GLN   3 -32.552  15.737   3.032
   19    HG2  GLN   3           HG2      GLN   3 -31.744  13.721   1.694
   20    HG3  GLN   3           HG3      GLN   3 -32.460  14.430   0.227
   21   HE21  GLN   3          HE21      GLN   3 -30.153  15.487   2.922
   22   HE22  GLN   3          HE22      GLN   3 -29.081  16.267   1.819
   23    H    GLY   4           H        GLY   4 -36.766  14.018   2.926
   24    HA2  GLY   4           HA2      GLY   4 -37.746  16.549   3.710
   25    HA3  GLY   4           HA3      GLY   4 -38.484  14.997   4.169
   26    H    THR   5           H        THR   5 -38.524  17.260   5.874
   27    HA   THR   5           HA       THR   5 -37.738  18.069   7.906
   28    HB   THR   5           HB       THR   5 -38.254  16.561   9.718
   29    HG1  THR   5           HG1      THR   5 -37.124  14.639   8.956
   30   HG21  THR   5          HG21      THR   5 -40.064  15.846   7.333
   31   HG22  THR   5          HG22      THR   5 -40.486  15.779   9.066
   32   HG23  THR   5          HG23      THR   5 -40.168  17.357   8.289
   33    H    PHE   6           H        PHE   6 -35.411  17.778   6.293
   34    HA   PHE   6           HA       PHE   6 -33.375  16.389   7.746
   35    HB2  PHE   6           HB2      PHE   6 -32.994  17.251   5.469
   36    HB3  PHE   6           HB3      PHE   6 -33.175  18.926   6.036
   37    HD1  PHE   6           HD1      PHE   6 -31.175  15.756   6.630
   38    HD2  PHE   6           HD2      PHE   6 -31.159  20.060   6.801
   39    HE1  PHE   6           HE1      PHE   6 -28.734  15.735   7.034
   40    HE2  PHE   6           HE2      PHE   6 -28.704  20.034   7.092
   41    HZ   PHE   6           HZ       PHE   6 -27.481  17.875   7.192
   42    H    THR   7           H        THR   7 -34.631  19.830   8.193
   43    HA   THR   7           HA       THR   7 -32.766  20.507  10.123
   44    HB   THR   7           HB       THR   7 -34.493  22.117   9.324
   45    HG1  THR   7           HG1      THR   7 -34.264  21.891  12.179
   46   HG21  THR   7          HG21      THR   7 -36.397  20.754  11.345
   47   HG22  THR   7          HG22      THR   7 -36.718  22.239  10.422
   48   HG23  THR   7          HG23      THR   7 -36.566  20.675   9.568
   49    H    SER   8           H        SER   8 -35.470  18.092  10.621
   50    HA   SER   8           HA       SER   8 -35.625  18.453  13.426
   51    HB2  SER   8           HB2      SER   8 -37.167  16.949  12.165
   52    HB3  SER   8           HB3      SER   8 -35.841  15.780  11.925
   53    HG   SER   8           HG       SER   8 -37.116  15.297  13.879
   54    H    ASP   9           H        ASP   9 -33.309  16.370  11.527
   55    HA   ASP   9           HA       ASP   9 -32.049  15.392  13.916
   56    HB2  ASP   9           HB2      ASP   9 -31.864  14.337  11.594
   57    HB3  ASP   9           HB3      ASP   9 -30.798  15.681  11.112
   58    H    LEU  10           H        LEU  10 -31.515  18.413  12.003
   59    HA   LEU  10           HA       LEU  10 -29.087  19.117  13.433
   60    HB2  LEU  10           HB2      LEU  10 -30.993  20.824  11.786
   61    HB3  LEU  10           HB3      LEU  10 -29.820  21.547  12.898
   62    HG   LEU  10           HG       LEU  10 -27.944  20.340  11.600
   63   HD11  LEU  10          HD11      LEU  10 -30.129  19.203   9.733
   64   HD12  LEU  10          HD12      LEU  10 -28.350  19.088   9.577
   65   HD13  LEU  10          HD13      LEU  10 -29.153  18.314  10.956
   66   HD21  LEU  10          HD21      LEU  10 -29.912  21.786   9.701
   67   HD22  LEU  10          HD22      LEU  10 -28.744  22.539  10.857
   68   HD23  LEU  10          HD23      LEU  10 -28.149  21.510   9.501
   69    H    SER  11           H        SER  11 -32.715  19.949  13.821
   70    HA   SER  11           HA       SER  11 -32.459  21.589  16.059
   71    HB2  SER  11           HB2      SER  11 -34.608  19.464  15.567
   72    HB3  SER  11           HB3      SER  11 -34.710  20.793  16.742
   73    HG   SER  11           HG       SER  11 -34.601  22.247  14.845
   74    H    LYS  12           H        LYS  12 -32.158  17.962  15.867
   75    HA   LYS  12           HA       LYS  12 -32.085  17.736  18.749
   76    HB2  LYS  12           HB2      LYS  12 -32.699  15.890  17.134
   77    HB3  LYS  12           HB3      LYS  12 -30.972  15.692  16.761
   78    HG2  LYS  12           HG2      LYS  12 -30.513  15.186  19.195
   79    HG3  LYS  12           HG3      LYS  12 -32.224  15.527  19.580
   80    HD2  LYS  12           HD2      LYS  12 -32.898  13.637  17.993
   81    HD3  LYS  12           HD3      LYS  12 -31.173  13.214  17.839
   82    HE2  LYS  12           HE2      LYS  12 -31.056  12.795  20.305
   83    HE3  LYS  12           HE3      LYS  12 -32.735  13.350  20.512
   84    HZ1  LYS  12           HZ1      LYS  12 -32.640  10.862  20.457
   85    HZ2  LYS  12           HZ2      LYS  12 -33.540  11.447  19.110
   86    HZ3  LYS  12           HZ3      LYS  12 -31.946  10.901  18.886
   87    H    GLN  13           H        GLN  13 -29.489  18.156  16.187
   88    HA   GLN  13           HA       GLN  13 -27.328  17.890  18.112
   89    HB2  GLN  13           HB2      GLN  13 -27.402  19.669  15.585
   90    HB3  GLN  13           HB3      GLN  13 -25.983  19.329  16.605
   91    HG2  GLN  13           HG2      GLN  13 -26.400  16.799  16.103
   92    HG3  GLN  13           HG3      GLN  13 -27.499  17.350  14.820
   93   HE21  GLN  13          HE21      GLN  13 -26.514  18.869  13.073
   94   HE22  GLN  13          HE22      GLN  13 -24.837  18.666  12.734
   95    H    LYS  14           HN       LYS  14 -29.477  20.643  17.072
   96    HA   LYS  14           HA       LYS  14 -28.029  22.590  18.619
   97    HB2  LYS  14           HB2      LYS  14 -30.978  22.546  17.734
   98    HB3  LYS  14           HB3      LYS  14 -30.187  23.940  18.505
   99    HG2  LYS  14          HC81      LYS  14 -28.552  24.129  16.711
  100    HG3  LYS  14          HC82      LYS  14 -29.169  22.691  15.866
  101    HD2  LYS  14          HC71      LYS  14 -31.359  23.802  15.467
  102    HD3  LYS  14          HC72      LYS  14 -30.809  25.253  16.350
  103    HE2  LYS  14          HC61      LYS  14 -29.490  24.133  13.787
  104    HE3  LYS  14          HC62      LYS  14 -30.615  25.506  13.823
  105    HZ1  LYS  14          H N1      LYS  14 -27.813  25.501  14.744
  106    H    ASP  15           H        ASP  15 -30.887  20.473  19.378
  107    HA   ASP  15           HA       ASP  15 -31.296  21.373  22.030
  108    HB2  ASP  15           HB2      ASP  15 -32.810  19.721  20.853
  109    HB3  ASP  15           HB3      ASP  15 -31.511  18.503  20.930
  110    H    SER  16           H        SER  16 -28.929  18.892  20.672
  111    HA   SER  16           HA       SER  16 -28.106  18.001  23.238
  112    HB2  SER  16           HB2      SER  16 -27.503  16.851  21.134
  113    HB3  SER  16           HB3      SER  16 -26.396  18.186  20.689
  114    HG   SER  16           HG       SER  16 -25.314  16.365  21.820
  115    H    ARG  17           H        ARG  17 -26.869  20.832  21.244
  116    HA   ARG  17           HA       ARG  17 -24.898  21.456  23.288
  117    HB2  ARG  17           HB2      ARG  17 -24.708  21.977  20.816
  118    HB3  ARG  17           HB3      ARG  17 -26.011  23.179  20.986
  119    HG2  ARG  17           HG2      ARG  17 -24.514  24.310  22.783
  120    HG3  ARG  17           HG3      ARG  17 -23.265  23.104  22.376
  121    HD2  ARG  17           HD2      ARG  17 -22.700  25.115  21.193
  122    HD3  ARG  17           HD3      ARG  17 -23.315  23.953  19.969
  123    HE   ARG  17           HE       ARG  17 -25.490  25.616  20.926
  124   HH11  ARG  17          HH11      ARG  17 -26.211  27.395  19.753
  125   HH12  ARG  17          HH12      ARG  17 -25.197  28.120  18.528
  126   HH21  ARG  17          HH21      ARG  17 -22.493  25.925  18.953
  127   HH22  ARG  17          HH22      ARG  17 -23.117  27.337  18.115
  128    H    ARG  18           H        ARG  18 -28.142  22.873  22.349
  129    HA   ARG  18           HA       ARG  18 -27.941  24.997  24.314
  130    HB2  ARG  18           HB2      ARG  18 -30.305  23.780  22.782
  131    HB3  ARG  18           HB3      ARG  18 -30.533  25.115  23.914
  132    HG2  ARG  18           HG2      ARG  18 -28.347  25.477  21.857
  133    HG3  ARG  18           HG3      ARG  18 -30.024  25.599  21.276
  134    HD2  ARG  18           HD2      ARG  18 -30.536  27.418  22.763
  135    HD3  ARG  18           HD3      ARG  18 -29.012  27.185  23.699
  136    HE   ARG  18           HE       ARG  18 -28.339  27.733  20.970
  137   HH11  ARG  18          HH11      ARG  18 -27.372  29.740  20.544
  138   HH12  ARG  18          HH12      ARG  18 -27.741  31.140  21.544
  139   HH21  ARG  18          HH21      ARG  18 -29.803  29.417  23.788
  140   HH22  ARG  18          HH22      ARG  18 -29.062  30.948  23.360
  141    H    ALA  19           H        ALA  19 -29.476  21.703  24.374
  142    HA   ALA  19           HA       ALA  19 -30.541  21.938  27.006
  143    HB1  ALA  19           HB1      ALA  19 -29.316  19.437  25.666
  144    HB2  ALA  19           HB2      ALA  19 -30.409  19.443  27.076
  145    HB3  ALA  19           HB3      ALA  19 -31.009  19.980  25.480
  146    H    GLN  20           H        GLN  20 -27.220  20.784  25.856
  147    HA   GLN  20           HA       GLN  20 -26.214  20.482  28.516
  148    HB2  GLN  20           HB2      GLN  20 -24.772  21.081  25.877
  149    HB3  GLN  20           HB3      GLN  20 -23.924  20.949  27.438
  150    HG2  GLN  20           HG2      GLN  20 -24.731  18.644  27.769
  151    HG3  GLN  20           HG3      GLN  20 -25.688  18.711  26.272
  152   HE21  GLN  20          HE21      GLN  20 -24.205  16.641  25.948
  153   HE22  GLN  20          HE22      GLN  20 -22.699  16.945  25.164
  154    H    ASP  21           H        ASP  21 -26.580  23.430  26.448
  155    HA   ASP  21           HA       ASP  21 -24.894  25.040  28.166
  156    HB2  ASP  21           HB2      ASP  21 -25.647  25.607  25.750
  157    HB3  ASP  21           HB3      ASP  21 -27.208  26.121  26.447
  158    H    PHE  22           H        PHE  22 -28.470  24.340  28.033
  159    HA   PHE  22           HA       PHE  22 -29.117  26.101  30.229
  160    HB2  PHE  22           HB2      PHE  22 -30.844  25.170  28.675
  161    HB3  PHE  22           HB3      PHE  22 -30.517  23.534  29.255
  162    HD1  PHE  22           HD1      PHE  22 -31.486  26.976  30.499
  163    HD2  PHE  22           HD2      PHE  22 -31.742  22.738  31.170
  164    HE1  PHE  22           HE1      PHE  22 -33.009  27.364  32.404
  165    HE2  PHE  22           HE2      PHE  22 -33.500  23.115  32.859
  166    HZ   PHE  22           HZ       PHE  22 -34.071  25.437  33.553
  167    H    ILE  23           H        ILE  23 -28.194  22.594  30.051
  168    HA   ILE  23           HA       ILE  23 -28.432  22.212  32.915
  169    HB   ILE  23           HB       ILE  23 -26.729  20.775  30.805
  170   HG12  ILE  23          HG12      ILE  23 -29.256  19.770  32.280
  171   HG13  ILE  23          HG13      ILE  23 -29.370  20.643  30.747
  172   HG21  ILE  23          HG21      ILE  23 -26.349  18.985  32.484
  173   HG22  ILE  23          HG22      ILE  23 -25.628  20.522  32.995
  174   HG23  ILE  23          HG23      ILE  23 -27.167  19.982  33.731
  175   HD11  ILE  23          HD11      ILE  23 -27.944  17.937  31.135
  176   HD12  ILE  23          HD12      ILE  23 -29.468  18.248  30.273
  177   HD13  ILE  23          HD13      ILE  23 -27.941  18.900  29.625
  178    H    GLU  24           H        GLU  24 -25.756  23.409  30.743
  179    HA   GLU  24           HA       GLU  24 -23.805  23.539  32.826
  180    HB2  GLU  24           HB2      GLU  24 -23.361  23.998  30.261
  181    HB3  GLU  24           HB3      GLU  24 -23.990  25.627  30.577
  182    HG2  GLU  24           HG2      GLU  24 -21.561  25.679  30.697
  183    HG3  GLU  24           HG3      GLU  24 -22.223  25.959  32.332
  184    H    TRP  25           H        TRP  25 -26.323  25.867  31.624
  185    HA   TRP  25           HA       TRP  25 -25.596  27.986  33.345
  186    HB2  TRP  25           HB2      TRP  25 -27.171  28.176  31.403
  187    HB3  TRP  25           HB3      TRP  25 -28.402  27.273  32.301
  188    HD1  TRP  25           HD1      TRP  25 -26.395  30.619  32.589
  189    HE1  TRP  25           HE1      TRP  25 -27.864  32.311  33.739
  190    HE3  TRP  25           HE3      TRP  25 -30.467  27.596  33.684
  191    HZ2  TRP  25           HZ2      TRP  25 -30.298  32.456  34.946
  192    HZ3  TRP  25           HZ3      TRP  25 -32.337  28.637  34.988
  193    HH2  TRP  25           HH2      TRP  25 -32.292  31.056  35.517
  194    H    LEU  26           H        LEU  26 -28.053  25.304  33.937
  195    HA   LEU  26           HA       LEU  26 -28.584  26.243  36.642
  196    HB2  LEU  26           HB2      LEU  26 -28.859  23.446  35.464
  197    HB3  LEU  26           HB3      LEU  26 -29.456  23.939  37.069
  198    HG   LEU  26           HG       LEU  26 -30.476  25.108  34.398
  199   HD11  LEU  26          HD11      LEU  26 -32.583  23.787  35.051
  200   HD12  LEU  26          HD12      LEU  26 -31.173  22.773  34.628
  201   HD13  LEU  26          HD13      LEU  26 -31.634  23.023  36.343
  202   HD21  LEU  26          HD21      LEU  26 -32.332  26.074  35.837
  203   HD22  LEU  26          HD22      LEU  26 -31.451  25.553  37.302
  204   HD23  LEU  26          HD23      LEU  26 -30.768  26.795  36.218
  205    H    LYS  27           H        LYS  27 -26.437  23.545  35.436
  206    HA   LYS  27           HA       LYS  27 -25.333  22.813  37.921
  207    HB2  LYS  27           HB2      LYS  27 -24.833  21.748  35.667
  208    HB3  LYS  27           HB3      LYS  27 -23.929  23.204  35.211
  209    HG2  LYS  27           HG2      LYS  27 -22.383  22.663  37.294
  210    HG3  LYS  27           HG3      LYS  27 -23.206  21.085  37.311
  211    HD2  LYS  27           HD2      LYS  27 -21.249  20.663  35.978
  212    HD3  LYS  27           HD3      LYS  27 -22.536  20.920  34.770
  213    HE2  LYS  27           HE2      LYS  27 -21.737  23.385  34.620
  214    HE3  LYS  27           HE3      LYS  27 -20.427  22.958  35.736
  215    HZ1  LYS  27           HZ1      LYS  27 -19.643  22.922  33.422
  216    HZ2  LYS  27           HZ2      LYS  27 -19.616  21.303  33.954
  217    HZ3  LYS  27           HZ3      LYS  27 -20.873  21.843  32.917
  218    H    ASN  28           H        ASN  28 -24.599  25.633  35.844
  219    HA   ASN  28           HA       ASN  28 -22.314  26.464  37.498
  220    HB2  ASN  28           HB2      ASN  28 -22.470  26.639  34.999
  221    HB3  ASN  28           HB3      ASN  28 -23.780  27.856  35.182
  222   HD21  ASN  28          HD21      ASN  28 -22.055  28.667  33.535
  223   HD22  ASN  28          HD22      ASN  28 -20.864  29.706  34.219
  224    H    GLY  29           H        GLY  29 -25.561  26.620  38.419
  225    HA2  GLY  29           HA2      GLY  29 -25.773  28.015  40.407
  226    HA3  GLY  29           HA3      GLY  29 -25.235  29.436  39.487
  227    H    GLY  30           H        GLY  30 -26.969  28.197  37.061
  228    HA2  GLY  30           HA2      GLY  30 -29.127  28.646  36.295
  229    HA3  GLY  30           HA3      GLY  30 -29.655  28.438  37.966
  230    HA   PRO  31           HA       PRO  31 -30.164  33.075  37.214
  231    HB2  PRO  31           HB2      PRO  31 -30.789  32.631  40.190
  232    HB3  PRO  31           HB3      PRO  31 -31.553  33.815  39.082
  233    HG2  PRO  31           HG2      PRO  31 -32.879  31.509  39.554
  234    HG3  PRO  31           HG3      PRO  31 -32.637  31.995  37.843
  235    HD2  PRO  31           HD2      PRO  31 -30.987  29.946  39.455
  236    HD3  PRO  31           HD3      PRO  31 -31.690  29.749  37.808
  237    H    SER  32           H        SER  32 -28.488  31.462  40.039
  238    HA   SER  32           HA       SER  32 -26.819  33.756  40.546
  239    HB2  SER  32           HB2      SER  32 -26.326  30.828  41.307
  240    HB3  SER  32           HB3      SER  32 -25.530  32.242  42.041
  241    HG   SER  32           HG       SER  32 -27.737  32.853  42.788
  242    H    SER  33           H        SER  33 -26.594  31.348  37.948
  243    HA   SER  33           HA       SER  33 -23.776  31.288  37.644
  244    HB2  SER  33           HB2      SER  33 -25.361  29.979  36.204
  245    HB3  SER  33           HB3      SER  33 -25.915  31.501  35.438
  246    HG   SER  33           HG       SER  33 -24.160  30.435  34.203
  247    H    GLY  34           H        GLY  34 -26.153  33.932  36.942
  248    HA2  GLY  34           HA2      GLY  34 -25.349  36.194  37.179
  249    HA3  GLY  34           HA3      GLY  34 -23.777  35.743  36.500
  250    H    ALA  35           H        ALA  35 -24.663  34.127  34.253
  251    HA   ALA  35           HA       ALA  35 -25.418  36.290  32.454
  252    HB1  ALA  35           HB1      ALA  35 -25.419  34.438  30.704
  253    HB2  ALA  35           HB2      ALA  35 -23.922  34.453  31.674
  254    HB3  ALA  35           HB3      ALA  35 -25.195  33.242  32.004
  255    HA   PRO  36           HA       PRO  36 -29.873  35.252  32.770
  256    HB2  PRO  36           HB2      PRO  36 -30.814  35.995  30.248
  257    HB3  PRO  36           HB3      PRO  36 -30.197  37.208  31.423
  258    HG2  PRO  36           HG2      PRO  36 -28.596  35.834  29.204
  259    HG3  PRO  36           HG3      PRO  36 -28.863  37.596  29.378
  260    HD2  PRO  36           HD2      PRO  36 -26.604  36.471  30.383
  261    HD3  PRO  36           HD3      PRO  36 -27.479  37.646  31.434
  262    HA   PRO  37           HA       PRO  37 -29.570  31.179  31.323
  263    HB2  PRO  37           HB2      PRO  37 -32.160  30.246  30.746
  264    HB3  PRO  37           HB3      PRO  37 -31.630  30.709  32.375
  265    HG2  PRO  37           HG2      PRO  37 -33.058  32.514  30.382
  266    HG3  PRO  37           HG3      PRO  37 -33.579  32.147  32.053
  267    HD2  PRO  37           HD2      PRO  37 -32.152  34.429  31.526
  268    HD3  PRO  37           HD3      PRO  37 -31.685  33.458  32.975
  269    HA   PRO  38           HA       PRO  38 -29.791  31.103  26.710
  270    HB2  PRO  38           HB2      PRO  38 -29.063  28.537  26.208
  271    HB3  PRO  38           HB3      PRO  38 -27.931  29.628  27.046
  272    HG2  PRO  38           HG2      PRO  38 -29.793  27.611  28.376
  273    HG3  PRO  38           HG3      PRO  38 -28.019  27.752  28.595
  274    HD2  PRO  38           HD2      PRO  38 -29.857  28.953  30.334
  275    HD3  PRO  38           HD3      PRO  38 -28.289  29.751  29.958
  276    H    SER  39           H        SER  39 -32.189  31.551  27.445
  277    HA   SER  39           HA       SER  39 -33.934  29.573  26.184
  278    HB2  SER  39           HB2      SER  39 -33.550  28.547  28.493
  279    HB3  SER  39           HB3      SER  39 -34.204  30.041  29.216
  280    HG   SER  39           HG       SER  39 -35.905  28.376  28.865
  281    HN1  NH2  40           H11      SER  39 -36.361  30.259  26.485
  282    HN2  NH2  40           H12      SER  39 -36.635  31.966  26.560
  283    H03  D6M 101          H N2      LYS  14 -28.835  31.004  18.605
  284   H121  D6M 101          H101      LYS  14 -32.245  32.417  18.334
  285   H122  D6M 101          H102      LYS  14 -30.584  33.002  18.189
  286    H04  D6M 101           HC2      LYS  14 -29.954  28.498  17.427
  287   H051  D6M 101          HC31      LYS  14 -27.432  29.961  16.452
  288   H052  D6M 101          HC32      LYS  14 -28.957  29.864  15.548
  289   H061  D6M 101          HC41      LYS  14 -27.281  27.410  16.414
  290   H062  D6M 101          HC42      LYS  14 -27.208  28.161  14.800
  291   H131  D6M 101          H111      LYS  14 -31.511  33.093  20.548
  292   H132  D6M 101          H112      LYS  14 -29.992  32.183  20.415
  293   H141  D6M 101          H121      LYS  14 -31.527  31.005  21.915
  294   H142  D6M 101          H122      LYS  14 -31.222  30.010  20.474
  295   H151  D6M 101          H131      LYS  14 -33.436  30.674  19.524
  296   H152  D6M 101          H132      LYS  14 -33.730  31.777  20.895
  297   H161  D6M 101          H141      LYS  14 -33.761  29.854  22.469
  298   H162  D6M 101          H142      LYS  14 -33.334  28.726  21.153
  299   H171  D6M 101          H151      LYS  14 -35.474  29.346  19.964
  300   H172  D6M 101          H152      LYS  14 -35.935  30.390  21.335
  301   H181  D6M 101          H161      LYS  14 -35.452  27.336  21.495
  302   H182  D6M 101          H162      LYS  14 -37.040  28.119  21.316
  303   H191  D6M 101          H171      LYS  14 -36.703  29.309  23.519
  304   H192  D6M 101          H172      LYS  14 -35.189  28.398  23.765
  305   H201  D6M 101          H181      LYS  14 -36.491  26.224  23.587
  306   H202  D6M 101          H182      LYS  14 -37.989  27.170  23.386
  307   H211  D6M 101          H191      LYS  14 -37.539  28.241  25.670
  308   H212  D6M 101          H192      LYS  14 -36.161  27.124  25.869
  309   H221  D6M 101          H201      LYS  14 -37.793  25.171  25.613
  310   H222  D6M 101          H202      LYS  14 -39.123  26.346  25.458
  311   H231  D6M 101          H211      LYS  14 -38.575  27.246  27.759
  312   H232  D6M 101          H212      LYS  14 -37.314  25.992  27.929
  313   H241  D6M 101          H221      LYS  14 -39.038  24.193  27.712
  314   H242  D6M 101          H222      LYS  14 -40.313  25.417  27.443
  315   H251  D6M 101          H231      LYS  14 -39.856  26.367  29.740
  316   H252  D6M 101          H232      LYS  14 -38.644  25.090  30.014
  317   H261  D6M 101          H241      LYS  14 -40.806  24.442  31.070
  318   H262  D6M 101          H242      LYS  14 -41.665  24.662  29.517
  319   H263  D6M 101          H243      LYS  14 -40.478  23.338  29.701
  Start of MODEL    2
    1    H1   HIS   1           H1       HIS   1 -27.381  11.398  -0.579
    2    H2   HIS   1           H2       HIS   1 -25.990  11.382  -1.558
    3    H3   HIS   1           H3       HIS   1 -26.311  12.737  -0.596
    4    HA   HIS   1           HA       HIS   1 -25.569   9.955   0.427
    5    HB2  HIS   1           HB2      HIS   1 -23.638  11.153  -0.533
    6    HB3  HIS   1           HB3      HIS   1 -23.974  12.580   0.476
    7    HD1  HIS   1           HD1      HIS   1 -21.365  11.767   0.916
    8    HD2  HIS   1           HD2      HIS   1 -24.455   9.622   2.809
    9    HE1  HIS   1           HE1      HIS   1 -20.282  10.586   2.850
   10    H    DSN   2           HN       DSN   2 -27.719  10.100   1.670
   11    HA   DSN   2           HA       DSN   2 -27.028  10.994   4.325
   12    HB2  DSN   2           HB1      DSN   2 -29.154  10.159   5.053
   13    HB3  DSN   2           HB2      DSN   2 -28.580   9.017   3.818
   14    HG   DSN   2           HOG      DSN   2 -30.095  10.219   2.324
   15    H    GLN   3           H        GLN   3 -28.448  12.432   5.736
   16    HA   GLN   3           HA       GLN   3 -29.478  14.439   6.138
   17    HB2  GLN   3           HB2      GLN   3 -28.054  15.375   3.570
   18    HB3  GLN   3           HB3      GLN   3 -28.561  16.352   4.966
   19    HG2  GLN   3           HG2      GLN   3 -27.012  14.815   6.406
   20    HG3  GLN   3           HG3      GLN   3 -26.346  14.231   4.861
   21   HE21  GLN   3          HE21      GLN   3 -24.617  15.498   6.704
   22   HE22  GLN   3          HE22      GLN   3 -24.179  17.037   6.051
   23    H    GLY   4           H        GLY   4 -31.380  12.762   5.273
   24    HA2  GLY   4           HA2      GLY   4 -33.006  14.365   3.336
   25    HA3  GLY   4           HA3      GLY   4 -33.451  12.812   4.074
   26    H    THR   5           H        THR   5 -34.774  15.705   4.276
   27    HA   THR   5           HA       THR   5 -35.441  17.190   5.941
   28    HB   THR   5           HB       THR   5 -36.648  16.166   7.829
   29    HG1  THR   5           HG1      THR   5 -35.133  13.821   7.482
   30   HG21  THR   5          HG21      THR   5 -37.630  15.716   5.510
   31   HG22  THR   5          HG22      THR   5 -36.761  14.159   5.437
   32   HG23  THR   5          HG23      THR   5 -37.999  14.424   6.692
   33    H    PHE   6           H        PHE   6 -32.709  17.292   5.736
   34    HA   PHE   6           HA       PHE   6 -31.230  16.487   7.893
   35    HB2  PHE   6           HB2      PHE   6 -30.384  17.689   5.759
   36    HB3  PHE   6           HB3      PHE   6 -30.874  19.214   6.514
   37    HD1  PHE   6           HD1      PHE   6 -28.955  16.140   7.828
   38    HD2  PHE   6           HD2      PHE   6 -28.881  20.385   7.137
   39    HE1  PHE   6           HE1      PHE   6 -26.572  16.207   8.423
   40    HE2  PHE   6           HE2      PHE   6 -26.495  20.437   7.736
   41    HZ   PHE   6           HZ       PHE   6 -25.285  18.314   8.212
   42    H    THR   7           H        THR   7 -33.348  19.429   7.833
   43    HA   THR   7           HA       THR   7 -32.585  20.644  10.188
   44    HB   THR   7           HB       THR   7 -34.513  21.429   8.835
   45    HG1  THR   7           HG1      THR   7 -35.210  21.063  11.578
   46   HG21  THR   7          HG21      THR   7 -36.198  19.207  10.211
   47   HG22  THR   7          HG22      THR   7 -36.781  20.461   9.097
   48   HG23  THR   7          HG23      THR   7 -35.698  19.174   8.500
   49    H    SER   8           H        SER   8 -34.232  17.383   9.964
   50    HA   SER   8           HA       SER   8 -34.850  17.370  12.811
   51    HB2  SER   8           HB2      SER   8 -36.048  15.891  11.240
   52    HB3  SER   8           HB3      SER   8 -34.533  15.011  10.875
   53    HG   SER   8           HG       SER   8 -35.755  13.981  12.665
   54    H    ASP   9           H        ASP   9 -32.130  15.912  10.785
   55    HA   ASP   9           HA       ASP   9 -30.776  14.922  13.058
   56    HB2  ASP   9           HB2      ASP   9 -29.766  15.693  10.272
   57    HB3  ASP   9           HB3      ASP   9 -28.596  15.457  11.573
   58    H    LEU  10           H        LEU  10 -30.914  18.305  11.812
   59    HA   LEU  10           HA       LEU  10 -28.782  18.995  13.798
   60    HB2  LEU  10           HB2      LEU  10 -30.233  20.582  11.663
   61    HB3  LEU  10           HB3      LEU  10 -29.387  21.401  13.004
   62    HG   LEU  10           HG       LEU  10 -27.241  20.302  12.454
   63   HD11  LEU  10          HD11      LEU  10 -28.706  18.897  10.162
   64   HD12  LEU  10          HD12      LEU  10 -26.933  18.949  10.452
   65   HD13  LEU  10          HD13      LEU  10 -27.977  18.105  11.598
   66   HD21  LEU  10          HD21      LEU  10 -28.549  21.523   9.950
   67   HD22  LEU  10          HD22      LEU  10 -27.860  22.461  11.308
   68   HD23  LEU  10          HD23      LEU  10 -26.796  21.437  10.303
   69    H    SER  11           H        SER  11 -32.423  19.190  13.631
   70    HA   SER  11           HA       SER  11 -32.586  21.047  15.792
   71    HB2  SER  11           HB2      SER  11 -34.522  18.809  15.020
   72    HB3  SER  11           HB3      SER  11 -34.861  20.083  16.237
   73    HG   SER  11           HG       SER  11 -35.596  20.678  14.024
   74    H    LYS  12           H        LYS  12 -32.299  17.405  15.779
   75    HA   LYS  12           HA       LYS  12 -32.426  17.221  18.646
   76    HB2  LYS  12           HB2      LYS  12 -31.605  14.995  18.457
   77    HB3  LYS  12           HB3      LYS  12 -32.660  15.259  17.042
   78    HG2  LYS  12           HG2      LYS  12 -30.515  15.836  15.734
   79    HG3  LYS  12           HG3      LYS  12 -29.569  15.182  17.100
   80    HD2  LYS  12           HD2      LYS  12 -30.833  12.957  16.783
   81    HD3  LYS  12           HD3      LYS  12 -31.625  13.706  15.370
   82    HE2  LYS  12           HE2      LYS  12 -29.115  14.200  14.586
   83    HE3  LYS  12           HE3      LYS  12 -28.633  12.966  15.751
   84    HZ1  LYS  12           HZ1      LYS  12 -30.002  11.273  14.495
   85    HZ2  LYS  12           HZ2      LYS  12 -30.591  12.519  13.446
   86    HZ3  LYS  12           HZ3      LYS  12 -29.052  12.202  13.294
   87    H    GLN  13           H        GLN  13 -29.667  18.029  16.438
   88    HA   GLN  13           HA       GLN  13 -27.688  17.779  18.591
   89    HB2  GLN  13           HB2      GLN  13 -27.555  19.294  15.917
   90    HB3  GLN  13           HB3      GLN  13 -26.212  19.116  17.071
   91    HG2  GLN  13           HG2      GLN  13 -26.253  16.639  16.817
   92    HG3  GLN  13           HG3      GLN  13 -27.660  16.743  15.743
   93   HE21  GLN  13          HE21      GLN  13 -24.156  17.754  16.084
   94   HE22  GLN  13          HE22      GLN  13 -23.867  17.806  14.385
   95    H    LYS  14           HN       LYS  14 -29.565  20.517  17.064
   96    HA   LYS  14           HA       LYS  14 -28.477  22.588  18.716
   97    HB2  LYS  14           HB2      LYS  14 -31.321  22.248  17.578
   98    HB3  LYS  14           HB3      LYS  14 -30.705  23.709  18.398
   99    HG2  LYS  14          HC81      LYS  14 -28.942  23.947  16.643
  100    HG3  LYS  14          HC82      LYS  14 -29.577  22.539  15.769
  101    HD2  LYS  14          HC71      LYS  14 -31.833  23.733  15.544
  102    HD3  LYS  14          HC72      LYS  14 -31.111  25.179  16.306
  103    HE2  LYS  14          HC61      LYS  14 -30.174  23.872  13.695
  104    HE3  LYS  14          HC62      LYS  14 -31.131  25.360  13.834
  105    HZ1  LYS  14          H N1      LYS  14 -28.252  25.029  14.451
  106    H    ASP  15           H        ASP  15 -31.197  20.213  19.279
  107    HA   ASP  15           HA       ASP  15 -31.995  21.367  21.769
  108    HB2  ASP  15           HB2      ASP  15 -33.401  19.675  20.513
  109    HB3  ASP  15           HB3      ASP  15 -32.184  18.417  20.865
  110    H    SER  16           H        SER  16 -29.626  18.644  20.900
  111    HA   SER  16           HA       SER  16 -28.993  18.114  23.628
  112    HB2  SER  16           HB2      SER  16 -28.213  16.593  21.894
  113    HB3  SER  16           HB3      SER  16 -27.159  17.860  21.190
  114    HG   SER  16           HG       SER  16 -25.970  16.480  22.765
  115    H    ARG  17           H        ARG  17 -27.483  20.478  21.240
  116    HA   ARG  17           HA       ARG  17 -25.467  21.265  23.094
  117    HB2  ARG  17           HB2      ARG  17 -25.587  21.661  20.482
  118    HB3  ARG  17           HB3      ARG  17 -26.667  23.007  20.885
  119    HG2  ARG  17           HG2      ARG  17 -24.566  23.552  22.616
  120    HG3  ARG  17           HG3      ARG  17 -23.689  22.539  21.459
  121    HD2  ARG  17           HD2      ARG  17 -23.424  24.841  20.607
  122    HD3  ARG  17           HD3      ARG  17 -24.602  23.967  19.580
  123    HE   ARG  17           HE       ARG  17 -25.764  25.456  21.893
  124   HH11  ARG  17          HH11      ARG  17 -26.927  27.308  21.566
  125   HH12  ARG  17          HH12      ARG  17 -26.892  28.141  20.016
  126   HH21  ARG  17          HH21      ARG  17 -24.562  25.982  18.531
  127   HH22  ARG  17          HH22      ARG  17 -25.591  27.395  18.332
  128    H    ARG  18           H        ARG  18 -28.716  22.789  22.278
  129    HA   ARG  18           HA       ARG  18 -28.312  24.933  24.177
  130    HB2  ARG  18           HB2      ARG  18 -30.864  23.681  23.011
  131    HB3  ARG  18           HB3      ARG  18 -30.927  25.061  24.124
  132    HG2  ARG  18           HG2      ARG  18 -29.294  25.205  21.525
  133    HG3  ARG  18           HG3      ARG  18 -31.029  25.627  21.585
  134    HD2  ARG  18           HD2      ARG  18 -30.644  27.365  23.265
  135    HD3  ARG  18           HD3      ARG  18 -28.884  26.996  23.287
  136    HE   ARG  18           HE       ARG  18 -29.674  27.551  20.581
  137   HH11  ARG  18          HH11      ARG  18 -29.113  29.505  19.673
  138   HH12  ARG  18          HH12      ARG  18 -28.834  30.932  20.673
  139   HH21  ARG  18          HH21      ARG  18 -29.337  29.273  23.744
  140   HH22  ARG  18          HH22      ARG  18 -28.921  30.779  22.947
  141    H    ALA  19           H        ALA  19 -29.936  21.702  24.399
  142    HA   ALA  19           HA       ALA  19 -30.909  22.086  27.054
  143    HB1  ALA  19           HB1      ALA  19 -30.024  19.472  25.650
  144    HB2  ALA  19           HB2      ALA  19 -31.054  19.583  27.105
  145    HB3  ALA  19           HB3      ALA  19 -31.646  20.213  25.539
  146    H    GLN  20           H        GLN  20 -27.773  20.636  25.844
  147    HA   GLN  20           HA       GLN  20 -26.788  20.222  28.527
  148    HB2  GLN  20           HB2      GLN  20 -25.317  20.379  25.835
  149    HB3  GLN  20           HB3      GLN  20 -24.529  20.049  27.391
  150    HG2  GLN  20           HG2      GLN  20 -26.014  18.050  27.758
  151    HG3  GLN  20           HG3      GLN  20 -26.767  18.302  26.165
  152   HE21  GLN  20          HE21      GLN  20 -25.894  15.889  26.119
  153   HE22  GLN  20          HE22      GLN  20 -24.289  15.712  25.512
  154    H    ASP  21           H        ASP  21 -26.559  23.001  26.231
  155    HA   ASP  21           HA       ASP  21 -24.556  24.404  27.823
  156    HB2  ASP  21           HB2      ASP  21 -25.055  24.815  25.362
  157    HB3  ASP  21           HB3      ASP  21 -26.630  25.514  25.844
  158    H    PHE  22           H        PHE  22 -28.190  24.438  27.651
  159    HA   PHE  22           HA       PHE  22 -28.509  26.513  29.640
  160    HB2  PHE  22           HB2      PHE  22 -30.299  25.845  28.066
  161    HB3  PHE  22           HB3      PHE  22 -30.394  24.229  28.809
  162    HD1  PHE  22           HD1      PHE  22 -30.863  27.895  29.490
  163    HD2  PHE  22           HD2      PHE  22 -31.582  23.893  30.902
  164    HE1  PHE  22           HE1      PHE  22 -32.326  28.783  31.285
  165    HE2  PHE  22           HE2      PHE  22 -33.259  24.769  32.492
  166    HZ   PHE  22           HZ       PHE  22 -33.521  27.218  32.796
  167    H    ILE  23           H        ILE  23 -28.357  22.857  29.784
  168    HA   ILE  23           HA       ILE  23 -28.656  22.804  32.679
  169    HB   ILE  23           HB       ILE  23 -27.416  20.862  30.710
  170   HG12  ILE  23          HG12      ILE  23 -29.976  20.541  32.401
  171   HG13  ILE  23          HG13      ILE  23 -29.995  21.322  30.813
  172   HG21  ILE  23          HG21      ILE  23 -27.354  19.179  32.631
  173   HG22  ILE  23          HG22      ILE  23 -26.238  20.527  32.870
  174   HG23  ILE  23          HG23      ILE  23 -27.789  20.496  33.752
  175   HD11  ILE  23          HD11      ILE  23 -29.071  19.227  29.741
  176   HD12  ILE  23          HD12      ILE  23 -29.154  18.393  31.317
  177   HD13  ILE  23          HD13      ILE  23 -30.645  18.963  30.535
  178    H    GLU  24           H        GLU  24 -25.769  23.245  30.472
  179    HA   GLU  24           HA       GLU  24 -23.853  23.107  32.560
  180    HB2  GLU  24           HB2      GLU  24 -23.318  23.385  30.031
  181    HB3  GLU  24           HB3      GLU  24 -23.641  25.128  30.248
  182    HG2  GLU  24           HG2      GLU  24 -21.283  24.860  30.456
  183    HG3  GLU  24           HG3      GLU  24 -21.908  25.188  32.088
  184    H    TRP  25           H        TRP  25 -25.864  25.860  31.257
  185    HA   TRP  25           HA       TRP  25 -24.870  27.814  33.080
  186    HB2  TRP  25           HB2      TRP  25 -26.128  28.424  31.125
  187    HB3  TRP  25           HB3      TRP  25 -27.598  27.606  31.702
  188    HD1  TRP  25           HD1      TRP  25 -25.457  30.709  32.615
  189    HE1  TRP  25           HE1      TRP  25 -26.968  32.351  33.824
  190    HE3  TRP  25           HE3      TRP  25 -29.727  27.785  33.047
  191    HZ2  TRP  25           HZ2      TRP  25 -29.492  32.475  34.859
  192    HZ3  TRP  25           HZ3      TRP  25 -31.706  28.813  34.200
  193    HH2  TRP  25           HH2      TRP  25 -31.614  31.156  34.980
  194    H    LEU  26           H        LEU  26 -27.662  25.443  33.547
  195    HA   LEU  26           HA       LEU  26 -28.197  26.459  36.212
  196    HB2  LEU  26           HB2      LEU  26 -28.638  23.629  35.129
  197    HB3  LEU  26           HB3      LEU  26 -29.220  24.217  36.696
  198    HG   LEU  26           HG       LEU  26 -30.132  25.314  33.965
  199   HD11  LEU  26          HD11      LEU  26 -32.288  24.116  34.558
  200   HD12  LEU  26          HD12      LEU  26 -30.914  23.003  34.332
  201   HD13  LEU  26          HD13      LEU  26 -31.474  23.426  35.981
  202   HD21  LEU  26          HD21      LEU  26 -30.383  27.093  35.718
  203   HD22  LEU  26          HD22      LEU  26 -31.974  26.420  35.354
  204   HD23  LEU  26          HD23      LEU  26 -31.126  25.931  36.843
  205    H    LYS  27           H        LYS  27 -26.248  23.573  35.178
  206    HA   LYS  27           HA       LYS  27 -25.261  22.840  37.710
  207    HB2  LYS  27           HB2      LYS  27 -24.801  21.640  35.517
  208    HB3  LYS  27           HB3      LYS  27 -23.792  23.009  35.018
  209    HG2  LYS  27           HG2      LYS  27 -22.230  22.446  37.064
  210    HG3  LYS  27           HG3      LYS  27 -23.253  21.007  37.286
  211    HD2  LYS  27           HD2      LYS  27 -21.414  20.219  35.994
  212    HD3  LYS  27           HD3      LYS  27 -22.676  20.480  34.762
  213    HE2  LYS  27           HE2      LYS  27 -21.575  22.837  34.370
  214    HE3  LYS  27           HE3      LYS  27 -20.262  22.295  35.427
  215    HZ1  LYS  27           HZ1      LYS  27 -19.662  21.896  33.079
  216    HZ2  LYS  27           HZ2      LYS  27 -19.883  20.359  33.791
  217    HZ3  LYS  27           HZ3      LYS  27 -21.112  21.011  32.798
  218    H    ASN  28           H        ASN  28 -24.263  25.515  35.511
  219    HA   ASN  28           HA       ASN  28 -21.959  26.248  37.254
  220    HB2  ASN  28           HB2      ASN  28 -21.994  26.049  34.755
  221    HB3  ASN  28           HB3      ASN  28 -23.055  27.504  34.705
  222   HD21  ASN  28          HD21      ASN  28 -21.098  27.815  33.102
  223   HD22  ASN  28          HD22      ASN  28 -19.815  28.737  33.794
  224    H    GLY  29           H        GLY  29 -25.095  26.667  38.047
  225    HA2  GLY  29           HA2      GLY  29 -25.101  28.344  39.952
  226    HA3  GLY  29           HA3      GLY  29 -24.720  29.583  38.739
  227    H    GLY  30           H        GLY  30 -26.499  28.574  36.555
  228    HA2  GLY  30           HA2      GLY  30 -28.771  28.876  35.983
  229    HA3  GLY  30           HA3      GLY  30 -29.168  28.403  37.658
  230    HA   PRO  31           HA       PRO  31 -30.156  32.992  37.254
  231    HB2  PRO  31           HB2      PRO  31 -31.343  32.096  39.954
  232    HB3  PRO  31           HB3      PRO  31 -31.990  33.314  38.801
  233    HG2  PRO  31           HG2      PRO  31 -33.097  30.830  38.775
  234    HG3  PRO  31           HG3      PRO  31 -32.589  31.546  37.220
  235    HD2  PRO  31           HD2      PRO  31 -31.010  29.515  38.908
  236    HD3  PRO  31           HD3      PRO  31 -31.358  29.471  37.138
  237    H    SER  32           H        SER  32 -28.962  31.090  40.174
  238    HA   SER  32           HA       SER  32 -27.723  33.348  41.456
  239    HB2  SER  32           HB2      SER  32 -26.749  30.450  41.502
  240    HB3  SER  32           HB3      SER  32 -26.403  31.711  42.714
  241    HG   SER  32           HG       SER  32 -28.759  31.688  43.191
  242    H    SER  33           H        SER  33 -26.677  31.555  38.531
  243    HA   SER  33           HA       SER  33 -23.927  32.159  38.602
  244    HB2  SER  33           HB2      SER  33 -25.023  30.960  36.629
  245    HB3  SER  33           HB3      SER  33 -25.840  32.483  36.191
  246    HG   SER  33           HG       SER  33 -22.989  32.167  36.190
  247    H    GLY  34           H        GLY  34 -26.800  34.322  37.885
  248    HA2  GLY  34           HA2      GLY  34 -26.707  36.705  38.144
  249    HA3  GLY  34           HA3      GLY  34 -24.933  36.693  38.004
  250    H    ALA  35           H        ALA  35 -24.512  35.030  35.683
  251    HA   ALA  35           HA       ALA  35 -25.158  36.899  33.635
  252    HB1  ALA  35           HB1      ALA  35 -24.380  35.093  32.032
  253    HB2  ALA  35           HB2      ALA  35 -23.251  35.301  33.412
  254    HB3  ALA  35           HB3      ALA  35 -24.393  33.916  33.385
  255    HA   PRO  36           HA       PRO  36 -29.346  35.350  32.986
  256    HB2  PRO  36           HB2      PRO  36 -29.935  36.254  30.381
  257    HB3  PRO  36           HB3      PRO  36 -29.649  37.401  31.721
  258    HG2  PRO  36           HG2      PRO  36 -27.516  36.373  29.767
  259    HG3  PRO  36           HG3      PRO  36 -27.986  38.083  30.071
  260    HD2  PRO  36           HD2      PRO  36 -25.847  36.997  31.338
  261    HD3  PRO  36           HD3      PRO  36 -26.990  38.028  32.289
  262    HA   PRO  37           HA       PRO  37 -28.649  31.462  31.120
  263    HB2  PRO  37           HB2      PRO  37 -31.128  30.682  29.994
  264    HB3  PRO  37           HB3      PRO  37 -30.856  30.860  31.748
  265    HG2  PRO  37           HG2      PRO  37 -31.939  32.987  29.846
  266    HG3  PRO  37           HG3      PRO  37 -32.764  32.360  31.298
  267    HD2  PRO  37           HD2      PRO  37 -31.312  34.649  31.492
  268    HD3  PRO  37           HD3      PRO  37 -31.047  33.408  32.758
  269    HA   PRO  38           HA       PRO  38 -27.708  31.974  26.751
  270    HB2  PRO  38           HB2      PRO  38 -27.442  29.356  25.875
  271    HB3  PRO  38           HB3      PRO  38 -26.370  30.084  27.106
  272    HG2  PRO  38           HG2      PRO  38 -28.877  28.401  27.641
  273    HG3  PRO  38           HG3      PRO  38 -27.203  28.066  28.208
  274    HD2  PRO  38           HD2      PRO  38 -28.974  29.372  29.825
  275    HD3  PRO  38           HD3      PRO  38 -27.294  29.997  29.738
  276    H    SER  39           H        SER  39 -30.084  32.889  26.827
  277    HA   SER  39           HA       SER  39 -31.797  31.339  24.869
  278    HB2  SER  39           HB2      SER  39 -32.618  31.079  27.210
  279    HB3  SER  39           HB3      SER  39 -32.733  32.847  27.383
  280    HG   SER  39           HG       SER  39 -34.307  32.770  25.600
  281    HN1  NH2  40           H11      SER  39 -30.334  33.008  23.442
  282    HN2  NH2  40           H12      SER  39 -31.133  34.516  23.212
  283    H03  D6M 101          H N2      LYS  14 -28.021  31.308  17.408
  284   H121  D6M 101          H101      LYS  14 -28.892  33.391  16.537
  285   H122  D6M 101          H102      LYS  14 -30.508  33.129  17.247
  286    H04  D6M 101           HC2      LYS  14 -29.456  28.839  16.847
  287   H051  D6M 101          HC31      LYS  14 -26.969  29.534  15.176
  288   H052  D6M 101          HC32      LYS  14 -28.608  29.509  14.514
  289   H061  D6M 101          HC41      LYS  14 -27.272  27.044  15.796
  290   H062  D6M 101          HC42      LYS  14 -27.270  27.415  14.050
  291   H131  D6M 101          H111      LYS  14 -30.672  34.601  15.233
  292   H132  D6M 101          H112      LYS  14 -31.505  33.055  14.934
  293   H141  D6M 101          H121      LYS  14 -29.341  32.224  13.784
  294   H142  D6M 101          H122      LYS  14 -28.690  33.874  13.954
  295   H151  D6M 101          H131      LYS  14 -30.609  34.754  12.561
  296   H152  D6M 101          H132      LYS  14 -31.288  33.106  12.468
  297   H161  D6M 101          H141      LYS  14 -29.143  32.333  11.358
  298   H162  D6M 101          H142      LYS  14 -28.582  34.032  11.289
  299   H171  D6M 101          H151      LYS  14 -30.688  34.599   9.953
  300   H172  D6M 101          H152      LYS  14 -31.123  32.872   9.988
  301   H181  D6M 101          H161      LYS  14 -28.671  34.128   8.597
  302   H182  D6M 101          H162      LYS  14 -30.096  33.407   7.820
  303   H191  D6M 101          H171      LYS  14 -29.457  31.176   9.018
  304   H192  D6M 101          H172      LYS  14 -27.884  31.950   9.390
  305   H201  D6M 101          H181      LYS  14 -27.521  32.316   6.913
  306   H202  D6M 101          H182      LYS  14 -29.078  31.498   6.602
  307   H211  D6M 101          H191      LYS  14 -28.141  29.427   7.831
  308   H212  D6M 101          H192      LYS  14 -26.589  30.289   7.952
  309   H221  D6M 101          H201      LYS  14 -26.433  28.759   6.102
  310   H222  D6M 101          H202      LYS  14 -26.493  30.392   5.394
  311   H231  D6M 101          H211      LYS  14 -28.874  30.051   4.738
  312   H232  D6M 101          H212      LYS  14 -28.940  28.529   5.674
  313   H241  D6M 101          H221      LYS  14 -27.206  27.532   4.139
  314   H242  D6M 101          H222      LYS  14 -27.172  29.043   3.198
  315   H251  D6M 101          H231      LYS  14 -29.558  28.729   2.548
  316   H252  D6M 101          H232      LYS  14 -29.696  27.288   3.595
  317   H261  D6M 101          H241      LYS  14 -29.361  26.639   1.189
  318   H262  D6M 101          H242      LYS  14 -27.799  27.513   1.174
  319   H263  D6M 101          H243      LYS  14 -28.010  26.074   2.214
  Start of MODEL    3
    1    H1   HIS   1           H1       HIS   1 -33.693  22.240  -1.987
    2    H2   HIS   1           H2       HIS   1 -34.953  21.627  -0.972
    3    H3   HIS   1           H3       HIS   1 -35.376  22.226  -2.533
    4    HA   HIS   1           HA       HIS   1 -35.318  19.713  -2.468
    5    HB2  HIS   1           HB2      HIS   1 -34.780  20.755  -4.661
    6    HB3  HIS   1           HB3      HIS   1 -33.086  21.012  -4.168
    7    HD1  HIS   1           HD1      HIS   1 -31.649  18.821  -3.826
    8    HD2  HIS   1           HD2      HIS   1 -35.431  18.277  -5.585
    9    HE1  HIS   1           HE1      HIS   1 -31.584  16.522  -4.837
   10    H    DSN   2           HN       DSN   2 -33.908  17.710  -2.062
   11    HA   DSN   2           HA       DSN   2 -31.247  18.102  -1.039
   12    HB2  DSN   2           HB1      DSN   2 -31.489  15.734  -0.188
   13    HB3  DSN   2           HB2      DSN   2 -32.032  15.889  -1.890
   14    HG   DSN   2           HOG      DSN   2 -33.653  14.755  -0.533
   15    H    GLN   3           H        GLN   3 -30.600  17.599   1.333
   16    HA   GLN   3           HA       GLN   3 -30.856  18.045   3.609
   17    HB2  GLN   3           HB2      GLN   3 -32.463  20.383   2.415
   18    HB3  GLN   3           HB3      GLN   3 -31.720  20.357   4.028
   19    HG2  GLN   3           HG2      GLN   3 -29.439  20.137   3.026
   20    HG3  GLN   3           HG3      GLN   3 -30.146  20.173   1.386
   21   HE21  GLN   3          HE21      GLN   3 -31.537  22.212   0.837
   22   HE22  GLN   3          HE22      GLN   3 -31.004  23.694   1.545
   23    H    GLY   4           H        GLY   4 -32.701  15.983   2.851
   24    HA2  GLY   4           HA2      GLY   4 -35.350  16.597   3.643
   25    HA3  GLY   4           HA3      GLY   4 -34.619  14.981   3.754
   26    H    THR   5           H        THR   5 -36.268  16.922   5.805
   27    HA   THR   5           HA       THR   5 -36.110  17.370   8.098
   28    HB   THR   5           HB       THR   5 -35.525  15.270   9.401
   29    HG1  THR   5           HG1      THR   5 -33.875  14.448   7.837
   30   HG21  THR   5          HG21      THR   5 -37.819  15.578   8.443
   31   HG22  THR   5          HG22      THR   5 -37.276  14.798   6.923
   32   HG23  THR   5          HG23      THR   5 -37.318  13.861   8.444
   33    H    PHE   6           H        PHE   6 -33.688  18.394   6.561
   34    HA   PHE   6           HA       PHE   6 -31.435  17.867   8.246
   35    HB2  PHE   6           HB2      PHE   6 -31.259  18.803   5.990
   36    HB3  PHE   6           HB3      PHE   6 -32.055  20.320   6.494
   37    HD1  PHE   6           HD1      PHE   6 -29.082  18.100   7.222
   38    HD2  PHE   6           HD2      PHE   6 -30.694  22.091   7.446
   39    HE1  PHE   6           HE1      PHE   6 -26.814  18.997   7.653
   40    HE2  PHE   6           HE2      PHE   6 -28.413  22.992   7.775
   41    HZ   PHE   6           HZ       PHE   6 -26.468  21.450   7.869
   42    H    THR   7           H        THR   7 -33.951  20.603   8.350
   43    HA   THR   7           HA       THR   7 -32.661  21.815  10.595
   44    HB   THR   7           HB       THR   7 -34.435  22.934   9.182
   45    HG1  THR   7           HG1      THR   7 -34.683  23.092  12.040
   46   HG21  THR   7          HG21      THR   7 -36.392  21.459  11.081
   47   HG22  THR   7          HG22      THR   7 -36.799  22.725   9.896
   48   HG23  THR   7          HG23      THR   7 -36.228  21.126   9.331
   49    H    SER   8           H        SER   8 -34.901  18.967  10.369
   50    HA   SER   8           HA       SER   8 -35.598  19.027  13.148
   51    HB2  SER   8           HB2      SER   8 -35.291  16.503  11.433
   52    HB3  SER   8           HB3      SER   8 -36.335  16.727  12.852
   53    HG   SER   8           HG       SER   8 -37.544  18.282  11.452
   54    H    ASP   9           H        ASP   9 -32.846  17.472  11.242
   55    HA   ASP   9           HA       ASP   9 -31.824  16.225  13.627
   56    HB2  ASP   9           HB2      ASP   9 -31.169  15.617  11.173
   57    HB3  ASP   9           HB3      ASP   9 -30.005  16.971  11.257
   58    H    LEU  10           H        LEU  10 -30.974  19.361  11.875
   59    HA   LEU  10           HA       LEU  10 -29.027  20.070  13.856
   60    HB2  LEU  10           HB2      LEU  10 -30.669  21.786  11.947
   61    HB3  LEU  10           HB3      LEU  10 -29.750  22.547  13.262
   62    HG   LEU  10           HG       LEU  10 -27.625  21.581  12.513
   63   HD11  LEU  10          HD11      LEU  10 -29.177  20.376  10.137
   64   HD12  LEU  10          HD12      LEU  10 -27.401  20.385  10.355
   65   HD13  LEU  10          HD13      LEU  10 -28.415  19.436  11.455
   66   HD21  LEU  10          HD21      LEU  10 -29.180  23.017  10.277
   67   HD22  LEU  10          HD22      LEU  10 -28.316  23.796  11.634
   68   HD23  LEU  10          HD23      LEU  10 -27.396  22.905  10.391
   69    H    SER  11           H        SER  11 -32.653  20.279  13.958
   70    HA   SER  11           HA       SER  11 -32.661  21.918  16.298
   71    HB2  SER  11           HB2      SER  11 -34.717  19.734  15.617
   72    HB3  SER  11           HB3      SER  11 -34.848  20.976  16.882
   73    HG   SER  11           HG       SER  11 -34.679  21.544  14.070
   74    H    LYS  12           H        LYS  12 -32.383  18.241  15.927
   75    HA   LYS  12           HA       LYS  12 -32.321  17.951  18.780
   76    HB2  LYS  12           HB2      LYS  12 -31.859  15.712  18.582
   77    HB3  LYS  12           HB3      LYS  12 -32.670  16.007  17.026
   78    HG2  LYS  12           HG2      LYS  12 -30.377  16.073  15.949
   79    HG3  LYS  12           HG3      LYS  12 -29.611  15.803  17.539
   80    HD2  LYS  12           HD2      LYS  12 -30.870  13.605  17.711
   81    HD3  LYS  12           HD3      LYS  12 -31.428  13.839  16.033
   82    HE2  LYS  12           HE2      LYS  12 -28.483  13.638  16.971
   83    HE3  LYS  12           HE3      LYS  12 -29.412  12.335  16.204
   84    HZ1  LYS  12           HZ1      LYS  12 -27.986  13.491  14.478
   85    HZ2  LYS  12           HZ2      LYS  12 -29.643  13.607  14.181
   86    HZ3  LYS  12           HZ3      LYS  12 -28.670  14.972  14.811
   87    H    GLN  13           H        GLN  13 -29.723  18.535  16.313
   88    HA   GLN  13           HA       GLN  13 -27.587  18.053  18.197
   89    HB2  GLN  13           HB2      GLN  13 -27.532  19.999  15.802
   90    HB3  GLN  13           HB3      GLN  13 -26.131  19.385  16.691
   91    HG2  GLN  13           HG2      GLN  13 -28.000  17.786  14.853
   92    HG3  GLN  13           HG3      GLN  13 -26.288  18.142  14.608
   93   HE21  GLN  13          HE21      GLN  13 -24.835  17.306  16.721
   94   HE22  GLN  13          HE22      GLN  13 -25.229  15.684  17.151
   95    H    LYS  14           HN       LYS  14 -29.449  21.024  17.227
   96    HA   LYS  14           HA       LYS  14 -28.001  22.757  19.032
   97    HB2  LYS  14           HB2      LYS  14 -30.822  22.988  17.813
   98    HB3  LYS  14           HB3      LYS  14 -30.076  24.230  18.851
   99    HG2  LYS  14          HC81      LYS  14 -28.150  24.412  17.294
  100    HG3  LYS  14          HC82      LYS  14 -28.887  23.254  16.167
  101    HD2  LYS  14          HC71      LYS  14 -30.886  24.765  15.903
  102    HD3  LYS  14          HC72      LYS  14 -30.142  25.934  17.027
  103    HE2  LYS  14          HC61      LYS  14 -29.037  25.078  14.290
  104    HE3  LYS  14          HC62      LYS  14 -29.814  26.626  14.654
  105    HZ1  LYS  14          H N1      LYS  14 -27.083  25.764  15.443
  106    H    ASP  15           H        ASP  15 -30.813  20.503  19.469
  107    HA   ASP  15           HA       ASP  15 -31.475  21.655  22.021
  108    HB2  ASP  15           HB2      ASP  15 -33.019  20.045  20.574
  109    HB3  ASP  15           HB3      ASP  15 -32.102  18.729  21.328
  110    H    SER  16           H        SER  16 -29.328  18.892  20.878
  111    HA   SER  16           HA       SER  16 -28.681  18.005  23.513
  112    HB2  SER  16           HB2      SER  16 -27.939  16.721  21.487
  113    HB3  SER  16           HB3      SER  16 -26.878  18.064  21.003
  114    HG   SER  16           HG       SER  16 -26.533  16.561  23.427
  115    H    ARG  17           H        ARG  17 -27.245  20.614  21.399
  116    HA   ARG  17           HA       ARG  17 -25.237  21.334  23.329
  117    HB2  ARG  17           HB2      ARG  17 -25.007  21.938  20.977
  118    HB3  ARG  17           HB3      ARG  17 -26.551  22.830  20.972
  119    HG2  ARG  17           HG2      ARG  17 -25.754  24.449  22.592
  120    HG3  ARG  17           HG3      ARG  17 -24.158  23.646  22.672
  121    HD2  ARG  17           HD2      ARG  17 -23.740  24.273  20.299
  122    HD3  ARG  17           HD3      ARG  17 -25.442  24.844  20.147
  123    HE   ARG  17           HE       ARG  17 -24.094  26.225  22.317
  124   HH11  ARG  17          HH11      ARG  17 -23.765  28.424  22.078
  125   HH12  ARG  17          HH12      ARG  17 -23.761  29.148  20.465
  126   HH21  ARG  17          HH21      ARG  17 -24.251  26.163  18.719
  127   HH22  ARG  17          HH22      ARG  17 -23.985  27.902  18.629
  128    H    ARG  18           H        ARG  18 -28.459  22.915  22.567
  129    HA   ARG  18           HA       ARG  18 -28.230  24.872  24.647
  130    HB2  ARG  18           HB2      ARG  18 -30.664  23.474  23.425
  131    HB3  ARG  18           HB3      ARG  18 -30.814  24.770  24.628
  132    HG2  ARG  18           HG2      ARG  18 -29.172  25.287  22.077
  133    HG3  ARG  18           HG3      ARG  18 -30.943  25.411  22.048
  134    HD2  ARG  18           HD2      ARG  18 -30.970  27.075  23.835
  135    HD3  ARG  18           HD3      ARG  18 -29.233  27.019  24.060
  136    HE   ARG  18           HE       ARG  18 -30.857  28.315  21.926
  137   HH11  ARG  18          HH11      ARG  18 -29.851  29.653  20.467
  138   HH12  ARG  18          HH12      ARG  18 -28.102  29.593  20.265
  139   HH21  ARG  18          HH21      ARG  18 -27.526  27.080  22.611
  140   HH22  ARG  18          HH22      ARG  18 -26.833  28.168  21.413
  141    H    ALA  19           H        ALA  19 -29.551  21.500  24.670
  142    HA   ALA  19           HA       ALA  19 -30.528  21.616  27.342
  143    HB1  ALA  19           HB1      ALA  19 -29.531  19.181  25.728
  144    HB2  ALA  19           HB2      ALA  19 -30.534  19.117  27.204
  145    HB3  ALA  19           HB3      ALA  19 -31.190  19.840  25.711
  146    H    GLN  20           H        GLN  20 -27.309  20.292  26.090
  147    HA   GLN  20           HA       GLN  20 -26.406  19.830  28.791
  148    HB2  GLN  20           HB2      GLN  20 -24.816  20.153  26.173
  149    HB3  GLN  20           HB3      GLN  20 -24.092  19.756  27.748
  150    HG2  GLN  20           HG2      GLN  20 -25.488  17.696  27.927
  151    HG3  GLN  20           HG3      GLN  20 -26.218  18.031  26.337
  152   HE21  GLN  20          HE21      GLN  20 -25.270  15.698  26.002
  153   HE22  GLN  20          HE22      GLN  20 -23.629  15.635  25.468
  154    H    ASP  21           H        ASP  21 -26.208  22.688  26.610
  155    HA   ASP  21           HA       ASP  21 -24.359  24.123  28.319
  156    HB2  ASP  21           HB2      ASP  21 -24.932  24.607  25.851
  157    HB3  ASP  21           HB3      ASP  21 -26.457  25.335  26.434
  158    H    PHE  22           H        PHE  22 -27.963  23.739  28.179
  159    HA   PHE  22           HA       PHE  22 -28.498  25.756  30.185
  160    HB2  PHE  22           HB2      PHE  22 -30.205  24.881  28.546
  161    HB3  PHE  22           HB3      PHE  22 -30.189  23.317  29.382
  162    HD1  PHE  22           HD1      PHE  22 -30.988  26.967  29.688
  163    HD2  PHE  22           HD2      PHE  22 -31.373  23.125  31.588
  164    HE1  PHE  22           HE1      PHE  22 -32.722  27.877  31.198
  165    HE2  PHE  22           HE2      PHE  22 -33.326  23.964  32.857
  166    HZ   PHE  22           HZ       PHE  22 -33.924  26.370  32.767
  167    H    ILE  23           H        ILE  23 -28.062  22.132  30.282
  168    HA   ILE  23           HA       ILE  23 -28.379  22.025  33.164
  169    HB   ILE  23           HB       ILE  23 -27.148  20.127  31.121
  170   HG12  ILE  23          HG12      ILE  23 -28.710  18.498  32.250
  171   HG13  ILE  23          HG13      ILE  23 -29.243  19.785  33.356
  172   HG21  ILE  23          HG21      ILE  23 -26.429  18.600  32.977
  173   HG22  ILE  23          HG22      ILE  23 -25.469  20.089  32.921
  174   HG23  ILE  23          HG23      ILE  23 -26.748  19.901  34.160
  175   HD11  ILE  23          HD11      ILE  23 -30.904  19.453  31.539
  176   HD12  ILE  23          HD12      ILE  23 -30.157  21.059  31.347
  177   HD13  ILE  23          HD13      ILE  23 -29.656  19.705  30.294
  178    H    GLU  24           H        GLU  24 -25.476  22.626  31.015
  179    HA   GLU  24           HA       GLU  24 -23.637  22.770  33.209
  180    HB2  GLU  24           HB2      GLU  24 -22.972  22.758  30.763
  181    HB3  GLU  24           HB3      GLU  24 -23.538  24.443  30.658
  182    HG2  GLU  24           HG2      GLU  24 -21.138  24.508  30.937
  183    HG3  GLU  24           HG3      GLU  24 -21.891  25.125  32.428
  184    H    TRP  25           H        TRP  25 -25.803  25.280  31.646
  185    HA   TRP  25           HA       TRP  25 -24.895  27.446  33.271
  186    HB2  TRP  25           HB2      TRP  25 -26.257  27.796  31.269
  187    HB3  TRP  25           HB3      TRP  25 -27.630  26.941  32.003
  188    HD1  TRP  25           HD1      TRP  25 -25.699  30.289  32.424
  189    HE1  TRP  25           HE1      TRP  25 -27.303  31.974  33.395
  190    HE3  TRP  25           HE3      TRP  25 -29.786  27.199  33.248
  191    HZ2  TRP  25           HZ2      TRP  25 -29.809  32.075  34.480
  192    HZ3  TRP  25           HZ3      TRP  25 -31.807  28.241  34.300
  193    HH2  TRP  25           HH2      TRP  25 -31.827  30.650  34.861
  194    H    LEU  26           H        LEU  26 -27.571  25.004  33.913
  195    HA   LEU  26           HA       LEU  26 -28.190  26.197  36.475
  196    HB2  LEU  26           HB2      LEU  26 -28.526  23.294  35.520
  197    HB3  LEU  26           HB3      LEU  26 -29.162  23.915  37.056
  198    HG   LEU  26           HG       LEU  26 -30.049  24.894  34.277
  199   HD11  LEU  26          HD11      LEU  26 -32.153  23.613  34.863
  200   HD12  LEU  26          HD12      LEU  26 -30.727  22.554  34.685
  201   HD13  LEU  26          HD13      LEU  26 -31.332  22.993  36.316
  202   HD21  LEU  26          HD21      LEU  26 -31.967  25.943  35.577
  203   HD22  LEU  26          HD22      LEU  26 -31.183  25.463  37.103
  204   HD23  LEU  26          HD23      LEU  26 -30.428  26.683  36.044
  205    H    LYS  27           H        LYS  27 -26.090  23.327  35.675
  206    HA   LYS  27           HA       LYS  27 -25.274  22.798  38.353
  207    HB2  LYS  27           HB2      LYS  27 -24.709  21.292  36.436
  208    HB3  LYS  27           HB3      LYS  27 -23.780  22.587  35.684
  209    HG2  LYS  27           HG2      LYS  27 -22.279  22.425  37.970
  210    HG3  LYS  27           HG3      LYS  27 -23.064  20.846  38.074
  211    HD2  LYS  27           HD2      LYS  27 -20.984  20.466  36.920
  212    HD3  LYS  27           HD3      LYS  27 -22.195  20.462  35.615
  213    HE2  LYS  27           HE2      LYS  27 -21.585  22.935  35.155
  214    HE3  LYS  27           HE3      LYS  27 -20.394  22.819  36.454
  215    HZ1  LYS  27           HZ1      LYS  27 -19.311  22.490  34.250
  216    HZ2  LYS  27           HZ2      LYS  27 -19.205  21.020  35.096
  217    HZ3  LYS  27           HZ3      LYS  27 -20.382  21.225  33.863
  218    H    ASN  28           H        ASN  28 -23.953  25.027  35.858
  219    HA   ASN  28           HA       ASN  28 -21.659  25.876  37.422
  220    HB2  ASN  28           HB2      ASN  28 -21.857  25.862  34.923
  221    HB3  ASN  28           HB3      ASN  28 -23.076  27.175  35.027
  222   HD21  ASN  28          HD21      ASN  28 -21.009  27.498  33.314
  223   HD22  ASN  28          HD22      ASN  28 -19.926  28.663  33.941
  224    H    GLY  29           H        GLY  29 -25.098  27.061  37.084
  225    HA2  GLY  29           HA2      GLY  29 -24.837  28.457  39.567
  226    HA3  GLY  29           HA3      GLY  29 -24.674  29.617  38.232
  227    H    GLY  30           H        GLY  30 -26.636  28.720  36.333
  228    HA2  GLY  30           HA2      GLY  30 -28.966  28.643  36.055
  229    HA3  GLY  30           HA3      GLY  30 -29.157  28.362  37.783
  230    HA   PRO  31           HA       PRO  31 -30.471  32.784  36.773
  231    HB2  PRO  31           HB2      PRO  31 -31.540  32.245  39.610
  232    HB3  PRO  31           HB3      PRO  31 -32.299  33.238  38.329
  233    HG2  PRO  31           HG2      PRO  31 -33.218  30.712  38.682
  234    HG3  PRO  31           HG3      PRO  31 -32.802  31.223  37.024
  235    HD2  PRO  31           HD2      PRO  31 -31.064  29.545  38.925
  236    HD3  PRO  31           HD3      PRO  31 -31.411  29.240  37.183
  237    H    SER  32           H        SER  32 -29.083  31.519  39.902
  238    HA   SER  32           HA       SER  32 -28.001  33.893  40.895
  239    HB2  SER  32           HB2      SER  32 -26.712  31.102  40.886
  240    HB3  SER  32           HB3      SER  32 -26.225  32.451  41.960
  241    HG   SER  32           HG       SER  32 -27.830  31.056  43.008
  242    H    SER  33           H        SER  33 -26.731  31.819  38.167
  243    HA   SER  33           HA       SER  33 -24.142  32.828  38.007
  244    HB2  SER  33           HB2      SER  33 -24.978  31.155  36.382
  245    HB3  SER  33           HB3      SER  33 -26.054  32.370  35.641
  246    HG   SER  33           HG       SER  33 -23.929  32.168  34.538
  247    H    GLY  34           H        GLY  34 -27.194  34.362  36.654
  248    HA2  GLY  34           HA2      GLY  34 -27.449  36.755  36.468
  249    HA3  GLY  34           HA3      GLY  34 -25.692  36.978  36.472
  250    H    ALA  35           H        ALA  35 -24.963  34.789  34.564
  251    HA   ALA  35           HA       ALA  35 -25.268  36.158  32.153
  252    HB1  ALA  35           HB1      ALA  35 -24.945  33.126  32.459
  253    HB2  ALA  35           HB2      ALA  35 -24.693  34.077  30.972
  254    HB3  ALA  35           HB3      ALA  35 -23.624  34.323  32.379
  255    HA   PRO  36           HA       PRO  36 -29.755  35.151  31.650
  256    HB2  PRO  36           HB2      PRO  36 -28.870  35.477  28.706
  257    HB3  PRO  36           HB3      PRO  36 -30.412  36.040  29.436
  258    HG2  PRO  36           HG2      PRO  36 -28.439  37.883  29.116
  259    HG3  PRO  36           HG3      PRO  36 -29.184  37.752  30.743
  260    HD2  PRO  36           HD2      PRO  36 -26.511  36.474  29.864
  261    HD3  PRO  36           HD3      PRO  36 -26.908  37.481  31.325
  262    HA   PRO  37           HA       PRO  37 -29.039  30.881  30.861
  263    HB2  PRO  37           HB2      PRO  37 -31.545  29.832  30.101
  264    HB3  PRO  37           HB3      PRO  37 -31.199  30.457  31.737
  265    HG2  PRO  37           HG2      PRO  37 -32.424  32.022  29.415
  266    HG3  PRO  37           HG3      PRO  37 -33.123  31.825  31.048
  267    HD2  PRO  37           HD2      PRO  37 -31.682  34.075  30.477
  268    HD3  PRO  37           HD3      PRO  37 -31.369  33.229  32.044
  269    HA   PRO  38           HA       PRO  38 -28.645  30.470  26.303
  270    HB2  PRO  38           HB2      PRO  38 -27.860  27.867  26.057
  271    HB3  PRO  38           HB3      PRO  38 -26.853  29.068  26.924
  272    HG2  PRO  38           HG2      PRO  38 -28.826  27.086  28.158
  273    HG3  PRO  38           HG3      PRO  38 -27.097  27.271  28.585
  274    HD2  PRO  38           HD2      PRO  38 -29.112  28.545  30.019
  275    HD3  PRO  38           HD3      PRO  38 -27.544  29.375  29.740
  276    H    SER  39           H        SER  39 -31.066  30.942  26.380
  277    HA   SER  39           HA       SER  39 -32.515  28.655  25.167
  278    HB2  SER  39           HB2      SER  39 -32.861  28.499  27.689
  279    HB3  SER  39           HB3      SER  39 -33.536  30.156  27.659
  280    HG   SER  39           HG       SER  39 -35.223  28.465  27.443
  281    HN1  NH2  40           H11      SER  39 -35.128  29.833  25.126
  282    HN2  NH2  40           H12      SER  39 -34.990  31.255  24.152
  283    H03  D6M 101          H N2      LYS  14 -26.219  32.077  17.435
  284   H121  D6M 101          H101      LYS  14 -26.118  33.922  18.997
  285   H122  D6M 101          H102      LYS  14 -26.743  33.636  20.635
  286    H04  D6M 101           HC2      LYS  14 -27.802  29.754  17.918
  287   H051  D6M 101          HC31      LYS  14 -25.136  29.949  16.451
  288   H052  D6M 101          HC32      LYS  14 -26.732  30.247  15.717
  289   H061  D6M 101          HC41      LYS  14 -25.930  27.549  16.993
  290   H062  D6M 101          HC42      LYS  14 -25.743  27.933  15.267
  291   H131  D6M 101          H111      LYS  14 -28.184  35.305  19.515
  292   H132  D6M 101          H112      LYS  14 -29.106  33.797  19.779
  293   H141  D6M 101          H121      LYS  14 -28.641  33.129  17.366
  294   H142  D6M 101          H122      LYS  14 -27.802  34.686  17.129
  295   H151  D6M 101          H131      LYS  14 -29.949  35.896  17.713
  296   H152  D6M 101          H132      LYS  14 -30.756  34.325  17.955
  297   H161  D6M 101          H141      LYS  14 -30.286  33.702  15.575
  298   H162  D6M 101          H142      LYS  14 -29.501  35.285  15.305
  299   H171  D6M 101          H151      LYS  14 -31.694  36.414  15.953
  300   H172  D6M 101          H152      LYS  14 -32.470  34.812  16.011
  301   H181  D6M 101          H161      LYS  14 -31.140  36.132  13.555
  302   H182  D6M 101          H162      LYS  14 -32.891  36.023  13.860
  303   H191  D6M 101          H171      LYS  14 -32.797  33.518  13.694
  304   H192  D6M 101          H172      LYS  14 -31.041  33.597  13.373
  305   H201  D6M 101          H181      LYS  14 -31.426  34.959  11.332
  306   H202  D6M 101          H182      LYS  14 -33.190  34.904  11.632
  307   H211  D6M 101          H191      LYS  14 -33.270  32.496  11.267
  308   H212  D6M 101          H192      LYS  14 -31.493  32.373  11.243
  309   H221  D6M 101          H201      LYS  14 -32.416  32.247   8.920
  310   H222  D6M 101          H202      LYS  14 -31.376  33.676   9.115
  311   H231  D6M 101          H211      LYS  14 -33.357  35.157   9.301
  312   H232  D6M 101          H212      LYS  14 -34.447  33.740   9.303
  313   H241  D6M 101          H221      LYS  14 -33.706  33.188   6.964
  314   H242  D6M 101          H222      LYS  14 -32.591  34.585   6.987
  315   H251  D6M 101          H231      LYS  14 -34.577  36.137   7.331
  316   H252  D6M 101          H232      LYS  14 -35.665  34.724   7.252
  317   H261  D6M 101          H241      LYS  14 -35.587  35.897   5.053
  318   H262  D6M 101          H242      LYS  14 -33.811  35.696   4.984
  319   H263  D6M 101          H243      LYS  14 -34.876  34.260   4.899
  Start of MODEL    4
    1    H1   HIS   1           H1       HIS   1 -35.373  12.278  -3.438
    2    H2   HIS   1           H2       HIS   1 -36.316  13.620  -2.911
    3    H3   HIS   1           H3       HIS   1 -37.100  12.175  -3.515
    4    HA   HIS   1           HA       HIS   1 -37.182  12.317  -0.991
    5    HB2  HIS   1           HB2      HIS   1 -37.232  10.055  -1.962
    6    HB3  HIS   1           HB3      HIS   1 -35.458  10.026  -2.161
    7    HD1  HIS   1           HD1      HIS   1 -34.038   9.794  -0.058
    8    HD2  HIS   1           HD2      HIS   1 -38.194   9.611   0.589
    9    HE1  HIS   1           HE1      HIS   1 -34.345   8.902   2.307
   10    H    DSN   2           HN       DSN   2 -35.792  12.303   1.076
   11    HA   DSN   2           HA       DSN   2 -33.211  13.768   0.510
   12    HB2  DSN   2           HB1      DSN   2 -32.723  11.433   1.287
   13    HB3  DSN   2           HB2      DSN   2 -33.782  11.702   2.711
   14    HG   DSN   2           HOG      DSN   2 -31.482  12.225   3.183
   15    H    GLN   3           H        GLN   3 -32.572  14.683   2.967
   16    HA   GLN   3           HA       GLN   3 -33.284  16.021   4.770
   17    HB2  GLN   3           HB2      GLN   3 -34.788  17.157   2.332
   18    HB3  GLN   3           HB3      GLN   3 -34.702  18.005   3.890
   19    HG2  GLN   3           HG2      GLN   3 -32.183  17.973   3.788
   20    HG3  GLN   3           HG3      GLN   3 -32.273  17.214   2.172
   21   HE21  GLN   3          HE21      GLN   3 -30.866  19.642   2.490
   22   HE22  GLN   3          HE22      GLN   3 -31.777  20.897   1.740
   23    H    GLY   4           H        GLY   4 -34.537  13.543   4.994
   24    HA2  GLY   4           HA2      GLY   4 -37.390  13.874   5.295
   25    HA3  GLY   4           HA3      GLY   4 -36.406  12.617   6.070
   26    H    THR   5           H        THR   5 -38.129  15.594   6.762
   27    HA   THR   5           HA       THR   5 -38.113  16.953   8.635
   28    HB   THR   5           HB       THR   5 -38.168  15.888  10.743
   29    HG1  THR   5           HG1      THR   5 -36.525  13.766   9.734
   30   HG21  THR   5          HG21      THR   5 -39.528  13.858  10.395
   31   HG22  THR   5          HG22      THR   5 -39.960  15.092   9.169
   32   HG23  THR   5          HG23      THR   5 -38.931  13.693   8.719
   33    H    PHE   6           H        PHE   6 -35.851  17.401   7.048
   34    HA   PHE   6           HA       PHE   6 -33.394  17.151   8.280
   35    HB2  PHE   6           HB2      PHE   6 -33.698  18.164   6.040
   36    HB3  PHE   6           HB3      PHE   6 -34.488  19.588   6.723
   37    HD1  PHE   6           HD1      PHE   6 -31.260  17.633   6.691
   38    HD2  PHE   6           HD2      PHE   6 -33.083  21.417   7.587
   39    HE1  PHE   6           HE1      PHE   6 -29.038  18.723   6.628
   40    HE2  PHE   6           HE2      PHE   6 -30.875  22.531   7.382
   41    HZ   PHE   6           HZ       PHE   6 -28.850  21.184   6.889
   42    H    THR   7           H        THR   7 -35.810  19.840   9.017
   43    HA   THR   7           HA       THR   7 -34.033  21.118  10.809
   44    HB   THR   7           HB       THR   7 -36.220  22.142  10.079
   45    HG1  THR   7           HG1      THR   7 -36.429  23.158  12.228
   46   HG21  THR   7          HG21      THR   7 -37.738  20.133  10.626
   47   HG22  THR   7          HG22      THR   7 -37.450  20.450  12.363
   48   HG23  THR   7          HG23      THR   7 -38.279  21.666  11.362
   49    H    SER   8           H        SER   8 -36.086  18.147  11.321
   50    HA   SER   8           HA       SER   8 -35.791  18.285  14.192
   51    HB2  SER   8           HB2      SER   8 -36.334  15.810  12.480
   52    HB3  SER   8           HB3      SER   8 -36.555  15.948  14.239
   53    HG   SER   8           HG       SER   8 -38.215  17.618  13.723
   54    H    ASP   9           H        ASP   9 -33.988  16.554  11.463
   55    HA   ASP   9           HA       ASP   9 -32.274  15.177  13.188
   56    HB2  ASP   9           HB2      ASP   9 -32.186  14.715  10.752
   57    HB3  ASP   9           HB3      ASP   9 -31.474  16.334  10.439
   58    H    LEU  10           H        LEU  10 -32.120  18.617  11.939
   59    HA   LEU  10           HA       LEU  10 -29.534  19.102  13.274
   60    HB2  LEU  10           HB2      LEU  10 -31.610  20.932  11.976
   61    HB3  LEU  10           HB3      LEU  10 -30.318  21.592  12.989
   62    HG   LEU  10           HG       LEU  10 -28.563  20.571  11.557
   63   HD11  LEU  10          HD11      LEU  10 -30.803  19.583   9.715
   64   HD12  LEU  10          HD12      LEU  10 -29.053  19.485   9.391
   65   HD13  LEU  10          HD13      LEU  10 -29.749  18.526  10.700
   66   HD21  LEU  10          HD21      LEU  10 -30.662  22.193   9.965
   67   HD22  LEU  10          HD22      LEU  10 -29.390  22.876  11.011
   68   HD23  LEU  10          HD23      LEU  10 -28.944  22.004   9.519
   69    H    SER  11           H        SER  11 -33.032  19.606  14.130
   70    HA   SER  11           HA       SER  11 -32.578  21.354  16.227
   71    HB2  SER  11           HB2      SER  11 -34.717  19.161  16.186
   72    HB3  SER  11           HB3      SER  11 -34.671  20.495  17.356
   73    HG   SER  11           HG       SER  11 -35.019  20.867  14.544
   74    H    LYS  12           H        LYS  12 -32.310  17.691  16.304
   75    HA   LYS  12           HA       LYS  12 -31.915  17.572  19.126
   76    HB2  LYS  12           HB2      LYS  12 -31.099  15.404  18.897
   77    HB3  LYS  12           HB3      LYS  12 -32.263  15.597  17.563
   78    HG2  LYS  12           HG2      LYS  12 -30.179  16.170  16.089
   79    HG3  LYS  12           HG3      LYS  12 -29.173  15.589  17.433
   80    HD2  LYS  12           HD2      LYS  12 -30.364  13.343  17.247
   81    HD3  LYS  12           HD3      LYS  12 -31.311  13.977  15.875
   82    HE2  LYS  12           HE2      LYS  12 -28.269  13.511  15.963
   83    HE3  LYS  12           HE3      LYS  12 -29.479  12.601  15.034
   84    HZ1  LYS  12           HZ1      LYS  12 -28.447  15.448  14.467
   85    HZ2  LYS  12           HZ2      LYS  12 -28.697  14.123  13.337
   86    HZ3  LYS  12           HZ3      LYS  12 -29.966  14.913  13.911
   87    H    GLN  13           H        GLN  13 -29.611  18.475  16.442
   88    HA   GLN  13           HA       GLN  13 -27.258  18.186  18.133
   89    HB2  GLN  13           HB2      GLN  13 -27.638  20.118  15.738
   90    HB3  GLN  13           HB3      GLN  13 -26.105  19.652  16.482
   91    HG2  GLN  13           HG2      GLN  13 -27.981  17.936  14.779
   92    HG3  GLN  13           HG3      GLN  13 -26.295  18.354  14.441
   93   HE21  GLN  13          HE21      GLN  13 -24.880  17.583  16.803
   94   HE22  GLN  13          HE22      GLN  13 -25.157  15.901  17.044
   95    H    LYS  14           HN       LYS  14 -29.580  20.825  17.333
   96    HA   LYS  14           HA       LYS  14 -28.011  22.782  18.850
   97    HB2  LYS  14           HB2      LYS  14 -30.853  22.931  17.656
   98    HB3  LYS  14           HB3      LYS  14 -29.954  24.299  18.360
   99    HG2  LYS  14          HC81      LYS  14 -28.123  23.942  16.701
  100    HG3  LYS  14          HC82      LYS  14 -29.053  22.645  15.911
  101    HD2  LYS  14          HC71      LYS  14 -30.930  24.284  15.446
  102    HD3  LYS  14          HC72      LYS  14 -29.919  25.590  16.129
  103    HE2  LYS  14          HC61      LYS  14 -29.184  23.824  13.703
  104    HE3  LYS  14          HC62      LYS  14 -29.726  25.505  13.610
  105    HZ1  LYS  14          H N1      LYS  14 -27.076  24.533  14.470
  106    H    ASP  15           H        ASP  15 -30.877  20.676  19.523
  107    HA   ASP  15           HA       ASP  15 -31.360  22.062  22.036
  108    HB2  ASP  15           HB2      ASP  15 -33.179  20.670  20.805
  109    HB3  ASP  15           HB3      ASP  15 -32.318  19.216  21.365
  110    H    SER  16           H        SER  16 -29.509  19.064  20.879
  111    HA   SER  16           HA       SER  16 -28.825  18.256  23.534
  112    HB2  SER  16           HB2      SER  16 -28.254  16.788  21.602
  113    HB3  SER  16           HB3      SER  16 -27.141  18.025  20.965
  114    HG   SER  16           HG       SER  16 -26.775  16.687  23.489
  115    H    ARG  17           H        ARG  17 -27.234  20.650  21.215
  116    HA   ARG  17           HA       ARG  17 -25.124  21.167  23.065
  117    HB2  ARG  17           HB2      ARG  17 -24.982  21.654  20.645
  118    HB3  ARG  17           HB3      ARG  17 -26.221  22.934  20.780
  119    HG2  ARG  17           HG2      ARG  17 -24.820  24.210  22.367
  120    HG3  ARG  17           HG3      ARG  17 -23.618  22.891  22.393
  121    HD2  ARG  17           HD2      ARG  17 -23.240  23.218  19.955
  122    HD3  ARG  17           HD3      ARG  17 -24.166  24.754  20.011
  123    HE   ARG  17           HE       ARG  17 -22.449  25.093  22.126
  124   HH11  ARG  17          HH11      ARG  17 -20.319  25.747  22.148
  125   HH12  ARG  17          HH12      ARG  17 -19.339  25.691  20.679
  126   HH21  ARG  17          HH21      ARG  17 -21.861  24.361  18.643
  127   HH22  ARG  17          HH22      ARG  17 -20.182  24.863  18.762
  128    H    ARG  18           H        ARG  18 -28.226  23.041  22.362
  129    HA   ARG  18           HA       ARG  18 -27.579  24.973  24.416
  130    HB2  ARG  18           HB2      ARG  18 -30.267  24.208  23.141
  131    HB3  ARG  18           HB3      ARG  18 -30.095  25.482  24.365
  132    HG2  ARG  18           HG2      ARG  18 -28.603  25.531  21.670
  133    HG3  ARG  18           HG3      ARG  18 -30.157  26.329  21.984
  134    HD2  ARG  18           HD2      ARG  18 -29.189  27.675  23.814
  135    HD3  ARG  18           HD3      ARG  18 -27.569  27.087  23.509
  136    HE   ARG  18           HE       ARG  18 -29.120  29.075  22.015
  137   HH11  ARG  18          HH11      ARG  18 -28.251  30.038  20.200
  138   HH12  ARG  18          HH12      ARG  18 -26.859  29.319  19.388
  139   HH21  ARG  18          HH21      ARG  18 -26.494  26.625  21.584
  140   HH22  ARG  18          HH22      ARG  18 -25.920  27.434  20.129
  141    H    ALA  19           H        ALA  19 -29.364  21.849  24.495
  142    HA   ALA  19           HA       ALA  19 -30.405  22.262  27.136
  143    HB1  ALA  19           HB1      ALA  19 -29.690  19.597  25.753
  144    HB2  ALA  19           HB2      ALA  19 -30.698  19.786  27.210
  145    HB3  ALA  19           HB3      ALA  19 -31.262  20.444  25.651
  146    H    GLN  20           H        GLN  20 -27.350  20.601  25.906
  147    HA   GLN  20           HA       GLN  20 -26.324  20.170  28.564
  148    HB2  GLN  20           HB2      GLN  20 -24.918  20.498  25.849
  149    HB3  GLN  20           HB3      GLN  20 -24.036  20.147  27.352
  150    HG2  GLN  20           HG2      GLN  20 -25.272  18.053  27.711
  151    HG3  GLN  20           HG3      GLN  20 -26.313  18.347  26.297
  152   HE21  GLN  20          HE21      GLN  20 -25.076  15.919  26.288
  153   HE22  GLN  20          HE22      GLN  20 -23.773  15.937  25.157
  154    H    ASP  21           H        ASP  21 -26.194  23.017  26.362
  155    HA   ASP  21           HA       ASP  21 -24.304  24.495  27.991
  156    HB2  ASP  21           HB2      ASP  21 -25.302  24.982  25.529
  157    HB3  ASP  21           HB3      ASP  21 -26.526  25.915  26.418
  158    H    PHE  22           H        PHE  22 -27.909  24.174  27.944
  159    HA   PHE  22           HA       PHE  22 -28.354  26.150  29.986
  160    HB2  PHE  22           HB2      PHE  22 -30.082  25.378  28.309
  161    HB3  PHE  22           HB3      PHE  22 -30.151  23.806  29.129
  162    HD1  PHE  22           HD1      PHE  22 -30.558  27.537  29.614
  163    HD2  PHE  22           HD2      PHE  22 -31.611  23.642  31.106
  164    HE1  PHE  22           HE1      PHE  22 -32.277  28.555  31.081
  165    HE2  PHE  22           HE2      PHE  22 -33.481  24.649  32.381
  166    HZ   PHE  22           HZ       PHE  22 -33.759  27.118  32.449
  167    H    ILE  23           H        ILE  23 -28.040  22.523  30.052
  168    HA   ILE  23           HA       ILE  23 -28.496  22.380  32.900
  169    HB   ILE  23           HB       ILE  23 -27.265  20.426  30.885
  170   HG12  ILE  23          HG12      ILE  23 -28.984  18.891  31.882
  171   HG13  ILE  23          HG13      ILE  23 -29.506  20.169  33.008
  172   HG21  ILE  23          HG21      ILE  23 -26.743  18.850  32.736
  173   HG22  ILE  23          HG22      ILE  23 -25.680  20.272  32.744
  174   HG23  ILE  23          HG23      ILE  23 -27.026  20.157  33.929
  175   HD11  ILE  23          HD11      ILE  23 -31.093  20.009  31.111
  176   HD12  ILE  23          HD12      ILE  23 -30.233  21.566  30.993
  177   HD13  ILE  23          HD13      ILE  23 -29.765  20.191  29.935
  178    H    GLU  24           H        GLU  24 -25.448  22.794  30.859
  179    HA   GLU  24           HA       GLU  24 -23.730  22.802  33.116
  180    HB2  GLU  24           HB2      GLU  24 -22.926  22.883  30.703
  181    HB3  GLU  24           HB3      GLU  24 -23.404  24.613  30.632
  182    HG2  GLU  24           HG2      GLU  24 -21.006  24.444  31.085
  183    HG3  GLU  24           HG3      GLU  24 -21.852  25.179  32.479
  184    H    TRP  25           H        TRP  25 -25.586  25.523  31.511
  185    HA   TRP  25           HA       TRP  25 -24.757  27.550  33.326
  186    HB2  TRP  25           HB2      TRP  25 -25.960  28.021  31.234
  187    HB3  TRP  25           HB3      TRP  25 -27.396  27.199  31.847
  188    HD1  TRP  25           HD1      TRP  25 -25.376  30.413  32.651
  189    HE1  TRP  25           HE1      TRP  25 -26.996  32.103  33.590
  190    HE3  TRP  25           HE3      TRP  25 -29.654  27.489  32.894
  191    HZ2  TRP  25           HZ2      TRP  25 -29.597  32.254  34.453
  192    HZ3  TRP  25           HZ3      TRP  25 -31.707  28.548  33.846
  193    HH2  TRP  25           HH2      TRP  25 -31.684  30.910  34.545
  194    H    LEU  26           H        LEU  26 -27.542  25.175  33.725
  195    HA   LEU  26           HA       LEU  26 -28.288  26.309  36.283
  196    HB2  LEU  26           HB2      LEU  26 -28.663  23.452  35.267
  197    HB3  LEU  26           HB3      LEU  26 -29.366  24.107  36.775
  198    HG   LEU  26           HG       LEU  26 -30.032  25.139  33.946
  199   HD11  LEU  26          HD11      LEU  26 -31.573  23.255  35.838
  200   HD12  LEU  26          HD12      LEU  26 -32.214  23.921  34.314
  201   HD13  LEU  26          HD13      LEU  26 -30.824  22.807  34.271
  202   HD21  LEU  26          HD21      LEU  26 -32.003  26.230  35.129
  203   HD22  LEU  26          HD22      LEU  26 -31.305  25.756  36.708
  204   HD23  LEU  26          HD23      LEU  26 -30.454  26.916  35.645
  205    H    LYS  27           H        LYS  27 -26.310  23.322  35.568
  206    HA   LYS  27           HA       LYS  27 -25.627  22.741  38.250
  207    HB2  LYS  27           HB2      LYS  27 -25.072  21.275  36.285
  208    HB3  LYS  27           HB3      LYS  27 -24.000  22.529  35.653
  209    HG2  LYS  27           HG2      LYS  27 -22.691  22.164  38.039
  210    HG3  LYS  27           HG3      LYS  27 -23.592  20.633  38.013
  211    HD2  LYS  27           HD2      LYS  27 -21.475  20.128  36.964
  212    HD3  LYS  27           HD3      LYS  27 -22.595  20.318  35.587
  213    HE2  LYS  27           HE2      LYS  27 -21.754  22.799  35.432
  214    HE3  LYS  27           HE3      LYS  27 -20.568  22.388  36.685
  215    HZ1  LYS  27           HZ1      LYS  27 -19.612  22.254  34.421
  216    HZ2  LYS  27           HZ2      LYS  27 -19.611  20.665  35.122
  217    HZ3  LYS  27           HZ3      LYS  27 -20.804  21.103  33.933
  218    H    ASN  28           H        ASN  28 -24.096  24.981  35.897
  219    HA   ASN  28           HA       ASN  28 -21.861  25.700  37.610
  220    HB2  ASN  28           HB2      ASN  28 -21.945  25.736  35.129
  221    HB3  ASN  28           HB3      ASN  28 -23.080  27.135  35.191
  222   HD21  ASN  28          HD21      ASN  28 -21.063  27.504  33.576
  223   HD22  ASN  28          HD22      ASN  28 -19.854  28.499  34.292
  224    H    GLY  29           H        GLY  29 -25.233  26.981  37.138
  225    HA2  GLY  29           HA2      GLY  29 -25.171  28.156  39.713
  226    HA3  GLY  29           HA3      GLY  29 -24.828  29.449  38.536
  227    H    GLY  30           H        GLY  30 -26.601  28.763  36.343
  228    HA2  GLY  30           HA2      GLY  30 -28.897  28.734  35.820
  229    HA3  GLY  30           HA3      GLY  30 -29.264  28.344  37.516
  230    HA   PRO  31           HA       PRO  31 -30.357  32.880  36.825
  231    HB2  PRO  31           HB2      PRO  31 -31.690  32.052  39.485
  232    HB3  PRO  31           HB3      PRO  31 -32.320  33.226  38.287
  233    HG2  PRO  31           HG2      PRO  31 -33.303  30.694  38.281
  234    HG3  PRO  31           HG3      PRO  31 -32.761  31.375  36.707
  235    HD2  PRO  31           HD2      PRO  31 -31.244  29.436  38.553
  236    HD3  PRO  31           HD3      PRO  31 -31.486  29.313  36.773
  237    H    SER  32           H        SER  32 -29.235  31.090  39.822
  238    HA   SER  32           HA       SER  32 -28.148  33.329  41.183
  239    HB2  SER  32           HB2      SER  32 -28.204  31.022  42.191
  240    HB3  SER  32           HB3      SER  32 -26.969  30.490  41.015
  241    HG   SER  32           HG       SER  32 -26.495  32.538  42.982
  242    H    SER  33           H        SER  33 -26.806  31.509  38.322
  243    HA   SER  33           HA       SER  33 -24.178  32.501  38.401
  244    HB2  SER  33           HB2      SER  33 -24.980  30.989  36.531
  245    HB3  SER  33           HB3      SER  33 -26.012  32.308  35.924
  246    HG   SER  33           HG       SER  33 -23.146  32.477  36.014
  247    H    GLY  34           H        GLY  34 -27.235  34.200  37.287
  248    HA2  GLY  34           HA2      GLY  34 -27.468  36.576  37.308
  249    HA3  GLY  34           HA3      GLY  34 -25.703  36.791  37.377
  250    H    ALA  35           H        ALA  35 -24.967  34.916  35.170
  251    HA   ALA  35           HA       ALA  35 -25.331  36.718  33.015
  252    HB1  ALA  35           HB1      ALA  35 -24.696  33.691  32.947
  253    HB2  ALA  35           HB2      ALA  35 -24.467  34.800  31.559
  254    HB3  ALA  35           HB3      ALA  35 -23.490  35.017  33.049
  255    HA   PRO  36           HA       PRO  36 -29.486  35.411  31.832
  256    HB2  PRO  36           HB2      PRO  36 -29.544  35.918  29.082
  257    HB3  PRO  36           HB3      PRO  36 -29.480  37.238  30.301
  258    HG2  PRO  36           HG2      PRO  36 -27.105  35.954  28.859
  259    HG3  PRO  36           HG3      PRO  36 -27.514  37.696  28.883
  260    HD2  PRO  36           HD2      PRO  36 -25.679  36.715  30.635
  261    HD3  PRO  36           HD3      PRO  36 -26.925  37.846  31.287
  262    HA   PRO  37           HA       PRO  37 -28.565  31.298  30.790
  263    HB2  PRO  37           HB2      PRO  37 -30.937  30.207  29.769
  264    HB3  PRO  37           HB3      PRO  37 -30.793  30.771  31.445
  265    HG2  PRO  37           HG2      PRO  37 -31.831  32.410  29.081
  266    HG3  PRO  37           HG3      PRO  37 -32.692  32.086  30.602
  267    HD2  PRO  37           HD2      PRO  37 -31.271  34.416  30.296
  268    HD3  PRO  37           HD3      PRO  37 -31.111  33.507  31.841
  269    HA   PRO  38           HA       PRO  38 -27.584  31.097  26.321
  270    HB2  PRO  38           HB2      PRO  38 -27.088  28.414  25.985
  271    HB3  PRO  38           HB3      PRO  38 -26.048  29.470  26.987
  272    HG2  PRO  38           HG2      PRO  38 -28.327  27.643  27.963
  273    HG3  PRO  38           HG3      PRO  38 -26.627  27.668  28.543
  274    HD2  PRO  38           HD2      PRO  38 -28.609  29.020  29.871
  275    HD3  PRO  38           HD3      PRO  38 -26.987  29.770  29.705
  276    H    SER  39           H        SER  39 -29.882  31.798  25.803
  277    HA   SER  39           HA       SER  39 -31.908  29.666  25.451
  278    HB2  SER  39           HB2      SER  39 -32.662  31.970  26.041
  279    HB3  SER  39           HB3      SER  39 -32.068  32.551  24.448
  280    HG   SER  39           HG       SER  39 -34.353  31.842  24.312
  281    HN1  NH2  40           H11      SER  39 -33.082  29.723  23.124
  282    HN2  NH2  40           H12      SER  39 -31.997  29.491  21.807
  283    H03  D6M 101          H N2      LYS  14 -25.139  30.680  16.476
  284   H121  D6M 101          H101      LYS  14 -25.785  32.955  16.953
  285   H122  D6M 101          H102      LYS  14 -27.514  33.328  17.076
  286    H04  D6M 101           HC2      LYS  14 -27.396  28.690  16.590
  287   H051  D6M 101          HC31      LYS  14 -24.821  28.713  14.924
  288   H052  D6M 101          HC32      LYS  14 -26.444  29.004  14.280
  289   H061  D6M 101          HC41      LYS  14 -25.652  26.370  15.673
  290   H062  D6M 101          HC42      LYS  14 -25.560  26.634  13.914
  291   H131  D6M 101          H111      LYS  14 -26.460  34.336  15.014
  292   H132  D6M 101          H112      LYS  14 -27.774  33.203  14.590
  293   H141  D6M 101          H121      LYS  14 -26.140  31.415  14.097
  294   H142  D6M 101          H122      LYS  14 -24.788  32.480  14.571
  295   H151  D6M 101          H131      LYS  14 -25.293  33.997  12.649
  296   H152  D6M 101          H132      LYS  14 -26.751  33.047  12.256
  297   H161  D6M 101          H141      LYS  14 -25.341  31.030  11.830
  298   H162  D6M 101          H142      LYS  14 -23.852  31.944  12.199
  299   H171  D6M 101          H151      LYS  14 -24.244  33.433  10.245
  300   H172  D6M 101          H152      LYS  14 -25.813  32.636   9.933
  301   H181  D6M 101          H161      LYS  14 -24.617  30.468   9.506
  302   H182  D6M 101          H162      LYS  14 -23.051  31.250   9.854
  303   H191  D6M 101          H171      LYS  14 -23.320  32.745   7.883
  304   H192  D6M 101          H172      LYS  14 -24.964  32.115   7.591
  305   H201  D6M 101          H181      LYS  14 -23.432  31.108   5.994
  306   H202  D6M 101          H182      LYS  14 -24.110  29.866   7.092
  307   H211  D6M 101          H191      LYS  14 -22.009  29.707   8.343
  308   H212  D6M 101          H192      LYS  14 -21.366  31.167   7.543
  309   H221  D6M 101          H201      LYS  14 -20.283  29.150   6.732
  310   H222  D6M 101          H202      LYS  14 -21.132  29.956   5.398
  311   H231  D6M 101          H211      LYS  14 -22.494  27.645   6.900
  312   H232  D6M 101          H212      LYS  14 -21.223  27.293   5.711
  313   H241  D6M 101          H221      LYS  14 -22.464  28.464   3.908
  314   H242  D6M 101          H222      LYS  14 -23.810  28.816   5.015
  315   H251  D6M 101          H231      LYS  14 -24.141  26.342   5.393
  316   H252  D6M 101          H232      LYS  14 -22.819  26.014   4.234
  317   H261  D6M 101          H241      LYS  14 -25.473  27.451   3.582
  318   H262  D6M 101          H242      LYS  14 -24.144  27.195   2.416
  319   H263  D6M 101          H243      LYS  14 -25.022  25.796   3.088
  Start of MODEL    5
    1    H1   HIS   1           H1       HIS   1 -30.812  11.179  -0.596
    2    H2   HIS   1           H2       HIS   1 -31.964  12.192   0.181
    3    H3   HIS   1           H3       HIS   1 -31.832  12.236  -1.553
    4    HA   HIS   1           HA       HIS   1 -33.841  10.913  -0.782
    5    HB2  HIS   1           HB2      HIS   1 -32.809  10.226  -2.950
    6    HB3  HIS   1           HB3      HIS   1 -31.608   9.218  -2.104
    7    HD1  HIS   1           HD1      HIS   1 -32.562   7.138  -0.783
    8    HD2  HIS   1           HD2      HIS   1 -35.249   9.097  -3.363
    9    HE1  HIS   1           HE1      HIS   1 -34.486   5.531  -1.121
   10    H    DSN   2           HN       DSN   2 -34.593   8.966   0.535
   11    HA   DSN   2           HA       DSN   2 -32.569   7.680   2.236
   12    HB2  DSN   2           HB1      DSN   2 -34.690   6.521   1.557
   13    HB3  DSN   2           HB2      DSN   2 -35.624   7.719   2.515
   14    HG   DSN   2           HOG      DSN   2 -35.059   5.769   3.804
   15    H    GLN   3           H        GLN   3 -33.461   7.703   4.783
   16    HA   GLN   3           HA       GLN   3 -33.529   8.943   6.729
   17    HB2  GLN   3           HB2      GLN   3 -32.277  11.235   5.110
   18    HB3  GLN   3           HB3      GLN   3 -32.243  11.011   6.866
   19    HG2  GLN   3           HG2      GLN   3 -30.076  10.306   6.006
   20    HG3  GLN   3           HG3      GLN   3 -30.942   8.865   6.589
   21   HE21  GLN   3          HE21      GLN   3 -30.411  10.815   3.499
   22   HE22  GLN   3          HE22      GLN   3 -30.391   9.415   2.491
   23    H    GLY   4           H        GLY   4 -34.461  11.152   7.765
   24    HA2  GLY   4           HA2      GLY   4 -36.456  12.466   6.105
   25    HA3  GLY   4           HA3      GLY   4 -37.161  11.202   7.160
   26    H    THR   5           H        THR   5 -38.265  13.457   7.829
   27    HA   THR   5           HA       THR   5 -38.347  15.251   9.347
   28    HB   THR   5           HB       THR   5 -37.990  14.503  11.647
   29    HG1  THR   5           HG1      THR   5 -35.921  13.288  11.259
   30   HG21  THR   5          HG21      THR   5 -39.976  13.568  10.422
   31   HG22  THR   5          HG22      THR   5 -38.991  12.146   9.949
   32   HG23  THR   5          HG23      THR   5 -39.351  12.447  11.672
   33    H    PHE   6           H        PHE   6 -36.277  15.820   7.634
   34    HA   PHE   6           HA       PHE   6 -33.739  16.070   8.698
   35    HB2  PHE   6           HB2      PHE   6 -34.261  16.706   6.376
   36    HB3  PHE   6           HB3      PHE   6 -35.289  18.045   6.904
   37    HD1  PHE   6           HD1      PHE   6 -31.752  16.822   6.707
   38    HD2  PHE   6           HD2      PHE   6 -34.276  20.157   7.715
   39    HE1  PHE   6           HE1      PHE   6 -29.837  18.363   6.406
   40    HE2  PHE   6           HE2      PHE   6 -32.368  21.699   7.383
   41    HZ   PHE   6           HZ       PHE   6 -30.153  20.810   6.698
   42    H    THR   7           H        THR   7 -36.449  18.500   9.246
   43    HA   THR   7           HA       THR   7 -34.785  20.265  10.706
   44    HB   THR   7           HB       THR   7 -37.132  20.800   9.929
   45    HG1  THR   7           HG1      THR   7 -36.527  21.450  12.656
   46   HG21  THR   7          HG21      THR   7 -38.344  18.765  10.877
   47   HG22  THR   7          HG22      THR   7 -38.019  19.373  12.527
   48   HG23  THR   7          HG23      THR   7 -39.045  20.317  11.418
   49    H    SER   8           H        SER   8 -36.326  17.151  11.771
   50    HA   SER   8           HA       SER   8 -35.872  17.764  14.579
   51    HB2  SER   8           HB2      SER   8 -36.298  15.022  13.273
   52    HB3  SER   8           HB3      SER   8 -36.225  15.366  15.012
   53    HG   SER   8           HG       SER   8 -38.226  16.517  13.275
   54    H    ASP   9           H        ASP   9 -34.110  15.934  11.919
   55    HA   ASP   9           HA       ASP   9 -32.135  15.052  13.785
   56    HB2  ASP   9           HB2      ASP   9 -32.637  14.216  11.219
   57    HB3  ASP   9           HB3      ASP   9 -31.230  15.261  10.898
   58    H    LEU  10           H        LEU  10 -32.512  18.180  12.114
   59    HA   LEU  10           HA       LEU  10 -29.812  19.009  13.093
   60    HB2  LEU  10           HB2      LEU  10 -32.156  20.566  11.900
   61    HB3  LEU  10           HB3      LEU  10 -30.849  21.358  12.802
   62    HG   LEU  10           HG       LEU  10 -29.117  20.447  11.241
   63   HD11  LEU  10          HD11      LEU  10 -31.446  19.221   9.668
   64   HD12  LEU  10          HD12      LEU  10 -29.731  19.276   9.161
   65   HD13  LEU  10          HD13      LEU  10 -30.201  18.293  10.554
   66   HD21  LEU  10          HD21      LEU  10 -31.448  21.857   9.809
   67   HD22  LEU  10          HD22      LEU  10 -30.169  22.672  10.750
   68   HD23  LEU  10          HD23      LEU  10 -29.750  21.811   9.245
   69    H    SER  11           H        SER  11 -33.295  19.344  14.162
   70    HA   SER  11           HA       SER  11 -32.715  21.047  16.287
   71    HB2  SER  11           HB2      SER  11 -34.855  18.840  16.420
   72    HB3  SER  11           HB3      SER  11 -34.707  20.241  17.490
   73    HG   SER  11           HG       SER  11 -35.260  20.475  14.684
   74    H    LYS  12           H        LYS  12 -32.507  17.365  16.266
   75    HA   LYS  12           HA       LYS  12 -31.970  17.165  19.020
   76    HB2  LYS  12           HB2      LYS  12 -30.938  15.001  18.638
   77    HB3  LYS  12           HB3      LYS  12 -32.282  15.179  17.483
   78    HG2  LYS  12           HG2      LYS  12 -30.543  15.937  15.776
   79    HG3  LYS  12           HG3      LYS  12 -29.255  15.519  16.936
   80    HD2  LYS  12           HD2      LYS  12 -30.043  13.117  16.914
   81    HD3  LYS  12           HD3      LYS  12 -31.300  13.580  15.732
   82    HE2  LYS  12           HE2      LYS  12 -29.401  14.475  14.228
   83    HE3  LYS  12           HE3      LYS  12 -28.234  13.737  15.325
   84    HZ1  LYS  12           HZ1      LYS  12 -29.011  12.452  13.164
   85    HZ2  LYS  12           HZ2      LYS  12 -28.944  11.523  14.652
   86    HZ3  LYS  12           HZ3      LYS  12 -30.438  12.070  14.025
   87    H    GLN  13           H        GLN  13 -29.735  18.202  16.346
   88    HA   GLN  13           HA       GLN  13 -27.367  17.936  18.060
   89    HB2  GLN  13           HB2      GLN  13 -27.767  19.558  15.467
   90    HB3  GLN  13           HB3      GLN  13 -26.217  19.267  16.285
   91    HG2  GLN  13           HG2      GLN  13 -28.027  17.080  15.052
   92    HG3  GLN  13           HG3      GLN  13 -26.543  17.726  14.329
   93   HE21  GLN  13          HE21      GLN  13 -24.431  17.499  15.762
   94   HE22  GLN  13          HE22      GLN  13 -24.339  16.049  16.685
   95    H    LYS  14           HN       LYS  14 -29.604  20.620  17.014
   96    HA   LYS  14           HA       LYS  14 -28.120  22.628  18.510
   97    HB2  LYS  14           HB2      LYS  14 -31.087  22.615  17.652
   98    HB3  LYS  14           HB3      LYS  14 -30.177  24.002  18.312
   99    HG2  LYS  14          HC81      LYS  14 -28.534  23.761  16.390
  100    HG3  LYS  14          HC82      LYS  14 -29.588  22.550  15.639
  101    HD2  LYS  14          HC71      LYS  14 -31.441  24.194  15.473
  102    HD3  LYS  14          HC72      LYS  14 -30.454  25.444  16.280
  103    HE2  LYS  14          HC61      LYS  14 -29.752  24.104  13.602
  104    HE3  LYS  14          HC62      LYS  14 -30.452  25.723  13.781
  105    HZ1  LYS  14          H N1      LYS  14 -27.660  24.929  14.358
  106    H    ASP  15           H        ASP  15 -30.703  20.253  19.356
  107    HA   ASP  15           HA       ASP  15 -31.249  21.519  21.880
  108    HB2  ASP  15           HB2      ASP  15 -32.832  19.893  20.640
  109    HB3  ASP  15           HB3      ASP  15 -31.740  18.575  21.118
  110    H    SER  16           H        SER  16 -28.992  18.826  20.742
  111    HA   SER  16           HA       SER  16 -28.220  18.133  23.414
  112    HB2  SER  16           HB2      SER  16 -27.485  16.811  21.375
  113    HB3  SER  16           HB3      SER  16 -26.364  18.121  20.951
  114    HG   SER  16           HG       SER  16 -25.366  17.679  23.124
  115    H    ARG  17           H        ARG  17 -26.939  20.642  21.076
  116    HA   ARG  17           HA       ARG  17 -24.944  21.620  22.878
  117    HB2  ARG  17           HB2      ARG  17 -24.912  22.083  20.475
  118    HB3  ARG  17           HB3      ARG  17 -26.491  22.899  20.547
  119    HG2  ARG  17           HG2      ARG  17 -25.538  24.656  22.045
  120    HG3  ARG  17           HG3      ARG  17 -23.931  23.869  21.919
  121    HD2  ARG  17           HD2      ARG  17 -23.868  24.314  19.501
  122    HD3  ARG  17           HD3      ARG  17 -25.590  24.839  19.539
  123    HE   ARG  17           HE       ARG  17 -24.149  26.560  21.291
  124   HH11  ARG  17          HH11      ARG  17 -23.959  28.713  20.609
  125   HH12  ARG  17          HH12      ARG  17 -24.050  29.109  18.883
  126   HH21  ARG  17          HH21      ARG  17 -24.412  25.817  17.772
  127   HH22  ARG  17          HH22      ARG  17 -24.277  27.518  17.340
  128    H    ARG  18           H        ARG  18 -28.292  22.948  22.149
  129    HA   ARG  18           HA       ARG  18 -28.069  25.099  24.040
  130    HB2  ARG  18           HB2      ARG  18 -30.474  23.598  22.883
  131    HB3  ARG  18           HB3      ARG  18 -30.688  24.958  23.988
  132    HG2  ARG  18           HG2      ARG  18 -28.976  25.307  21.454
  133    HG3  ARG  18           HG3      ARG  18 -30.743  25.357  21.344
  134    HD2  ARG  18           HD2      ARG  18 -30.882  27.158  23.027
  135    HD3  ARG  18           HD3      ARG  18 -29.141  27.266  23.179
  136    HE   ARG  18           HE       ARG  18 -30.928  28.203  20.997
  137   HH11  ARG  18          HH11      ARG  18 -30.074  29.348  19.267
  138   HH12  ARG  18          HH12      ARG  18 -28.334  29.350  18.981
  139   HH21  ARG  18          HH21      ARG  18 -27.487  27.306  21.665
  140   HH22  ARG  18          HH22      ARG  18 -26.930  28.215  20.263
  141    H    ALA  19           H        ALA  19 -29.339  21.711  24.337
  142    HA   ALA  19           HA       ALA  19 -30.270  22.044  27.034
  143    HB1  ALA  19           HB1      ALA  19 -29.304  19.479  25.650
  144    HB2  ALA  19           HB2      ALA  19 -30.312  19.583  27.123
  145    HB3  ALA  19           HB3      ALA  19 -30.963  20.161  25.562
  146    H    GLN  20           H        GLN  20 -27.087  20.724  25.703
  147    HA   GLN  20           HA       GLN  20 -25.935  20.417  28.323
  148    HB2  GLN  20           HB2      GLN  20 -24.640  20.994  25.589
  149    HB3  GLN  20           HB3      GLN  20 -23.710  20.731  27.084
  150    HG2  GLN  20           HG2      GLN  20 -24.592  18.468  27.371
  151    HG3  GLN  20           HG3      GLN  20 -25.719  18.637  26.020
  152   HE21  GLN  20          HE21      GLN  20 -22.112  18.791  26.776
  153   HE22  GLN  20          HE22      GLN  20 -21.653  18.180  25.230
  154    H    ASP  21           H        ASP  21 -26.303  23.294  26.221
  155    HA   ASP  21           HA       ASP  21 -24.534  24.945  27.817
  156    HB2  ASP  21           HB2      ASP  21 -25.658  25.327  25.380
  157    HB3  ASP  21           HB3      ASP  21 -26.918  26.167  26.296
  158    H    PHE  22           H        PHE  22 -28.088  24.314  27.791
  159    HA   PHE  22           HA       PHE  22 -28.675  26.171  29.941
  160    HB2  PHE  22           HB2      PHE  22 -30.370  25.443  28.300
  161    HB3  PHE  22           HB3      PHE  22 -30.186  23.752  28.812
  162    HD1  PHE  22           HD1      PHE  22 -30.886  27.147  30.396
  163    HD2  PHE  22           HD2      PHE  22 -31.784  22.930  30.332
  164    HE1  PHE  22           HE1      PHE  22 -32.697  27.489  32.048
  165    HE2  PHE  22           HE2      PHE  22 -33.509  23.270  32.044
  166    HZ   PHE  22           HZ       PHE  22 -34.038  25.564  32.847
  167    H    ILE  23           H        ILE  23 -28.078  22.579  29.879
  168    HA   ILE  23           HA       ILE  23 -28.290  22.313  32.749
  169    HB   ILE  23           HB       ILE  23 -26.888  20.643  30.597
  170   HG12  ILE  23          HG12      ILE  23 -28.361  18.830  31.442
  171   HG13  ILE  23          HG13      ILE  23 -28.948  19.869  32.758
  172   HG21  ILE  23          HG21      ILE  23 -26.136  19.041  32.389
  173   HG22  ILE  23          HG22      ILE  23 -25.257  20.581  32.445
  174   HG23  ILE  23          HG23      ILE  23 -26.560  20.257  33.624
  175   HD11  ILE  23          HD11      ILE  23 -30.656  19.702  30.999
  176   HD12  ILE  23          HD12      ILE  23 -30.040  21.370  31.023
  177   HD13  ILE  23          HD13      ILE  23 -29.501  20.226  29.750
  178    H    GLU  24           H        GLU  24 -25.539  23.365  30.535
  179    HA   GLU  24           HA       GLU  24 -23.650  23.403  32.674
  180    HB2  GLU  24           HB2      GLU  24 -23.050  23.867  30.178
  181    HB3  GLU  24           HB3      GLU  24 -23.676  25.509  30.423
  182    HG2  GLU  24           HG2      GLU  24 -21.258  25.501  30.696
  183    HG3  GLU  24           HG3      GLU  24 -22.028  25.875  32.264
  184    H    TRP  25           H        TRP  25 -25.960  25.926  31.434
  185    HA   TRP  25           HA       TRP  25 -25.131  27.899  33.316
  186    HB2  TRP  25           HB2      TRP  25 -26.406  28.374  31.318
  187    HB3  TRP  25           HB3      TRP  25 -27.833  27.498  31.917
  188    HD1  TRP  25           HD1      TRP  25 -25.723  30.667  32.809
  189    HE1  TRP  25           HE1      TRP  25 -27.263  32.348  33.894
  190    HE3  TRP  25           HE3      TRP  25 -30.048  27.815  33.058
  191    HZ2  TRP  25           HZ2      TRP  25 -29.832  32.514  34.829
  192    HZ3  TRP  25           HZ3      TRP  25 -32.059  28.882  34.095
  193    HH2  TRP  25           HH2      TRP  25 -31.969  31.219  34.891
  194    H    LEU  26           H        LEU  26 -27.808  25.404  33.654
  195    HA   LEU  26           HA       LEU  26 -28.446  26.339  36.329
  196    HB2  LEU  26           HB2      LEU  26 -28.825  23.578  35.077
  197    HB3  LEU  26           HB3      LEU  26 -29.509  24.064  36.649
  198    HG   LEU  26           HG       LEU  26 -30.252  25.324  33.924
  199   HD11  LEU  26          HD11      LEU  26 -32.452  24.085  34.343
  200   HD12  LEU  26          HD12      LEU  26 -31.050  23.033  34.017
  201   HD13  LEU  26          HD13      LEU  26 -31.659  23.244  35.694
  202   HD21  LEU  26          HD21      LEU  26 -31.507  25.721  36.731
  203   HD22  LEU  26          HD22      LEU  26 -30.643  26.966  35.791
  204   HD23  LEU  26          HD23      LEU  26 -32.184  26.342  35.199
  205    H    LYS  27           H        LYS  27 -26.376  23.541  35.202
  206    HA   LYS  27           HA       LYS  27 -25.467  22.668  37.722
  207    HB2  LYS  27           HB2      LYS  27 -24.840  21.584  35.533
  208    HB3  LYS  27           HB3      LYS  27 -23.915  23.024  35.094
  209    HG2  LYS  27           HG2      LYS  27 -22.427  22.509  37.241
  210    HG3  LYS  27           HG3      LYS  27 -23.275  20.953  37.239
  211    HD2  LYS  27           HD2      LYS  27 -21.260  20.523  36.020
  212    HD3  LYS  27           HD3      LYS  27 -22.452  20.763  34.717
  213    HE2  LYS  27           HE2      LYS  27 -21.656  23.230  34.631
  214    HE3  LYS  27           HE3      LYS  27 -20.392  22.804  35.799
  215    HZ1  LYS  27           HZ1      LYS  27 -19.483  22.760  33.511
  216    HZ2  LYS  27           HZ2      LYS  27 -19.477  21.155  34.117
  217    HZ3  LYS  27           HZ3      LYS  27 -20.691  21.681  32.984
  218    H    ASN  28           H        ASN  28 -24.300  25.371  35.662
  219    HA   ASN  28           HA       ASN  28 -22.043  25.974  37.373
  220    HB2  ASN  28           HB2      ASN  28 -22.203  26.372  34.899
  221    HB3  ASN  28           HB3      ASN  28 -23.456  27.625  35.189
  222   HD21  ASN  28          HD21      ASN  28 -21.705  28.438  33.553
  223   HD22  ASN  28          HD22      ASN  28 -20.459  29.381  34.267
  224    H    GLY  29           H        GLY  29 -25.460  27.169  37.105
  225    HA2  GLY  29           HA2      GLY  29 -25.432  28.069  39.802
  226    HA3  GLY  29           HA3      GLY  29 -25.110  29.474  38.771
  227    H    GLY  30           H        GLY  30 -26.915  28.872  36.492
  228    HA2  GLY  30           HA2      GLY  30 -29.202  28.835  36.001
  229    HA3  GLY  30           HA3      GLY  30 -29.554  28.393  37.680
  230    HA   PRO  31           HA       PRO  31 -30.742  32.933  37.111
  231    HB2  PRO  31           HB2      PRO  31 -31.963  32.028  39.794
  232    HB3  PRO  31           HB3      PRO  31 -32.651  33.198  38.622
  233    HG2  PRO  31           HG2      PRO  31 -33.622  30.656  38.613
  234    HG3  PRO  31           HG3      PRO  31 -33.132  31.370  37.046
  235    HD2  PRO  31           HD2      PRO  31 -31.503  29.446  38.799
  236    HD3  PRO  31           HD3      PRO  31 -31.781  29.352  37.018
  237    H    SER  32           H        SER  32 -29.513  31.131  40.040
  238    HA   SER  32           HA       SER  32 -28.425  33.475  41.308
  239    HB2  SER  32           HB2      SER  32 -28.771  31.324  42.521
  240    HB3  SER  32           HB3      SER  32 -27.521  30.541  41.516
  241    HG   SER  32           HG       SER  32 -27.000  32.754  43.292
  242    H    SER  33           H        SER  33 -27.176  31.535  38.532
  243    HA   SER  33           HA       SER  33 -24.444  31.999  38.779
  244    HB2  SER  33           HB2      SER  33 -25.388  30.840  36.742
  245    HB3  SER  33           HB3      SER  33 -26.158  32.359  36.234
  246    HG   SER  33           HG       SER  33 -23.308  32.013  36.422
  247    H    GLY  34           H        GLY  34 -26.965  34.385  37.594
  248    HA2  GLY  34           HA2      GLY  34 -26.624  36.765  37.637
  249    HA3  GLY  34           HA3      GLY  34 -24.867  36.545  37.790
  250    H    ALA  35           H        ALA  35 -24.458  34.497  35.671
  251    HA   ALA  35           HA       ALA  35 -24.333  36.171  33.413
  252    HB1  ALA  35           HB1      ALA  35 -23.967  34.103  32.076
  253    HB2  ALA  35           HB2      ALA  35 -22.984  34.109  33.574
  254    HB3  ALA  35           HB3      ALA  35 -24.457  33.100  33.474
  255    HA   PRO  36           HA       PRO  36 -28.832  35.893  32.370
  256    HB2  PRO  36           HB2      PRO  36 -27.525  36.257  29.606
  257    HB3  PRO  36           HB3      PRO  36 -29.075  36.981  30.143
  258    HG2  PRO  36           HG2      PRO  36 -26.878  38.551  30.245
  259    HG3  PRO  36           HG3      PRO  36 -27.865  38.428  31.737
  260    HD2  PRO  36           HD2      PRO  36 -25.247  36.894  31.117
  261    HD3  PRO  36           HD3      PRO  36 -25.732  37.824  32.596
  262    HA   PRO  37           HA       PRO  37 -28.665  31.629  31.145
  263    HB2  PRO  37           HB2      PRO  37 -31.199  31.100  30.020
  264    HB3  PRO  37           HB3      PRO  37 -30.970  31.491  31.755
  265    HG2  PRO  37           HG2      PRO  37 -31.623  33.455  29.505
  266    HG3  PRO  37           HG3      PRO  37 -32.568  33.199  31.006
  267    HD2  PRO  37           HD2      PRO  37 -30.751  35.231  30.894
  268    HD3  PRO  37           HD3      PRO  37 -30.767  34.195  32.376
  269    HA   PRO  38           HA       PRO  38 -27.524  31.513  26.788
  270    HB2  PRO  38           HB2      PRO  38 -27.648  28.806  26.197
  271    HB3  PRO  38           HB3      PRO  38 -26.470  29.504  27.349
  272    HG2  PRO  38           HG2      PRO  38 -29.161  28.211  28.054
  273    HG3  PRO  38           HG3      PRO  38 -27.535  27.805  28.694
  274    HD2  PRO  38           HD2      PRO  38 -29.233  29.489  30.061
  275    HD3  PRO  38           HD3      PRO  38 -27.474  29.894  29.984
  276    H    SER  39           H        SER  39 -29.501  32.849  26.403
  277    HA   SER  39           HA       SER  39 -31.298  31.485  24.480
  278    HB2  SER  39           HB2      SER  39 -32.320  31.219  26.858
  279    HB3  SER  39           HB3      SER  39 -32.362  32.998  26.947
  280    HG   SER  39           HG       SER  39 -33.808  31.406  25.018
  281    HN1  NH2  40           H11      SER  39 -33.186  33.620  24.126
  282    HN2  NH2  40           H12      SER  39 -32.285  35.006  23.622
  283    H03  D6M 101          H N2      LYS  14 -26.235  31.316  16.344
  284   H121  D6M 101          H101      LYS  14 -27.242  33.489  16.823
  285   H122  D6M 101          H102      LYS  14 -29.015  33.574  16.902
  286    H04  D6M 101           HC2      LYS  14 -28.205  29.053  16.599
  287   H051  D6M 101          HC31      LYS  14 -25.668  29.196  14.903
  288   H052  D6M 101          HC32      LYS  14 -27.314  29.394  14.251
  289   H061  D6M 101          HC41      LYS  14 -26.372  26.869  15.742
  290   H062  D6M 101          HC42      LYS  14 -26.321  27.064  13.973
  291   H131  D6M 101          H111      LYS  14 -28.273  34.736  14.877
  292   H132  D6M 101          H112      LYS  14 -29.154  33.257  14.406
  293   H141  D6M 101          H121      LYS  14 -26.956  32.088  13.984
  294   H142  D6M 101          H122      LYS  14 -26.077  33.553  14.510
  295   H151  D6M 101          H131      LYS  14 -27.182  34.844  12.620
  296   H152  D6M 101          H132      LYS  14 -27.984  33.338  12.091
  297   H161  D6M 101          H141      LYS  14 -25.704  32.287  11.721
  298   H162  D6M 101          H142      LYS  14 -24.937  33.823  12.216
  299   H171  D6M 101          H151      LYS  14 -26.133  35.001  10.308
  300   H172  D6M 101          H152      LYS  14 -26.829  33.435   9.807
  301   H181  D6M 101          H161      LYS  14 -24.484  32.540   9.443
  302   H182  D6M 101          H162      LYS  14 -23.832  34.134   9.920
  303   H191  D6M 101          H171      LYS  14 -25.045  35.204   7.973
  304   H192  D6M 101          H172      LYS  14 -25.751  33.621   7.559
  305   H201  D6M 101          H181      LYS  14 -23.947  34.039   6.022
  306   H202  D6M 101          H182      LYS  14 -23.428  32.715   7.098
  307   H211  D6M 101          H191      LYS  14 -22.018  34.322   8.402
  308   H212  D6M 101          H192      LYS  14 -22.611  35.683   7.404
  309   H221  D6M 101          H201      LYS  14 -21.636  34.518   5.351
  310   H222  D6M 101          H202      LYS  14 -20.927  33.286   6.427
  311   H231  D6M 101          H211      LYS  14 -20.309  36.319   6.453
  312   H232  D6M 101          H212      LYS  14 -19.291  35.048   5.729
  313   H241  D6M 101          H221      LYS  14 -19.021  33.995   8.029
  314   H242  D6M 101          H222      LYS  14 -19.913  35.376   8.734
  315   H251  D6M 101          H231      LYS  14 -18.193  36.966   7.824
  316   H252  D6M 101          H232      LYS  14 -17.280  35.589   7.145
  317   H261  D6M 101          H241      LYS  14 -16.299  36.307   9.333
  318   H262  D6M 101          H242      LYS  14 -17.867  36.033  10.148
  319   H263  D6M 101          H243      LYS  14 -16.959  34.650   9.465
  Start of MODEL    6
    1    H1   HIS   1           H1       HIS   1 -29.832  20.055   2.089
    2    H2   HIS   1           H2       HIS   1 -29.052  21.096   0.992
    3    H3   HIS   1           H3       HIS   1 -28.315  19.615   1.445
    4    HA   HIS   1           HA       HIS   1 -30.952  19.792  -0.076
    5    HB2  HIS   1           HB2      HIS   1 -29.143  20.630  -1.574
    6    HB3  HIS   1           HB3      HIS   1 -28.124  19.222  -1.192
    7    HD1  HIS   1           HD1      HIS   1 -29.027  16.889  -2.046
    8    HD2  HIS   1           HD2      HIS   1 -31.043  20.298  -3.461
    9    HE1  HIS   1           HE1      HIS   1 -30.365  16.108  -4.044
   10    H    DSN   2           HN       DSN   2 -31.911  17.625  -0.439
   11    HA   DSN   2           HA       DSN   2 -30.226  15.284   0.141
   12    HB2  DSN   2           HB1      DSN   2 -32.042  15.232  -1.608
   13    HB3  DSN   2           HB2      DSN   2 -33.256  15.431  -0.300
   14    HG   DSN   2           HOG      DSN   2 -32.865  13.132  -0.746
   15    H    GLN   3           H        GLN   3 -31.384  13.517   1.636
   16    HA   GLN   3           HA       GLN   3 -31.771  12.888   3.810
   17    HB2  GLN   3           HB2      GLN   3 -30.980  15.703   4.672
   18    HB3  GLN   3           HB3      GLN   3 -31.171  14.264   5.691
   19    HG2  GLN   3           HG2      GLN   3 -28.786  14.495   5.252
   20    HG3  GLN   3           HG3      GLN   3 -29.338  13.106   4.294
   21   HE21  GLN   3          HE21      GLN   3 -28.696  16.716   4.094
   22   HE22  GLN   3          HE22      GLN   3 -28.278  16.675   2.421
   23    H    GLY   4           H        GLY   4 -34.049  12.401   3.807
   24    HA2  GLY   4           HA2      GLY   4 -36.071  14.366   3.732
   25    HA3  GLY   4           HA3      GLY   4 -36.251  12.757   4.482
   26    H    THR   5           H        THR   5 -37.364  15.388   5.514
   27    HA   THR   5           HA       THR   5 -37.246  16.733   7.442
   28    HB   THR   5           HB       THR   5 -37.311  15.395   9.533
   29    HG1  THR   5           HG1      THR   5 -35.758  13.697   8.870
   30   HG21  THR   5          HG21      THR   5 -39.379  15.580   8.133
   31   HG22  THR   5          HG22      THR   5 -38.889  14.129   7.218
   32   HG23  THR   5          HG23      THR   5 -39.282  13.995   8.955
   33    H    PHE   6           H        PHE   6 -34.971  17.174   6.067
   34    HA   PHE   6           HA       PHE   6 -32.583  16.532   7.332
   35    HB2  PHE   6           HB2      PHE   6 -32.544  17.709   5.192
   36    HB3  PHE   6           HB3      PHE   6 -33.389  19.109   5.870
   37    HD1  PHE   6           HD1      PHE   6 -30.283  17.039   6.677
   38    HD2  PHE   6           HD2      PHE   6 -32.013  20.979   6.428
   39    HE1  PHE   6           HE1      PHE   6 -28.062  18.043   7.026
   40    HE2  PHE   6           HE2      PHE   6 -29.783  21.972   6.798
   41    HZ   PHE   6           HZ       PHE   6 -27.786  20.509   7.019
   42    H    THR   7           H        THR   7 -34.698  19.464   8.146
   43    HA   THR   7           HA       THR   7 -32.734  20.421   9.958
   44    HB   THR   7           HB       THR   7 -34.682  21.804   9.146
   45    HG1  THR   7           HG1      THR   7 -34.136  21.783  11.970
   46   HG21  THR   7          HG21      THR   7 -36.588  20.226   9.685
   47   HG22  THR   7          HG22      THR   7 -36.257  20.423  11.431
   48   HG23  THR   7          HG23      THR   7 -36.780  21.823  10.466
   49    H    SER   8           H        SER   8 -35.254  17.854  10.453
   50    HA   SER   8           HA       SER   8 -35.320  18.231  13.294
   51    HB2  SER   8           HB2      SER   8 -35.982  15.727  11.651
   52    HB3  SER   8           HB3      SER   8 -36.259  15.908  13.403
   53    HG   SER   8           HG       SER   8 -37.466  17.639  11.442
   54    H    ASP   9           H        ASP   9 -33.290  15.968  11.238
   55    HA   ASP   9           HA       ASP   9 -32.072  14.879  13.614
   56    HB2  ASP   9           HB2      ASP   9 -32.058  13.893  11.141
   57    HB3  ASP   9           HB3      ASP   9 -30.536  14.802  10.983
   58    H    LEU  10           H        LEU  10 -31.536  18.004  11.995
   59    HA   LEU  10           HA       LEU  10 -28.963  18.285  13.508
   60    HB2  LEU  10           HB2      LEU  10 -30.472  20.139  11.613
   61    HB3  LEU  10           HB3      LEU  10 -29.232  20.725  12.748
   62    HG   LEU  10           HG       LEU  10 -27.519  19.203  11.788
   63   HD11  LEU  10          HD11      LEU  10 -29.674  18.398   9.735
   64   HD12  LEU  10          HD12      LEU  10 -27.938  17.980   9.645
   65   HD13  LEU  10          HD13      LEU  10 -28.937  17.313  10.951
   66   HD21  LEU  10          HD21      LEU  10 -27.801  21.515  10.903
   67   HD22  LEU  10          HD22      LEU  10 -27.216  20.391   9.645
   68   HD23  LEU  10          HD23      LEU  10 -28.934  20.909   9.662
   69    H    SER  11           H        SER  11 -32.428  19.495  13.686
   70    HA   SER  11           HA       SER  11 -32.059  21.182  15.836
   71    HB2  SER  11           HB2      SER  11 -34.431  19.285  15.416
   72    HB3  SER  11           HB3      SER  11 -34.428  20.745  16.450
   73    HG   SER  11           HG       SER  11 -35.213  21.205  14.233
   74    H    LYS  12           H        LYS  12 -32.296  17.519  16.009
   75    HA   LYS  12           HA       LYS  12 -32.388  17.440  18.859
   76    HB2  LYS  12           HB2      LYS  12 -31.587  15.172  18.790
   77    HB3  LYS  12           HB3      LYS  12 -32.680  15.400  17.399
   78    HG2  LYS  12           HG2      LYS  12 -30.578  15.786  15.984
   79    HG3  LYS  12           HG3      LYS  12 -29.587  15.310  17.392
   80    HD2  LYS  12           HD2      LYS  12 -30.751  13.041  17.365
   81    HD3  LYS  12           HD3      LYS  12 -31.658  13.576  15.929
   82    HE2  LYS  12           HE2      LYS  12 -29.413  14.027  14.772
   83    HE3  LYS  12           HE3      LYS  12 -28.585  13.273  16.128
   84    HZ1  LYS  12           HZ1      LYS  12 -29.068  11.838  14.005
   85    HZ2  LYS  12           HZ2      LYS  12 -29.544  11.124  15.531
   86    HZ3  LYS  12           HZ3      LYS  12 -30.708  11.816  14.489
   87    H    GLN  13           H        GLN  13 -29.585  17.922  16.592
   88    HA   GLN  13           HA       GLN  13 -27.635  17.560  18.738
   89    HB2  GLN  13           HB2      GLN  13 -27.257  18.966  16.021
   90    HB3  GLN  13           HB3      GLN  13 -25.989  18.447  17.155
   91    HG2  GLN  13           HG2      GLN  13 -26.818  16.029  16.882
   92    HG3  GLN  13           HG3      GLN  13 -27.848  16.594  15.543
   93   HE21  GLN  13          HE21      GLN  13 -26.509  18.064  13.815
   94   HE22  GLN  13          HE22      GLN  13 -25.018  17.343  13.367
   95    H    LYS  14           HN       LYS  14 -29.324  20.346  17.114
   96    HA   LYS  14           HA       LYS  14 -27.802  22.314  18.600
   97    HB2  LYS  14           HB2      LYS  14 -30.576  22.555  17.273
   98    HB3  LYS  14           HB3      LYS  14 -29.622  23.915  17.911
   99    HG2  LYS  14          HC81      LYS  14 -27.755  23.348  16.347
  100    HG3  LYS  14          HC82      LYS  14 -28.718  22.053  15.602
  101    HD2  LYS  14          HC71      LYS  14 -30.459  23.722  14.908
  102    HD3  LYS  14          HC72      LYS  14 -29.482  25.029  15.632
  103    HE2  LYS  14          HC61      LYS  14 -28.614  23.212  13.299
  104    HE3  LYS  14          HC62      LYS  14 -29.104  24.914  13.157
  105    HZ1  LYS  14          H N1      LYS  14 -26.548  23.874  14.215
  106    H    ASP  15           H        ASP  15 -30.923  20.596  19.199
  107    HA   ASP  15           HA       ASP  15 -31.533  22.076  21.586
  108    HB2  ASP  15           HB2      ASP  15 -33.225  20.675  20.382
  109    HB3  ASP  15           HB3      ASP  15 -32.297  19.211  20.772
  110    H    SER  16           H        SER  16 -29.545  19.053  20.835
  111    HA   SER  16           HA       SER  16 -29.051  18.484  23.586
  112    HB2  SER  16           HB2      SER  16 -28.401  16.934  21.689
  113    HB3  SER  16           HB3      SER  16 -27.044  18.014  21.288
  114    HG   SER  16           HG       SER  16 -26.293  17.563  23.549
  115    H    ARG  17           H        ARG  17 -27.260  20.687  21.215
  116    HA   ARG  17           HA       ARG  17 -25.276  21.368  23.139
  117    HB2  ARG  17           HB2      ARG  17 -25.147  21.809  20.628
  118    HB3  ARG  17           HB3      ARG  17 -26.325  23.117  20.839
  119    HG2  ARG  17           HG2      ARG  17 -24.684  24.044  22.648
  120    HG3  ARG  17           HG3      ARG  17 -23.504  22.854  22.048
  121    HD2  ARG  17           HD2      ARG  17 -23.670  23.951  19.754
  122    HD3  ARG  17           HD3      ARG  17 -24.837  25.125  20.466
  123    HE   ARG  17           HE       ARG  17 -22.409  25.123  22.023
  124   HH11  ARG  17          HH11      ARG  17 -20.964  26.829  21.829
  125   HH12  ARG  17          HH12      ARG  17 -20.981  27.862  20.407
  126   HH21  ARG  17          HH21      ARG  17 -23.609  26.189  18.795
  127   HH22  ARG  17          HH22      ARG  17 -22.438  27.491  18.718
  128    H    ARG  18           H        ARG  18 -28.343  23.146  22.148
  129    HA   ARG  18           HA       ARG  18 -27.879  25.257  24.046
  130    HB2  ARG  18           HB2      ARG  18 -30.403  24.213  22.630
  131    HB3  ARG  18           HB3      ARG  18 -30.491  25.579  23.745
  132    HG2  ARG  18           HG2      ARG  18 -28.588  25.537  21.308
  133    HG3  ARG  18           HG3      ARG  18 -30.279  26.064  21.185
  134    HD2  ARG  18           HD2      ARG  18 -29.933  27.811  22.902
  135    HD3  ARG  18           HD3      ARG  18 -28.232  27.449  23.065
  136    HE   ARG  18           HE       ARG  18 -29.602  28.926  20.928
  137   HH11  ARG  18          HH11      ARG  18 -28.372  29.923  19.360
  138   HH12  ARG  18          HH12      ARG  18 -26.680  29.479  19.138
  139   HH21  ARG  18          HH21      ARG  18 -26.582  27.045  21.630
  140   HH22  ARG  18          HH22      ARG  18 -25.717  27.886  20.348
  141    H    ALA  19           H        ALA  19 -29.537  22.068  24.324
  142    HA   ALA  19           HA       ALA  19 -30.676  22.638  26.927
  143    HB1  ALA  19           HB1      ALA  19 -30.040  19.945  25.573
  144    HB2  ALA  19           HB2      ALA  19 -31.050  20.176  27.021
  145    HB3  ALA  19           HB3      ALA  19 -31.569  20.860  25.455
  146    H    GLN  20           H        GLN  20 -27.647  20.854  25.815
  147    HA   GLN  20           HA       GLN  20 -26.676  20.366  28.461
  148    HB2  GLN  20           HB2      GLN  20 -25.178  20.806  25.816
  149    HB3  GLN  20           HB3      GLN  20 -24.362  20.403  27.340
  150    HG2  GLN  20           HG2      GLN  20 -25.551  18.251  27.533
  151    HG3  GLN  20           HG3      GLN  20 -26.508  18.574  26.084
  152   HE21  GLN  20          HE21      GLN  20 -23.050  18.185  27.238
  153   HE22  GLN  20          HE22      GLN  20 -22.492  17.592  25.717
  154    H    ASP  21           H        ASP  21 -26.503  23.277  26.328
  155    HA   ASP  21           HA       ASP  21 -24.550  24.652  27.990
  156    HB2  ASP  21           HB2      ASP  21 -25.125  25.062  25.525
  157    HB3  ASP  21           HB3      ASP  21 -26.550  25.962  26.110
  158    H    PHE  22           H        PHE  22 -28.228  24.596  27.739
  159    HA   PHE  22           HA       PHE  22 -28.670  26.522  29.846
  160    HB2  PHE  22           HB2      PHE  22 -30.424  25.670  28.244
  161    HB3  PHE  22           HB3      PHE  22 -30.391  24.104  29.077
  162    HD1  PHE  22           HD1      PHE  22 -31.007  27.792  29.523
  163    HD2  PHE  22           HD2      PHE  22 -31.618  23.881  31.202
  164    HE1  PHE  22           HE1      PHE  22 -32.497  28.755  31.246
  165    HE2  PHE  22           HE2      PHE  22 -33.370  24.817  32.691
  166    HZ   PHE  22           HZ       PHE  22 -33.717  27.268  32.798
  167    H    ILE  23           H        ILE  23 -28.103  22.946  29.869
  168    HA   ILE  23           HA       ILE  23 -28.427  22.836  32.771
  169    HB   ILE  23           HB       ILE  23 -27.239  20.898  30.745
  170   HG12  ILE  23          HG12      ILE  23 -29.838  20.707  32.420
  171   HG13  ILE  23          HG13      ILE  23 -29.803  21.444  30.808
  172   HG21  ILE  23          HG21      ILE  23 -27.218  19.175  32.572
  173   HG22  ILE  23          HG22      ILE  23 -26.095  20.500  32.909
  174   HG23  ILE  23          HG23      ILE  23 -27.672  20.435  33.749
  175   HD11  ILE  23          HD11      ILE  23 -30.560  19.168  30.537
  176   HD12  ILE  23          HD12      ILE  23 -28.929  19.297  29.829
  177   HD13  ILE  23          HD13      ILE  23 -29.159  18.502  31.415
  178    H    GLU  24           H        GLU  24 -25.603  23.475  30.544
  179    HA   GLU  24           HA       GLU  24 -23.639  23.365  32.626
  180    HB2  GLU  24           HB2      GLU  24 -23.179  23.819  30.067
  181    HB3  GLU  24           HB3      GLU  24 -23.625  25.496  30.426
  182    HG2  GLU  24           HG2      GLU  24 -21.249  25.424  30.561
  183    HG3  GLU  24           HG3      GLU  24 -21.827  25.524  32.241
  184    H    TRP  25           H        TRP  25 -25.914  25.951  31.468
  185    HA   TRP  25           HA       TRP  25 -25.026  27.915  33.356
  186    HB2  TRP  25           HB2      TRP  25 -26.300  28.474  31.379
  187    HB3  TRP  25           HB3      TRP  25 -27.725  27.568  31.929
  188    HD1  TRP  25           HD1      TRP  25 -25.749  30.790  32.788
  189    HE1  TRP  25           HE1      TRP  25 -27.363  32.404  33.890
  190    HE3  TRP  25           HE3      TRP  25 -29.906  27.693  33.197
  191    HZ2  TRP  25           HZ2      TRP  25 -29.913  32.436  34.883
  192    HZ3  TRP  25           HZ3      TRP  25 -31.928  28.643  34.349
  193    HH2  TRP  25           HH2      TRP  25 -31.931  30.989  35.138
  194    H    LEU  26           H        LEU  26 -27.738  25.422  33.697
  195    HA   LEU  26           HA       LEU  26 -28.332  26.284  36.400
  196    HB2  LEU  26           HB2      LEU  26 -28.613  23.481  35.219
  197    HB3  LEU  26           HB3      LEU  26 -29.258  23.993  36.788
  198    HG   LEU  26           HG       LEU  26 -30.153  25.136  34.067
  199   HD11  LEU  26          HD11      LEU  26 -32.229  23.789  34.509
  200   HD12  LEU  26          HD12      LEU  26 -30.791  22.748  34.358
  201   HD13  LEU  26          HD13      LEU  26 -31.474  23.107  35.971
  202   HD21  LEU  26          HD21      LEU  26 -31.291  25.580  36.908
  203   HD22  LEU  26          HD22      LEU  26 -30.545  26.819  35.866
  204   HD23  LEU  26          HD23      LEU  26 -32.080  26.095  35.391
  205    H    LYS  27           H        LYS  27 -26.204  23.572  35.230
  206    HA   LYS  27           HA       LYS  27 -25.181  22.710  37.723
  207    HB2  LYS  27           HB2      LYS  27 -24.645  21.716  35.447
  208    HB3  LYS  27           HB3      LYS  27 -23.735  23.179  35.066
  209    HG2  LYS  27           HG2      LYS  27 -22.193  22.556  37.114
  210    HG3  LYS  27           HG3      LYS  27 -23.056  21.004  37.105
  211    HD2  LYS  27           HD2      LYS  27 -21.112  20.592  35.774
  212    HD3  LYS  27           HD3      LYS  27 -22.392  20.835  34.567
  213    HE2  LYS  27           HE2      LYS  27 -21.577  23.264  34.290
  214    HE3  LYS  27           HE3      LYS  27 -20.360  22.936  35.530
  215    HZ1  LYS  27           HZ1      LYS  27 -19.369  22.756  33.306
  216    HZ2  LYS  27           HZ2      LYS  27 -19.409  21.162  33.969
  217    HZ3  LYS  27           HZ3      LYS  27 -20.574  21.601  32.800
  218    H    ASN  28           H        ASN  28 -24.237  25.533  35.684
  219    HA   ASN  28           HA       ASN  28 -22.006  26.233  37.486
  220    HB2  ASN  28           HB2      ASN  28 -22.051  26.365  34.963
  221    HB3  ASN  28           HB3      ASN  28 -23.232  27.715  35.092
  222   HD21  ASN  28          HD21      ASN  28 -21.332  28.289  33.527
  223   HD22  ASN  28          HD22      ASN  28 -20.039  29.159  34.251
  224    H    GLY  29           H        GLY  29 -25.423  26.732  37.815
  225    HA2  GLY  29           HA2      GLY  29 -25.472  28.021  40.070
  226    HA3  GLY  29           HA3      GLY  29 -25.056  29.422  39.071
  227    H    GLY  30           H        GLY  30 -26.816  28.412  36.706
  228    HA2  GLY  30           HA2      GLY  30 -29.064  28.681  36.105
  229    HA3  GLY  30           HA3      GLY  30 -29.503  28.313  37.789
  230    HA   PRO  31           HA       PRO  31 -30.208  32.960  37.273
  231    HB2  PRO  31           HB2      PRO  31 -31.336  32.183  40.027
  232    HB3  PRO  31           HB3      PRO  31 -31.964  33.442  38.910
  233    HG2  PRO  31           HG2      PRO  31 -33.247  31.067  38.914
  234    HG3  PRO  31           HG3      PRO  31 -32.708  31.701  37.334
  235    HD2  PRO  31           HD2      PRO  31 -31.247  29.609  39.074
  236    HD3  PRO  31           HD3      PRO  31 -31.666  29.492  37.323
  237    H    SER  32           H        SER  32 -28.940  30.998  40.094
  238    HA   SER  32           HA       SER  32 -27.469  33.216  41.215
  239    HB2  SER  32           HB2      SER  32 -27.994  31.071  42.468
  240    HB3  SER  32           HB3      SER  32 -26.747  30.244  41.496
  241    HG   SER  32           HG       SER  32 -25.234  31.893  42.412
  242    H    SER  33           H        SER  33 -26.822  31.334  38.254
  243    HA   SER  33           HA       SER  33 -23.975  31.594  38.306
  244    HB2  SER  33           HB2      SER  33 -25.174  30.250  36.551
  245    HB3  SER  33           HB3      SER  33 -25.805  31.759  35.839
  246    HG   SER  33           HG       SER  33 -23.468  32.312  35.509
  247    H    GLY  34           H        GLY  34 -26.710  33.863  37.473
  248    HA2  GLY  34           HA2      GLY  34 -26.432  36.231  37.797
  249    HA3  GLY  34           HA3      GLY  34 -24.699  36.110  37.430
  250    H    ALA  35           H        ALA  35 -24.397  34.764  35.111
  251    HA   ALA  35           HA       ALA  35 -25.086  36.578  33.163
  252    HB1  ALA  35           HB1      ALA  35 -24.695  34.789  31.458
  253    HB2  ALA  35           HB2      ALA  35 -23.446  34.771  32.738
  254    HB3  ALA  35           HB3      ALA  35 -24.752  33.548  32.749
  255    HA   PRO  36           HA       PRO  36 -29.583  35.710  32.579
  256    HB2  PRO  36           HB2      PRO  36 -28.773  36.179  29.650
  257    HB3  PRO  36           HB3      PRO  36 -30.252  36.787  30.451
  258    HG2  PRO  36           HG2      PRO  36 -28.190  38.509  30.143
  259    HG3  PRO  36           HG3      PRO  36 -28.943  38.369  31.766
  260    HD2  PRO  36           HD2      PRO  36 -26.301  37.062  30.824
  261    HD3  PRO  36           HD3      PRO  36 -26.680  37.988  32.332
  262    HA   PRO  37           HA       PRO  37 -29.127  31.478  31.303
  263    HB2  PRO  37           HB2      PRO  37 -31.616  30.768  30.157
  264    HB3  PRO  37           HB3      PRO  37 -31.403  31.088  31.914
  265    HG2  PRO  37           HG2      PRO  37 -32.293  33.082  29.786
  266    HG3  PRO  37           HG3      PRO  37 -33.157  32.678  31.300
  267    HD2  PRO  37           HD2      PRO  37 -31.541  34.867  31.219
  268    HD3  PRO  37           HD3      PRO  37 -31.392  33.788  32.663
  269    HA   PRO  38           HA       PRO  38 -27.942  31.840  26.956
  270    HB2  PRO  38           HB2      PRO  38 -27.499  29.219  26.238
  271    HB3  PRO  38           HB3      PRO  38 -26.530  30.058  27.495
  272    HG2  PRO  38           HG2      PRO  38 -28.934  28.253  28.021
  273    HG3  PRO  38           HG3      PRO  38 -27.267  28.066  28.649
  274    HD2  PRO  38           HD2      PRO  38 -29.220  29.367  30.119
  275    HD3  PRO  38           HD3      PRO  38 -27.556  30.051  30.091
  276    H    SER  39           H        SER  39 -30.033  32.789  26.341
  277    HA   SER  39           HA       SER  39 -31.809  30.915  24.812
  278    HB2  SER  39           HB2      SER  39 -32.657  30.981  27.170
  279    HB3  SER  39           HB3      SER  39 -32.671  32.769  27.112
  280    HG   SER  39           HG       SER  39 -34.802  31.877  26.561
  281    HN1  NH2  40           H11      SER  39 -33.827  32.557  24.027
  282    HN2  NH2  40           H12      SER  39 -33.170  33.914  23.181
  283    H03  D6M 101          H N2      LYS  14 -25.651  30.113  16.964
  284   H121  D6M 101          H101      LYS  14 -26.554  32.074  15.917
  285   H122  D6M 101          H102      LYS  14 -28.155  31.885  16.681
  286    H04  D6M 101           HC2      LYS  14 -27.138  27.585  16.604
  287   H051  D6M 101          HC31      LYS  14 -24.317  27.920  15.450
  288   H052  D6M 101          HC32      LYS  14 -25.714  28.339  14.437
  289   H061  D6M 101          HC41      LYS  14 -25.256  25.553  15.652
  290   H062  D6M 101          HC42      LYS  14 -24.902  26.034  13.974
  291   H131  D6M 101          H111      LYS  14 -28.318  33.194  14.567
  292   H132  D6M 101          H112      LYS  14 -29.211  31.659  14.404
  293   H141  D6M 101          H121      LYS  14 -27.220  30.656  13.188
  294   H142  D6M 101          H122      LYS  14 -26.348  32.202  13.377
  295   H151  D6M 101          H131      LYS  14 -28.135  33.362  12.030
  296   H152  D6M 101          H132      LYS  14 -28.981  31.804  11.811
  297   H161  D6M 101          H141      LYS  14 -26.976  30.875  10.598
  298   H162  D6M 101          H142      LYS  14 -26.104  32.411  10.867
  299   H171  D6M 101          H151      LYS  14 -27.881  33.632   9.563
  300   H172  D6M 101          H152      LYS  14 -28.701  32.081   9.238
  301   H181  D6M 101          H161      LYS  14 -26.710  31.270   7.970
  302   H182  D6M 101          H162      LYS  14 -25.829  32.764   8.392
  303   H191  D6M 101          H171      LYS  14 -27.574  34.118   7.116
  304   H192  D6M 101          H172      LYS  14 -28.424  32.619   6.726
  305   H201  D6M 101          H181      LYS  14 -27.062  33.406   4.803
  306   H202  D6M 101          H182      LYS  14 -26.570  31.789   5.359
  307   H211  D6M 101          H191      LYS  14 -24.635  33.192   4.725
  308   H212  D6M 101          H192      LYS  14 -24.529  32.708   6.427
  309   H221  D6M 101          H201      LYS  14 -25.424  34.986   7.108
  310   H222  D6M 101          H202      LYS  14 -25.468  35.468   5.393
  311   H231  D6M 101          H211      LYS  14 -22.967  34.638   7.002
  312   H232  D6M 101          H212      LYS  14 -23.482  36.322   6.708
  313   H241  D6M 101          H221      LYS  14 -23.278  35.937   4.222
  314   H242  D6M 101          H222      LYS  14 -22.561  34.333   4.537
  315   H251  D6M 101          H231      LYS  14 -21.388  37.027   5.494
  316   H252  D6M 101          H232      LYS  14 -20.842  36.104   4.075
  317   H261  D6M 101          H241      LYS  14 -20.226  34.152   5.588
  318   H262  D6M 101          H242      LYS  14 -19.308  35.643   5.939
  319   H263  D6M 101          H243      LYS  14 -20.642  35.156   7.010
  Start of MODEL    7
    1    H1   HIS   1           H1       HIS   1 -29.048  18.323   0.599
    2    H2   HIS   1           H2       HIS   1 -28.491  16.932   1.429
    3    H3   HIS   1           H3       HIS   1 -29.914  17.753   1.937
    4    HA   HIS   1           HA       HIS   1 -31.178  17.050  -0.011
    5    HB2  HIS   1           HB2      HIS   1 -30.077  15.374  -1.652
    6    HB3  HIS   1           HB3      HIS   1 -29.598  17.071  -1.843
    7    HD1  HIS   1           HD1      HIS   1 -27.225  17.714  -1.306
    8    HD2  HIS   1           HD2      HIS   1 -28.140  13.679  -0.563
    9    HE1  HIS   1           HE1      HIS   1 -24.999  16.573  -0.893
   10    H    DSN   2           HN       DSN   2 -32.078  14.697  -0.257
   11    HA   DSN   2           HA       DSN   2 -31.024  12.673   1.499
   12    HB2  DSN   2           HB1      DSN   2 -32.714  12.155  -0.288
   13    HB3  DSN   2           HB2      DSN   2 -33.932  13.084   0.637
   14    HG   DSN   2           HOG      DSN   2 -33.969  10.761   1.218
   15    H    GLN   3           H        GLN   3 -32.368  11.897   3.541
   16    HA   GLN   3           HA       GLN   3 -33.205  12.428   5.678
   17    HB2  GLN   3           HB2      GLN   3 -31.342  14.823   5.186
   18    HB3  GLN   3           HB3      GLN   3 -32.019  14.350   6.761
   19    HG2  GLN   3           HG2      GLN   3 -29.695  13.466   6.529
   20    HG3  GLN   3           HG3      GLN   3 -30.873  12.137   6.635
   21   HE21  GLN   3          HE21      GLN   3 -29.276  14.218   4.002
   22   HE22  GLN   3          HE22      GLN   3 -28.972  12.860   2.994
   23    H    GLY   4           H        GLY   4 -35.378  12.728   4.380
   24    HA2  GLY   4           HA2      GLY   4 -36.376  15.265   3.783
   25    HA3  GLY   4           HA3      GLY   4 -37.399  13.941   4.412
   26    H    THR   5           H        THR   5 -37.893  16.717   5.057
   27    HA   THR   5           HA       THR   5 -38.318  18.029   6.862
   28    HB   THR   5           HB       THR   5 -38.581  17.317   9.069
   29    HG1  THR   5           HG1      THR   5 -36.603  16.099   9.481
   30   HG21  THR   5          HG21      THR   5 -40.192  16.318   7.406
   31   HG22  THR   5          HG22      THR   5 -39.144  14.869   7.286
   32   HG23  THR   5          HG23      THR   5 -39.941  15.267   8.834
   33    H    PHE   6           H        PHE   6 -35.171  16.233   7.592
   34    HA   PHE   6           HA       PHE   6 -33.103  17.099   7.950
   35    HB2  PHE   6           HB2      PHE   6 -33.511  17.990   5.701
   36    HB3  PHE   6           HB3      PHE   6 -34.121  19.513   6.344
   37    HD1  PHE   6           HD1      PHE   6 -31.116  17.369   5.990
   38    HD2  PHE   6           HD2      PHE   6 -32.594  21.138   7.424
   39    HE1  PHE   6           HE1      PHE   6 -28.783  18.198   6.235
   40    HE2  PHE   6           HE2      PHE   6 -30.293  22.050   7.407
   41    HZ   PHE   6           HZ       PHE   6 -28.376  20.569   6.845
   42    H    THR   7           H        THR   7 -35.258  20.050   8.586
   43    HA   THR   7           HA       THR   7 -33.558  21.079  10.522
   44    HB   THR   7           HB       THR   7 -35.625  22.239   9.648
   45    HG1  THR   7           HG1      THR   7 -35.443  22.291  12.494
   46   HG21  THR   7          HG21      THR   7 -37.313  20.357  10.003
   47   HG22  THR   7          HG22      THR   7 -37.149  20.587  11.768
   48   HG23  THR   7          HG23      THR   7 -37.788  21.908  10.758
   49    H    SER   8           H        SER   8 -35.762  18.217  10.912
   50    HA   SER   8           HA       SER   8 -35.776  18.398  13.814
   51    HB2  SER   8           HB2      SER   8 -36.435  15.999  12.039
   52    HB3  SER   8           HB3      SER   8 -36.603  16.112  13.810
   53    HG   SER   8           HG       SER   8 -38.008  17.845  11.974
   54    H    ASP   9           H        ASP   9 -33.884  16.323  11.395
   55    HA   ASP   9           HA       ASP   9 -32.435  15.039  13.521
   56    HB2  ASP   9           HB2      ASP   9 -32.652  14.267  11.034
   57    HB3  ASP   9           HB3      ASP   9 -31.286  15.365  10.710
   58    H    LEU  10           H        LEU  10 -32.009  18.252  11.934
   59    HA   LEU  10           HA       LEU  10 -29.405  18.578  13.358
   60    HB2  LEU  10           HB2      LEU  10 -31.122  20.475  11.690
   61    HB3  LEU  10           HB3      LEU  10 -29.825  21.054  12.763
   62    HG   LEU  10           HG       LEU  10 -28.137  19.660  11.569
   63   HD11  LEU  10          HD11      LEU  10 -30.430  18.932   9.645
   64   HD12  LEU  10          HD12      LEU  10 -28.697  18.586   9.383
   65   HD13  LEU  10          HD13      LEU  10 -29.559  17.791  10.722
   66   HD21  LEU  10          HD21      LEU  10 -28.545  22.025  10.862
   67   HD22  LEU  10          HD22      LEU  10 -28.114  21.010   9.457
   68   HD23  LEU  10          HD23      LEU  10 -29.821  21.475   9.745
   69    H    SER  11           H        SER  11 -32.934  19.358  13.960
   70    HA   SER  11           HA       SER  11 -32.398  21.172  16.058
   71    HB2  SER  11           HB2      SER  11 -34.789  19.216  16.002
   72    HB3  SER  11           HB3      SER  11 -34.570  20.622  17.074
   73    HG   SER  11           HG       SER  11 -34.840  20.808  14.243
   74    H    LYS  12           H        LYS  12 -32.690  17.516  16.167
   75    HA   LYS  12           HA       LYS  12 -32.449  17.390  18.992
   76    HB2  LYS  12           HB2      LYS  12 -31.775  15.084  18.781
   77    HB3  LYS  12           HB3      LYS  12 -32.986  15.416  17.511
   78    HG2  LYS  12           HG2      LYS  12 -31.048  15.788  15.897
   79    HG3  LYS  12           HG3      LYS  12 -29.918  15.235  17.160
   80    HD2  LYS  12           HD2      LYS  12 -31.112  12.991  17.201
   81    HD3  LYS  12           HD3      LYS  12 -32.182  13.588  15.899
   82    HE2  LYS  12           HE2      LYS  12 -30.046  14.078  14.534
   83    HE3  LYS  12           HE3      LYS  12 -29.111  13.183  15.745
   84    HZ1  LYS  12           HZ1      LYS  12 -31.423  12.071  14.073
   85    HZ2  LYS  12           HZ2      LYS  12 -29.841  11.910  13.662
   86    HZ3  LYS  12           HZ3      LYS  12 -30.335  11.114  15.109
   87    H    GLN  13           H        GLN  13 -29.867  17.953  16.495
   88    HA   GLN  13           HA       GLN  13 -27.745  17.538  18.508
   89    HB2  GLN  13           HB2      GLN  13 -27.647  18.756  15.683
   90    HB3  GLN  13           HB3      GLN  13 -26.244  18.485  16.745
   91    HG2  GLN  13           HG2      GLN  13 -28.145  16.303  15.651
   92    HG3  GLN  13           HG3      GLN  13 -26.504  16.633  15.057
   93   HE21  GLN  13          HE21      GLN  13 -24.715  16.582  17.010
   94   HE22  GLN  13          HE22      GLN  13 -24.932  15.255  18.092
   95    H    LYS  14           HN       LYS  14 -29.302  20.397  16.837
   96    HA   LYS  14           HA       LYS  14 -27.718  22.327  18.291
   97    HB2  LYS  14           HB2      LYS  14 -30.586  22.561  17.124
   98    HB3  LYS  14           HB3      LYS  14 -29.616  23.914  17.758
   99    HG2  LYS  14          HC81      LYS  14 -27.809  23.368  16.090
  100    HG3  LYS  14          HC82      LYS  14 -28.896  22.192  15.299
  101    HD2  LYS  14          HC71      LYS  14 -30.579  24.001  14.877
  102    HD3  LYS  14          HC72      LYS  14 -29.492  25.198  15.627
  103    HE2  LYS  14          HC61      LYS  14 -28.878  23.535  13.129
  104    HE3  LYS  14          HC62      LYS  14 -29.291  25.255  13.126
  105    HZ1  LYS  14          H N1      LYS  14 -26.711  24.029  13.921
  106    H    ASP  15           H        ASP  15 -30.729  20.512  19.105
  107    HA   ASP  15           HA       ASP  15 -31.252  22.124  21.420
  108    HB2  ASP  15           HB2      ASP  15 -33.081  20.696  20.444
  109    HB3  ASP  15           HB3      ASP  15 -32.164  19.216  20.841
  110    H    SER  16           H        SER  16 -29.688  18.838  20.847
  111    HA   SER  16           HA       SER  16 -29.006  18.298  23.517
  112    HB2  SER  16           HB2      SER  16 -28.613  16.702  21.798
  113    HB3  SER  16           HB3      SER  16 -27.342  17.707  21.032
  114    HG   SER  16           HG       SER  16 -27.172  16.514  23.660
  115    H    ARG  17           H        ARG  17 -27.292  20.394  21.043
  116    HA   ARG  17           HA       ARG  17 -25.025  20.931  22.673
  117    HB2  ARG  17           HB2      ARG  17 -25.194  21.310  20.199
  118    HB3  ARG  17           HB3      ARG  17 -26.381  22.607  20.464
  119    HG2  ARG  17           HG2      ARG  17 -24.711  23.914  21.739
  120    HG3  ARG  17           HG3      ARG  17 -23.506  22.594  21.540
  121    HD2  ARG  17           HD2      ARG  17 -23.531  22.883  19.080
  122    HD3  ARG  17           HD3      ARG  17 -24.875  24.081  19.240
  123    HE   ARG  17           HE       ARG  17 -22.549  24.913  20.765
  124   HH11  ARG  17          HH11      ARG  17 -21.391  26.699  20.007
  125   HH12  ARG  17          HH12      ARG  17 -21.512  27.173  18.315
  126   HH21  ARG  17          HH21      ARG  17 -23.707  24.621  17.369
  127   HH22  ARG  17          HH22      ARG  17 -22.830  26.065  16.883
  128    H    ARG  18           H        ARG  18 -28.003  23.086  22.182
  129    HA   ARG  18           HA       ARG  18 -26.971  24.695  24.416
  130    HB2  ARG  18           HB2      ARG  18 -29.569  24.954  22.875
  131    HB3  ARG  18           HB3      ARG  18 -29.074  26.046  24.191
  132    HG2  ARG  18           HG2      ARG  18 -27.544  25.708  21.534
  133    HG3  ARG  18           HG3      ARG  18 -28.619  27.055  22.009
  134    HD2  ARG  18           HD2      ARG  18 -26.967  27.409  24.026
  135    HD3  ARG  18           HD3      ARG  18 -25.865  26.305  23.117
  136    HE   ARG  18           HE       ARG  18 -26.797  28.426  21.384
  137   HH11  ARG  18          HH11      ARG  18 -25.478  30.171  20.935
  138   HH12  ARG  18          HH12      ARG  18 -24.047  30.502  21.909
  139   HH21  ARG  18          HH21      ARG  18 -24.600  27.904  24.205
  140   HH22  ARG  18          HH22      ARG  18 -23.585  29.255  23.736
  141    H    ALA  19           H        ALA  19 -28.863  21.781  24.289
  142    HA   ALA  19           HA       ALA  19 -30.288  22.331  26.775
  143    HB1  ALA  19           HB1      ALA  19 -29.562  19.669  25.418
  144    HB2  ALA  19           HB2      ALA  19 -30.667  19.858  26.810
  145    HB3  ALA  19           HB3      ALA  19 -31.100  20.554  25.224
  146    H    GLN  20           H        GLN  20 -27.168  20.630  25.749
  147    HA   GLN  20           HA       GLN  20 -26.328  20.125  28.455
  148    HB2  GLN  20           HB2      GLN  20 -24.697  20.531  25.890
  149    HB3  GLN  20           HB3      GLN  20 -23.991  20.099  27.472
  150    HG2  GLN  20           HG2      GLN  20 -25.351  18.021  27.579
  151    HG3  GLN  20           HG3      GLN  20 -26.094  18.369  26.005
  152   HE21  GLN  20          HE21      GLN  20 -25.214  16.113  25.531
  153   HE22  GLN  20          HE22      GLN  20 -23.587  16.026  24.973
  154    H    ASP  21           H        ASP  21 -25.986  23.016  26.252
  155    HA   ASP  21           HA       ASP  21 -24.199  24.369  28.071
  156    HB2  ASP  21           HB2      ASP  21 -24.763  24.958  25.563
  157    HB3  ASP  21           HB3      ASP  21 -26.146  25.874  26.240
  158    H    PHE  22           H        PHE  22 -27.822  24.376  27.681
  159    HA   PHE  22           HA       PHE  22 -28.230  26.369  29.736
  160    HB2  PHE  22           HB2      PHE  22 -29.979  25.812  28.082
  161    HB3  PHE  22           HB3      PHE  22 -30.075  24.138  28.679
  162    HD1  PHE  22           HD1      PHE  22 -30.395  27.712  29.879
  163    HD2  PHE  22           HD2      PHE  22 -31.588  23.626  30.492
  164    HE1  PHE  22           HE1      PHE  22 -32.087  28.459  31.521
  165    HE2  PHE  22           HE2      PHE  22 -33.348  24.381  32.052
  166    HZ   PHE  22           HZ       PHE  22 -33.541  26.786  32.650
  167    H    ILE  23           H        ILE  23 -28.124  22.734  29.773
  168    HA   ILE  23           HA       ILE  23 -28.634  22.527  32.604
  169    HB   ILE  23           HB       ILE  23 -27.055  20.770  30.673
  170   HG12  ILE  23          HG12      ILE  23 -29.712  20.179  32.134
  171   HG13  ILE  23          HG13      ILE  23 -29.672  21.004  30.564
  172   HG21  ILE  23          HG21      ILE  23 -26.998  19.008  32.508
  173   HG22  ILE  23          HG22      ILE  23 -26.019  20.429  32.889
  174   HG23  ILE  23          HG23      ILE  23 -27.625  20.230  33.647
  175   HD11  ILE  23          HD11      ILE  23 -28.658  18.142  31.077
  176   HD12  ILE  23          HD12      ILE  23 -30.085  18.644  30.142
  177   HD13  ILE  23          HD13      ILE  23 -28.450  19.043  29.549
  178    H    GLU  24           H        GLU  24 -25.574  23.210  30.669
  179    HA   GLU  24           HA       GLU  24 -23.941  23.194  33.000
  180    HB2  GLU  24           HB2      GLU  24 -23.026  23.309  30.632
  181    HB3  GLU  24           HB3      GLU  24 -23.488  25.031  30.581
  182    HG2  GLU  24           HG2      GLU  24 -21.067  24.707  31.236
  183    HG3  GLU  24           HG3      GLU  24 -22.020  25.576  32.463
  184    H    TRP  25           H        TRP  25 -25.811  25.921  31.383
  185    HA   TRP  25           HA       TRP  25 -25.063  27.895  33.248
  186    HB2  TRP  25           HB2      TRP  25 -26.398  28.421  31.264
  187    HB3  TRP  25           HB3      TRP  25 -27.800  27.539  31.909
  188    HD1  TRP  25           HD1      TRP  25 -25.652  30.661  32.808
  189    HE1  TRP  25           HE1      TRP  25 -27.154  32.329  33.994
  190    HE3  TRP  25           HE3      TRP  25 -29.960  27.815  33.165
  191    HZ2  TRP  25           HZ2      TRP  25 -29.672  32.468  35.051
  192    HZ3  TRP  25           HZ3      TRP  25 -31.934  28.855  34.310
  193    HH2  TRP  25           HH2      TRP  25 -31.789  31.151  35.215
  194    H    LEU  26           H        LEU  26 -27.726  25.396  33.642
  195    HA   LEU  26           HA       LEU  26 -28.386  26.400  36.287
  196    HB2  LEU  26           HB2      LEU  26 -28.788  23.601  35.113
  197    HB3  LEU  26           HB3      LEU  26 -29.432  24.148  36.676
  198    HG   LEU  26           HG       LEU  26 -30.183  25.389  33.943
  199   HD11  LEU  26          HD11      LEU  26 -32.365  24.159  34.287
  200   HD12  LEU  26          HD12      LEU  26 -30.984  23.044  34.106
  201   HD13  LEU  26          HD13      LEU  26 -31.671  23.370  35.727
  202   HD21  LEU  26          HD21      LEU  26 -31.384  25.793  36.762
  203   HD22  LEU  26          HD22      LEU  26 -30.564  27.040  35.788
  204   HD23  LEU  26          HD23      LEU  26 -32.119  26.399  35.251
  205    H    LYS  27           H        LYS  27 -26.351  23.521  35.330
  206    HA   LYS  27           HA       LYS  27 -25.657  22.822  37.997
  207    HB2  LYS  27           HB2      LYS  27 -25.178  21.388  36.026
  208    HB3  LYS  27           HB3      LYS  27 -24.055  22.614  35.381
  209    HG2  LYS  27           HG2      LYS  27 -22.473  22.242  37.267
  210    HG3  LYS  27           HG3      LYS  27 -23.643  21.157  38.046
  211    HD2  LYS  27           HD2      LYS  27 -21.866  19.845  36.923
  212    HD3  LYS  27           HD3      LYS  27 -23.459  19.517  36.203
  213    HE2  LYS  27           HE2      LYS  27 -21.705  19.636  34.472
  214    HE3  LYS  27           HE3      LYS  27 -22.883  20.928  34.208
  215    HZ1  LYS  27           HZ1      LYS  27 -21.308  22.566  35.165
  216    HZ2  LYS  27           HZ2      LYS  27 -20.186  21.331  35.591
  217    HZ3  LYS  27           HZ3      LYS  27 -20.510  21.643  33.931
  218    H    ASN  28           H        ASN  28 -24.073  25.054  35.693
  219    HA   ASN  28           HA       ASN  28 -21.853  25.853  37.320
  220    HB2  ASN  28           HB2      ASN  28 -22.159  26.211  34.853
  221    HB3  ASN  28           HB3      ASN  28 -23.444  27.416  35.196
  222   HD21  ASN  28          HD21      ASN  28 -21.654  28.218  33.473
  223   HD22  ASN  28          HD22      ASN  28 -20.473  29.245  34.195
  224    H    GLY  29           H        GLY  29 -25.313  27.014  37.147
  225    HA2  GLY  29           HA2      GLY  29 -25.235  27.877  39.838
  226    HA3  GLY  29           HA3      GLY  29 -24.892  29.310  38.838
  227    H    GLY  30           H        GLY  30 -26.720  28.792  36.567
  228    HA2  GLY  30           HA2      GLY  30 -29.025  28.852  36.106
  229    HA3  GLY  30           HA3      GLY  30 -29.359  28.360  37.777
  230    HA   PRO  31           HA       PRO  31 -30.386  32.960  37.406
  231    HB2  PRO  31           HB2      PRO  31 -31.504  32.041  40.125
  232    HB3  PRO  31           HB3      PRO  31 -32.195  33.268  39.011
  233    HG2  PRO  31           HG2      PRO  31 -33.276  30.775  38.981
  234    HG3  PRO  31           HG3      PRO  31 -32.816  31.510  37.414
  235    HD2  PRO  31           HD2      PRO  31 -31.197  29.464  39.049
  236    HD3  PRO  31           HD3      PRO  31 -31.577  29.433  37.285
  237    H    SER  32           H        SER  32 -29.067  31.038  40.227
  238    HA   SER  32           HA       SER  32 -27.824  33.179  41.596
  239    HB2  SER  32           HB2      SER  32 -27.879  30.816  42.451
  240    HB3  SER  32           HB3      SER  32 -26.689  30.348  41.193
  241    HG   SER  32           HG       SER  32 -25.623  30.951  43.253
  242    H    SER  33           H        SER  33 -26.727  31.434  38.582
  243    HA   SER  33           HA       SER  33 -24.082  32.411  38.550
  244    HB2  SER  33           HB2      SER  33 -24.962  30.828  36.781
  245    HB3  SER  33           HB3      SER  33 -25.991  32.139  36.152
  246    HG   SER  33           HG       SER  33 -23.117  32.247  36.159
  247    H    GLY  34           H        GLY  34 -27.188  34.136  37.662
  248    HA2  GLY  34           HA2      GLY  34 -27.420  36.493  37.686
  249    HA3  GLY  34           HA3      GLY  34 -25.660  36.700  37.757
  250    H    ALA  35           H        ALA  35 -24.600  35.365  35.604
  251    HA   ALA  35           HA       ALA  35 -24.971  36.900  33.368
  252    HB1  ALA  35           HB1      ALA  35 -24.216  34.892  32.020
  253    HB2  ALA  35           HB2      ALA  35 -23.225  35.197  33.476
  254    HB3  ALA  35           HB3      ALA  35 -24.430  33.879  33.477
  255    HA   PRO  36           HA       PRO  36 -29.420  35.973  32.700
  256    HB2  PRO  36           HB2      PRO  36 -28.469  36.957  29.925
  257    HB3  PRO  36           HB3      PRO  36 -30.089  37.218  30.642
  258    HG2  PRO  36           HG2      PRO  36 -28.269  39.215  30.934
  259    HG3  PRO  36           HG3      PRO  36 -29.087  38.629  32.419
  260    HD2  PRO  36           HD2      PRO  36 -26.269  37.895  31.448
  261    HD3  PRO  36           HD3      PRO  36 -26.828  38.334  33.110
  262    HA   PRO  37           HA       PRO  37 -28.792  31.927  31.327
  263    HB2  PRO  37           HB2      PRO  37 -31.327  31.032  30.424
  264    HB3  PRO  37           HB3      PRO  37 -30.958  31.401  32.125
  265    HG2  PRO  37           HG2      PRO  37 -32.153  33.354  30.101
  266    HG3  PRO  37           HG3      PRO  37 -32.860  32.889  31.680
  267    HD2  PRO  37           HD2      PRO  37 -31.383  35.157  31.476
  268    HD3  PRO  37           HD3      PRO  37 -31.013  34.058  32.873
  269    HA   PRO  38           HA       PRO  38 -28.116  32.077  26.849
  270    HB2  PRO  38           HB2      PRO  38 -27.447  29.496  26.287
  271    HB3  PRO  38           HB3      PRO  38 -26.519  30.449  27.500
  272    HG2  PRO  38           HG2      PRO  38 -28.795  28.519  28.106
  273    HG3  PRO  38           HG3      PRO  38 -27.112  28.404  28.717
  274    HD2  PRO  38           HD2      PRO  38 -29.051  29.712  30.224
  275    HD3  PRO  38           HD3      PRO  38 -27.393  30.403  30.103
  276    H    SER  39           H        SER  39 -30.603  32.626  26.996
  277    HA   SER  39           HA       SER  39 -32.361  30.457  25.924
  278    HB2  SER  39           HB2      SER  39 -33.021  33.382  26.593
  279    HB3  SER  39           HB3      SER  39 -34.157  32.187  25.938
  280    HG   SER  39           HG       SER  39 -32.748  31.688  28.386
  281    HN1  NH2  40           H11      SER  39 -33.537  30.757  23.784
  282    HN2  NH2  40           H12      SER  39 -32.701  31.617  22.552
  283    H03  D6M 101          H N2      LYS  14 -24.353  30.058  16.297
  284   H121  D6M 101          H101      LYS  14 -25.218  32.300  16.578
  285   H122  D6M 101          H102      LYS  14 -26.852  32.663  15.964
  286    H04  D6M 101           HC2      LYS  14 -26.617  28.140  16.187
  287   H051  D6M 101          HC31      LYS  14 -24.023  27.836  14.562
  288   H052  D6M 101          HC32      LYS  14 -25.569  28.362  13.851
  289   H061  D6M 101          HC41      LYS  14 -25.194  25.674  15.338
  290   H062  D6M 101          HC42      LYS  14 -24.974  25.899  13.584
  291   H131  D6M 101          H111      LYS  14 -25.083  33.738  14.591
  292   H132  D6M 101          H112      LYS  14 -26.097  32.620  13.639
  293   H141  D6M 101          H121      LYS  14 -24.325  30.901  13.636
  294   H142  D6M 101          H122      LYS  14 -23.333  31.846  14.785
  295   H151  D6M 101          H131      LYS  14 -23.050  33.669  13.155
  296   H152  D6M 101          H132      LYS  14 -24.133  32.856  11.996
  297   H161  D6M 101          H141      LYS  14 -22.533  31.027  11.661
  298   H162  D6M 101          H142      LYS  14 -21.477  31.599  12.988
  299   H171  D6M 101          H151      LYS  14 -20.925  33.661  11.751
  300   H172  D6M 101          H152      LYS  14 -22.141  33.276  10.504
  301   H181  D6M 101          H161      LYS  14 -20.800  31.298   9.772
  302   H182  D6M 101          H162      LYS  14 -19.602  31.601  11.058
  303   H191  D6M 101          H171      LYS  14 -18.985  33.778  10.064
  304   H192  D6M 101          H172      LYS  14 -20.341  33.658   8.904
  305   H201  D6M 101          H181      LYS  14 -19.281  31.815   7.705
  306   H202  D6M 101          H182      LYS  14 -18.003  31.680   8.942
  307   H211  D6M 101          H191      LYS  14 -17.208  32.827   6.859
  308   H212  D6M 101          H192      LYS  14 -17.051  33.864   8.298
  309   H221  D6M 101          H201      LYS  14 -19.065  35.149   7.693
  310   H222  D6M 101          H202      LYS  14 -19.401  34.079   6.304
  311   H231  D6M 101          H211      LYS  14 -16.878  35.842   6.603
  312   H232  D6M 101          H212      LYS  14 -18.390  36.373   5.822
  313   H241  D6M 101          H221      LYS  14 -18.201  34.547   4.119
  314   H242  D6M 101          H222      LYS  14 -16.675  34.003   4.866
  315   H251  D6M 101          H231      LYS  14 -16.137  35.331   2.915
  316   H252  D6M 101          H232      LYS  14 -15.619  36.241   4.360
  317   H261  D6M 101          H241      LYS  14 -17.583  37.777   4.125
  318   H262  D6M 101          H242      LYS  14 -16.719  37.674   2.577
  319   H263  D6M 101          H243      LYS  14 -18.239  36.767   2.806
  Start of MODEL    8
    1    H1   HIS   1           H1       HIS   1 -35.917  17.101  -1.251
    2    H2   HIS   1           H2       HIS   1 -34.300  17.609  -1.655
    3    H3   HIS   1           H3       HIS   1 -35.706  18.493  -2.220
    4    HA   HIS   1           HA       HIS   1 -34.975  18.192   0.731
    5    HB2  HIS   1           HB2      HIS   1 -34.376  20.655   0.634
    6    HB3  HIS   1           HB3      HIS   1 -33.246  19.673  -0.328
    7    HD1  HIS   1           HD1      HIS   1 -33.406  19.885  -2.896
    8    HD2  HIS   1           HD2      HIS   1 -36.144  22.267  -0.759
    9    HE1  HIS   1           HE1      HIS   1 -34.388  21.495  -4.586
   10    H    DSN   2           HN       DSN   2 -36.398  19.888   2.022
   11    HA   DSN   2           HA       DSN   2 -38.823  20.728   0.572
   12    HB2  DSN   2           HB1      DSN   2 -37.850  21.994   2.592
   13    HB3  DSN   2           HB2      DSN   2 -38.363  20.613   3.602
   14    HG   DSN   2           HOG      DSN   2 -40.143  22.284   2.054
   15    H    GLN   3           H        GLN   3 -40.932  19.993   2.262
   16    HA   GLN   3           HA       GLN   3 -42.392  18.271   2.639
   17    HB2  GLN   3           HB2      GLN   3 -40.717  16.549   0.735
   18    HB3  GLN   3           HB3      GLN   3 -42.384  16.291   1.276
   19    HG2  GLN   3           HG2      GLN   3 -42.425  17.291  -0.979
   20    HG3  GLN   3           HG3      GLN   3 -43.065  18.478   0.179
   21   HE21  GLN   3          HE21      GLN   3 -39.894  17.489  -1.431
   22   HE22  GLN   3          HE22      GLN   3 -39.320  19.111  -1.548
   23    H    GLY   4           H        GLY   4 -39.125  16.500   2.589
   24    HA2  GLY   4           HA2      GLY   4 -39.976  14.990   4.919
   25    HA3  GLY   4           HA3      GLY   4 -38.318  15.070   4.276
   26    H    THR   5           H        THR   5 -39.082  15.269   7.165
   27    HA   THR   5           HA       THR   5 -39.004  18.051   7.874
   28    HB   THR   5           HB       THR   5 -38.388  17.397  10.149
   29    HG1  THR   5           HG1      THR   5 -38.331  14.640   9.354
   30   HG21  THR   5          HG21      THR   5 -40.671  15.661   9.024
   31   HG22  THR   5          HG22      THR   5 -40.420  16.101  10.736
   32   HG23  THR   5          HG23      THR   5 -40.799  17.369   9.535
   33    H    PHE   6           H        PHE   6 -36.292  15.647   8.493
   34    HA   PHE   6           HA       PHE   6 -34.019  15.959   8.423
   35    HB2  PHE   6           HB2      PHE   6 -34.341  16.396   6.062
   36    HB3  PHE   6           HB3      PHE   6 -34.656  18.109   6.331
   37    HD1  PHE   6           HD1      PHE   6 -32.033  15.444   6.656
   38    HD2  PHE   6           HD2      PHE   6 -32.826  19.671   6.805
   39    HE1  PHE   6           HE1      PHE   6 -29.609  15.911   6.467
   40    HE2  PHE   6           HE2      PHE   6 -30.417  20.132   6.517
   41    HZ   PHE   6           HZ       PHE   6 -28.789  18.253   6.421
   42    H    THR   7           H        THR   7 -35.318  19.443   8.495
   43    HA   THR   7           HA       THR   7 -33.275  20.277  10.243
   44    HB   THR   7           HB       THR   7 -34.946  21.829   9.173
   45    HG1  THR   7           HG1      THR   7 -34.854  23.215  11.125
   46   HG21  THR   7          HG21      THR   7 -37.087  20.562   9.862
   47   HG22  THR   7          HG22      THR   7 -36.771  21.045  11.557
   48   HG23  THR   7          HG23      THR   7 -37.104  22.286  10.326
   49    H    SER   8           H        SER   8 -36.214  18.273  10.989
   50    HA   SER   8           HA       SER   8 -36.106  18.751  13.797
   51    HB2  SER   8           HB2      SER   8 -37.048  16.234  12.312
   52    HB3  SER   8           HB3      SER   8 -37.350  16.589  14.033
   53    HG   SER   8           HG       SER   8 -38.562  18.509  13.231
   54    H    ASP   9           H        ASP   9 -34.414  16.275  11.648
   55    HA   ASP   9           HA       ASP   9 -33.233  15.061  14.006
   56    HB2  ASP   9           HB2      ASP   9 -33.650  13.897  11.703
   57    HB3  ASP   9           HB3      ASP   9 -32.096  14.629  11.213
   58    H    LEU  10           H        LEU  10 -32.316  17.883  11.942
   59    HA   LEU  10           HA       LEU  10 -29.645  17.962  13.247
   60    HB2  LEU  10           HB2      LEU  10 -31.274  20.154  11.859
   61    HB3  LEU  10           HB3      LEU  10 -29.612  20.338  12.468
   62    HG   LEU  10           HG       LEU  10 -30.424  18.328  10.263
   63   HD11  LEU  10          HD11      LEU  10 -29.204  21.140  10.080
   64   HD12  LEU  10          HD12      LEU  10 -29.279  19.985   8.721
   65   HD13  LEU  10          HD13      LEU  10 -30.790  20.617   9.436
   66   HD21  LEU  10          HD21      LEU  10 -28.292  17.645  11.419
   67   HD22  LEU  10          HD22      LEU  10 -27.942  18.275   9.803
   68   HD23  LEU  10          HD23      LEU  10 -27.653  19.306  11.233
   69    H    SER  11           H        SER  11 -33.013  19.226  13.902
   70    HA   SER  11           HA       SER  11 -32.195  21.143  15.809
   71    HB2  SER  11           HB2      SER  11 -34.820  19.539  15.792
   72    HB3  SER  11           HB3      SER  11 -34.463  20.952  16.813
   73    HG   SER  11           HG       SER  11 -34.495  21.080  13.934
   74    H    LYS  12           H        LYS  12 -32.920  17.578  16.315
   75    HA   LYS  12           HA       LYS  12 -32.523  17.678  19.121
   76    HB2  LYS  12           HB2      LYS  12 -32.045  15.303  19.120
   77    HB3  LYS  12           HB3      LYS  12 -33.235  15.593  17.823
   78    HG2  LYS  12           HG2      LYS  12 -31.246  15.724  16.236
   79    HG3  LYS  12           HG3      LYS  12 -30.179  15.131  17.534
   80    HD2  LYS  12           HD2      LYS  12 -31.593  13.004  17.642
   81    HD3  LYS  12           HD3      LYS  12 -32.547  13.644  16.271
   82    HE2  LYS  12           HE2      LYS  12 -30.301  13.893  15.003
   83    HE3  LYS  12           HE3      LYS  12 -29.532  12.962  16.285
   84    HZ1  LYS  12           HZ1      LYS  12 -30.585  10.960  15.520
   85    HZ2  LYS  12           HZ2      LYS  12 -31.930  11.780  14.833
   86    HZ3  LYS  12           HZ3      LYS  12 -30.428  11.812  14.030
   87    H    GLN  13           H        GLN  13 -30.064  17.818  16.472
   88    HA   GLN  13           HA       GLN  13 -27.856  17.295  18.320
   89    HB2  GLN  13           HB2      GLN  13 -27.779  18.579  15.519
   90    HB3  GLN  13           HB3      GLN  13 -26.384  17.987  16.443
   91    HG2  GLN  13           HG2      GLN  13 -28.682  16.205  15.388
   92    HG3  GLN  13           HG3      GLN  13 -27.109  16.437  14.601
   93   HE21  GLN  13          HE21      GLN  13 -27.519  13.884  14.928
   94   HE22  GLN  13          HE22      GLN  13 -26.722  13.260  16.325
   95    H    LYS  14           HN       LYS  14 -29.402  20.206  16.749
   96    HA   LYS  14           HA       LYS  14 -27.474  22.010  17.952
   97    HB2  LYS  14           HB2      LYS  14 -30.308  22.586  16.894
   98    HB3  LYS  14           HB3      LYS  14 -29.097  23.821  17.339
   99    HG2  LYS  14          HC81      LYS  14 -27.521  22.867  15.616
  100    HG3  LYS  14          HC82      LYS  14 -28.794  21.754  15.057
  101    HD2  LYS  14          HC71      LYS  14 -30.275  23.778  14.574
  102    HD3  LYS  14          HC72      LYS  14 -28.888  24.830  14.992
  103    HE2  LYS  14          HC61      LYS  14 -28.941  22.746  12.725
  104    HE3  LYS  14          HC62      LYS  14 -29.116  24.494  12.520
  105    HZ1  LYS  14          H N1      LYS  14 -26.636  23.009  13.243
  106    H    ASP  15           H        ASP  15 -30.695  20.723  18.968
  107    HA   ASP  15           HA       ASP  15 -30.838  22.476  21.243
  108    HB2  ASP  15           HB2      ASP  15 -32.896  21.315  20.386
  109    HB3  ASP  15           HB3      ASP  15 -32.181  19.746  20.831
  110    H    SER  16           H        SER  16 -29.550  19.054  20.642
  111    HA   SER  16           HA       SER  16 -28.941  18.507  23.341
  112    HB2  SER  16           HB2      SER  16 -28.612  16.798  21.642
  113    HB3  SER  16           HB3      SER  16 -27.358  17.772  20.820
  114    HG   SER  16           HG       SER  16 -26.399  16.163  22.289
  115    H    ARG  17           H        ARG  17 -27.098  20.532  20.935
  116    HA   ARG  17           HA       ARG  17 -24.859  20.933  22.640
  117    HB2  ARG  17           HB2      ARG  17 -24.907  21.429  20.170
  118    HB3  ARG  17           HB3      ARG  17 -26.066  22.742  20.446
  119    HG2  ARG  17           HG2      ARG  17 -24.325  23.825  22.028
  120    HG3  ARG  17           HG3      ARG  17 -23.180  22.590  21.429
  121    HD2  ARG  17           HD2      ARG  17 -23.633  23.474  19.064
  122    HD3  ARG  17           HD3      ARG  17 -24.732  24.695  19.808
  123    HE   ARG  17           HE       ARG  17 -22.075  24.815  20.990
  124   HH11  ARG  17          HH11      ARG  17 -20.737  26.543  20.473
  125   HH12  ARG  17          HH12      ARG  17 -21.031  27.504  19.025
  126   HH21  ARG  17          HH21      ARG  17 -23.853  25.712  17.980
  127   HH22  ARG  17          HH22      ARG  17 -22.751  27.032  17.652
  128    H    ARG  18           H        ARG  18 -27.734  23.210  22.074
  129    HA   ARG  18           HA       ARG  18 -26.681  24.816  24.294
  130    HB2  ARG  18           HB2      ARG  18 -29.142  25.107  22.560
  131    HB3  ARG  18           HB3      ARG  18 -28.902  26.123  23.995
  132    HG2  ARG  18           HG2      ARG  18 -26.916  25.972  21.624
  133    HG3  ARG  18           HG3      ARG  18 -28.167  27.213  21.876
  134    HD2  ARG  18           HD2      ARG  18 -27.009  27.659  24.190
  135    HD3  ARG  18           HD3      ARG  18 -25.623  26.733  23.526
  136    HE   ARG  18           HE       ARG  18 -26.352  28.740  21.625
  137   HH11  ARG  18          HH11      ARG  18 -25.284  30.706  21.519
  138   HH12  ARG  18          HH12      ARG  18 -24.304  31.271  22.869
  139   HH21  ARG  18          HH21      ARG  18 -24.901  28.503  24.936
  140   HH22  ARG  18          HH22      ARG  18 -24.104  30.055  24.744
  141    H    ALA  19           H        ALA  19 -28.852  22.079  24.107
  142    HA   ALA  19           HA       ALA  19 -30.194  22.617  26.599
  143    HB1  ALA  19           HB1      ALA  19 -29.507  19.915  25.270
  144    HB2  ALA  19           HB2      ALA  19 -30.649  20.154  26.618
  145    HB3  ALA  19           HB3      ALA  19 -31.008  20.842  25.008
  146    H    GLN  20           H        GLN  20 -27.101  20.823  25.631
  147    HA   GLN  20           HA       GLN  20 -26.363  20.239  28.318
  148    HB2  GLN  20           HB2      GLN  20 -25.225  19.183  26.398
  149    HB3  GLN  20           HB3      GLN  20 -24.603  20.746  25.827
  150    HG2  GLN  20           HG2      GLN  20 -23.262  21.035  27.873
  151    HG3  GLN  20           HG3      GLN  20 -23.969  19.569  28.588
  152   HE21  GLN  20          HE21      GLN  20 -23.567  17.415  27.273
  153   HE22  GLN  20          HE22      GLN  20 -22.015  17.299  26.520
  154    H    ASP  21           H        ASP  21 -25.784  23.136  26.184
  155    HA   ASP  21           HA       ASP  21 -24.058  24.445  28.072
  156    HB2  ASP  21           HB2      ASP  21 -24.586  25.102  25.558
  157    HB3  ASP  21           HB3      ASP  21 -25.990  25.979  26.234
  158    H    PHE  22           H        PHE  22 -27.662  24.461  27.668
  159    HA   PHE  22           HA       PHE  22 -28.113  26.412  29.751
  160    HB2  PHE  22           HB2      PHE  22 -29.799  25.876  28.005
  161    HB3  PHE  22           HB3      PHE  22 -29.944  24.218  28.612
  162    HD1  PHE  22           HD1      PHE  22 -30.366  27.817  29.657
  163    HD2  PHE  22           HD2      PHE  22 -31.400  23.722  30.479
  164    HE1  PHE  22           HE1      PHE  22 -31.972  28.563  31.391
  165    HE2  PHE  22           HE2      PHE  22 -33.180  24.487  32.008
  166    HZ   PHE  22           HZ       PHE  22 -33.364  26.898  32.595
  167    H    ILE  23           H        ILE  23 -28.072  22.776  29.715
  168    HA   ILE  23           HA       ILE  23 -28.711  22.515  32.518
  169    HB   ILE  23           HB       ILE  23 -27.107  20.731  30.609
  170   HG12  ILE  23          HG12      ILE  23 -29.886  20.213  31.850
  171   HG13  ILE  23          HG13      ILE  23 -29.721  21.117  30.339
  172   HG21  ILE  23          HG21      ILE  23 -27.276  18.926  32.369
  173   HG22  ILE  23          HG22      ILE  23 -26.286  20.289  32.908
  174   HG23  ILE  23          HG23      ILE  23 -27.968  20.130  33.492
  175   HD11  ILE  23          HD11      ILE  23 -30.201  18.781  29.796
  176   HD12  ILE  23          HD12      ILE  23 -28.548  19.178  29.259
  177   HD13  ILE  23          HD13      ILE  23 -28.805  18.203  30.735
  178    H    GLU  24           H        GLU  24 -25.577  23.051  30.707
  179    HA   GLU  24           HA       GLU  24 -23.981  22.866  33.068
  180    HB2  GLU  24           HB2      GLU  24 -23.110  22.972  30.606
  181    HB3  GLU  24           HB3      GLU  24 -23.344  24.735  30.710
  182    HG2  GLU  24           HG2      GLU  24 -20.985  24.055  31.228
  183    HG3  GLU  24           HG3      GLU  24 -21.773  24.877  32.602
  184    H    TRP  25           H        TRP  25 -25.663  25.696  31.481
  185    HA   TRP  25           HA       TRP  25 -24.757  27.612  33.379
  186    HB2  TRP  25           HB2      TRP  25 -25.899  28.277  31.341
  187    HB3  TRP  25           HB3      TRP  25 -27.404  27.475  31.842
  188    HD1  TRP  25           HD1      TRP  25 -25.248  30.559  32.833
  189    HE1  TRP  25           HE1      TRP  25 -26.783  32.234  33.946
  190    HE3  TRP  25           HE3      TRP  25 -29.580  27.716  33.084
  191    HZ2  TRP  25           HZ2      TRP  25 -29.368  32.423  34.840
  192    HZ3  TRP  25           HZ3      TRP  25 -31.596  28.783  34.133
  193    HH2  TRP  25           HH2      TRP  25 -31.492  31.133  34.910
  194    H    LEU  26           H        LEU  26 -27.636  25.338  33.635
  195    HA   LEU  26           HA       LEU  26 -28.347  26.374  36.250
  196    HB2  LEU  26           HB2      LEU  26 -28.823  23.595  35.025
  197    HB3  LEU  26           HB3      LEU  26 -29.482  24.114  36.586
  198    HG   LEU  26           HG       LEU  26 -30.174  25.435  33.894
  199   HD11  LEU  26          HD11      LEU  26 -31.050  23.115  34.032
  200   HD12  LEU  26          HD12      LEU  26 -31.699  23.433  35.671
  201   HD13  LEU  26          HD13      LEU  26 -32.394  24.269  34.263
  202   HD21  LEU  26          HD21      LEU  26 -31.356  25.782  36.722
  203   HD22  LEU  26          HD22      LEU  26 -30.500  27.054  35.809
  204   HD23  LEU  26          HD23      LEU  26 -32.073  26.475  35.243
  205    H    LYS  27           H        LYS  27 -26.436  23.410  35.350
  206    HA   LYS  27           HA       LYS  27 -25.922  22.641  38.049
  207    HB2  LYS  27           HB2      LYS  27 -25.493  21.184  36.055
  208    HB3  LYS  27           HB3      LYS  27 -24.230  22.300  35.492
  209    HG2  LYS  27           HG2      LYS  27 -22.766  21.761  37.368
  210    HG3  LYS  27           HG3      LYS  27 -24.064  20.887  38.208
  211    HD2  LYS  27           HD2      LYS  27 -22.416  19.325  37.161
  212    HD3  LYS  27           HD3      LYS  27 -24.085  19.091  36.589
  213    HE2  LYS  27           HE2      LYS  27 -22.494  18.859  34.730
  214    HE3  LYS  27           HE3      LYS  27 -23.574  20.234  34.446
  215    HZ1  LYS  27           HZ1      LYS  27 -21.717  21.794  35.068
  216    HZ2  LYS  27           HZ2      LYS  27 -20.729  20.500  35.525
  217    HZ3  LYS  27           HZ3      LYS  27 -21.156  20.666  33.881
  218    H    ASN  28           H        ASN  28 -24.149  24.796  35.828
  219    HA   ASN  28           HA       ASN  28 -21.895  25.339  37.542
  220    HB2  ASN  28           HB2      ASN  28 -22.047  25.711  35.068
  221    HB3  ASN  28           HB3      ASN  28 -23.207  27.051  35.339
  222   HD21  ASN  28          HD21      ASN  28 -21.241  27.639  33.729
  223   HD22  ASN  28          HD22      ASN  28 -20.035  28.586  34.518
  224    H    GLY  29           H        GLY  29 -25.180  26.902  37.100
  225    HA2  GLY  29           HA2      GLY  29 -25.113  27.819  39.838
  226    HA3  GLY  29           HA3      GLY  29 -24.774  29.166  38.715
  227    H    GLY  30           H        GLY  30 -26.536  28.867  36.594
  228    HA2  GLY  30           HA2      GLY  30 -28.850  28.854  36.085
  229    HA3  GLY  30           HA3      GLY  30 -29.227  28.398  37.748
  230    HA   PRO  31           HA       PRO  31 -30.272  32.956  37.153
  231    HB2  PRO  31           HB2      PRO  31 -31.642  32.100  39.777
  232    HB3  PRO  31           HB3      PRO  31 -32.243  33.278  38.567
  233    HG2  PRO  31           HG2      PRO  31 -33.257  30.759  38.522
  234    HG3  PRO  31           HG3      PRO  31 -32.674  31.458  36.983
  235    HD2  PRO  31           HD2      PRO  31 -31.179  29.515  38.830
  236    HD3  PRO  31           HD3      PRO  31 -31.366  29.418  37.038
  237    H    SER  32           H        SER  32 -29.196  31.184  40.156
  238    HA   SER  32           HA       SER  32 -28.239  33.466  41.551
  239    HB2  SER  32           HB2      SER  32 -28.453  31.117  42.528
  240    HB3  SER  32           HB3      SER  32 -26.961  30.675  41.662
  241    HG   SER  32           HG       SER  32 -25.970  32.468  42.979
  242    H    SER  33           H        SER  33 -26.911  32.026  38.566
  243    HA   SER  33           HA       SER  33 -24.193  32.867  39.017
  244    HB2  SER  33           HB2      SER  33 -24.954  31.296  37.146
  245    HB3  SER  33           HB3      SER  33 -25.680  32.707  36.339
  246    HG   SER  33           HG       SER  33 -22.877  32.405  36.966
  247    H    GLY  34           H        GLY  34 -27.169  34.577  37.727
  248    HA2  GLY  34           HA2      GLY  34 -27.398  36.961  37.955
  249    HA3  GLY  34           HA3      GLY  34 -25.638  37.153  37.987
  250    H    ALA  35           H        ALA  35 -25.205  35.323  35.578
  251    HA   ALA  35           HA       ALA  35 -25.703  37.377  33.566
  252    HB1  ALA  35           HB1      ALA  35 -24.692  34.483  33.249
  253    HB2  ALA  35           HB2      ALA  35 -24.622  35.753  31.991
  254    HB3  ALA  35           HB3      ALA  35 -23.658  35.918  33.486
  255    HA   PRO  36           HA       PRO  36 -29.737  35.525  32.697
  256    HB2  PRO  36           HB2      PRO  36 -30.241  36.306  30.079
  257    HB3  PRO  36           HB3      PRO  36 -30.166  37.490  31.424
  258    HG2  PRO  36           HG2      PRO  36 -27.896  36.709  29.540
  259    HG3  PRO  36           HG3      PRO  36 -28.502  38.365  29.829
  260    HD2  PRO  36           HD2      PRO  36 -26.311  37.406  31.177
  261    HD3  PRO  36           HD3      PRO  36 -27.527  38.369  32.096
  262    HA   PRO  37           HA       PRO  37 -28.482  31.655  31.198
  263    HB2  PRO  37           HB2      PRO  37 -30.781  30.489  29.984
  264    HB3  PRO  37           HB3      PRO  37 -30.609  30.798  31.734
  265    HG2  PRO  37           HG2      PRO  37 -31.871  32.664  29.674
  266    HG3  PRO  37           HG3      PRO  37 -32.655  32.025  31.158
  267    HD2  PRO  37           HD2      PRO  37 -31.520  34.490  31.228
  268    HD3  PRO  37           HD3      PRO  37 -31.124  33.360  32.583
  269    HA   PRO  38           HA       PRO  38 -27.277  31.852  26.868
  270    HB2  PRO  38           HB2      PRO  38 -26.929  29.202  26.188
  271    HB3  PRO  38           HB3      PRO  38 -25.873  30.047  27.360
  272    HG2  PRO  38           HG2      PRO  38 -28.292  28.295  28.003
  273    HG3  PRO  38           HG3      PRO  38 -26.624  28.110  28.642
  274    HD2  PRO  38           HD2      PRO  38 -28.524  29.448  30.098
  275    HD3  PRO  38           HD3      PRO  38 -26.874  30.155  30.012
  276    H    SER  39           H        SER  39 -29.323  32.830  26.192
  277    HA   SER  39           HA       SER  39 -31.008  30.961  24.562
  278    HB2  SER  39           HB2      SER  39 -32.021  31.106  26.860
  279    HB3  SER  39           HB3      SER  39 -32.055  32.892  26.726
  280    HG   SER  39           HG       SER  39 -34.114  31.884  25.997
  281    HN1  NH2  40           H11      SER  39 -32.988  32.921  23.852
  282    HN2  NH2  40           H12      SER  39 -32.164  34.142  22.942
  283    H03  D6M 101          H N2      LYS  14 -22.960  28.267  15.156
  284   H121  D6M 101          H101      LYS  14 -23.258  30.831  15.311
  285   H122  D6M 101          H102      LYS  14 -23.909  31.546  13.819
  286    H04  D6M 101           HC2      LYS  14 -25.637  27.211  14.759
  287   H051  D6M 101          HC31      LYS  14 -23.373  26.429  12.844
  288   H052  D6M 101          HC32      LYS  14 -24.906  27.186  12.370
  289   H061  D6M 101          HC41      LYS  14 -24.689  24.389  13.677
  290   H062  D6M 101          HC42      LYS  14 -24.810  24.681  11.928
  291   H131  D6M 101          H111      LYS  14 -21.472  29.626  13.875
  292   H132  D6M 101          H112      LYS  14 -21.385  31.394  13.930
  293   H141  D6M 101          H121      LYS  14 -20.964  30.746  11.660
  294   H142  D6M 101          H122      LYS  14 -22.559  31.540  11.702
  295   H151  D6M 101          H131      LYS  14 -23.667  29.280  11.577
  296   H152  D6M 101          H132      LYS  14 -22.077  28.479  11.633
  297   H161  D6M 101          H141      LYS  14 -21.466  29.536   9.454
  298   H162  D6M 101          H142      LYS  14 -22.987  30.472   9.462
  299   H171  D6M 101          H151      LYS  14 -24.327  28.423   9.273
  300   H172  D6M 101          H152      LYS  14 -22.873  27.391   9.392
  301   H181  D6M 101          H161      LYS  14 -21.990  28.321   7.266
  302   H182  D6M 101          H162      LYS  14 -23.346  29.474   7.161
  303   H191  D6M 101          H171      LYS  14 -24.969  27.560   6.972
  304   H192  D6M 101          H172      LYS  14 -23.616  26.400   7.072
  305   H201  D6M 101          H181      LYS  14 -22.627  27.339   4.980
  306   H202  D6M 101          H182      LYS  14 -23.925  28.558   4.894
  307   H211  D6M 101          H191      LYS  14 -25.641  26.769   4.622
  308   H212  D6M 101          H192      LYS  14 -24.385  25.507   4.757
  309   H221  D6M 101          H201      LYS  14 -23.273  26.307   2.702
  310   H222  D6M 101          H202      LYS  14 -24.397  27.699   2.594
  311   H231  D6M 101          H211      LYS  14 -26.291  26.271   2.074
  312   H232  D6M 101          H212      LYS  14 -25.396  24.792   2.501
  313   H241  D6M 101          H221      LYS  14 -25.581  25.040   0.034
  314   H242  D6M 101          H222      LYS  14 -23.882  25.057   0.571
  315   H251  D6M 101          H231      LYS  14 -23.742  27.510   0.304
  316   H252  D6M 101          H232      LYS  14 -25.491  27.595  -0.063
  317   H261  D6M 101          H241      LYS  14 -23.354  26.146  -1.761
  318   H262  D6M 101          H242      LYS  14 -25.097  26.263  -2.165
  319   H263  D6M 101          H243      LYS  14 -24.084  27.734  -2.145
  Start of MODEL    9
    1    H1   HIS   1           H1       HIS   1 -38.934  14.888  -2.966
    2    H2   HIS   1           H2       HIS   1 -39.492  16.500  -2.888
    3    H3   HIS   1           H3       HIS   1 -40.512  15.218  -2.440
    4    HA   HIS   1           HA       HIS   1 -37.965  16.060  -0.976
    5    HB2  HIS   1           HB2      HIS   1 -39.370  16.520   1.003
    6    HB3  HIS   1           HB3      HIS   1 -39.986  17.503  -0.339
    7    HD1  HIS   1           HD1      HIS   1 -42.318  16.879  -1.251
    8    HD2  HIS   1           HD2      HIS   1 -40.866  14.365   1.792
    9    HE1  HIS   1           HE1      HIS   1 -44.294  15.473  -0.510
   10    H    DSN   2           HN       DSN   2 -37.563  14.678   1.080
   11    HA   DSN   2           HA       DSN   2 -37.689  11.950   0.053
   12    HB2  DSN   2           HB1      DSN   2 -39.797  11.981   1.375
   13    HB3  DSN   2           HB2      DSN   2 -38.897  12.558   2.812
   14    HG   DSN   2           HOG      DSN   2 -39.073  10.162   2.758
   15    H    GLN   3           H        GLN   3 -36.249  10.473   1.485
   16    HA   GLN   3           HA       GLN   3 -34.063  10.172   2.151
   17    HB2  GLN   3           HB2      GLN   3 -33.584  13.049   1.197
   18    HB3  GLN   3           HB3      GLN   3 -32.359  11.850   1.662
   19    HG2  GLN   3           HG2      GLN   3 -32.650  11.997  -0.817
   20    HG3  GLN   3           HG3      GLN   3 -33.059  10.374  -0.221
   21   HE21  GLN   3          HE21      GLN   3 -35.222   9.588  -0.806
   22   HE22  GLN   3          HE22      GLN   3 -36.365  10.610  -1.587
   23    H    GLY   4           H        GLY   4 -34.619  13.659   3.261
   24    HA2  GLY   4           HA2      GLY   4 -35.092  12.935   5.921
   25    HA3  GLY   4           HA3      GLY   4 -33.332  13.050   5.780
   26    H    THR   5           H        THR   5 -36.019  14.978   6.593
   27    HA   THR   5           HA       THR   5 -35.656  17.379   5.304
   28    HB   THR   5           HB       THR   5 -36.237  18.618   7.406
   29    HG1  THR   5           HG1      THR   5 -36.529  17.333   9.351
   30   HG21  THR   5          HG21      THR   5 -38.080  17.599   6.035
   31   HG22  THR   5          HG22      THR   5 -37.987  16.117   7.019
   32   HG23  THR   5          HG23      THR   5 -38.478  17.645   7.775
   33    H    PHE   6           H        PHE   6 -33.551  16.169   8.014
   34    HA   PHE   6           HA       PHE   6 -31.313  16.588   8.243
   35    HB2  PHE   6           HB2      PHE   6 -31.246  17.265   5.777
   36    HB3  PHE   6           HB3      PHE   6 -31.306  18.950   6.320
   37    HD1  PHE   6           HD1      PHE   6 -29.271  15.880   6.136
   38    HD2  PHE   6           HD2      PHE   6 -29.420  19.877   7.715
   39    HE1  PHE   6           HE1      PHE   6 -26.875  15.753   6.674
   40    HE2  PHE   6           HE2      PHE   6 -26.998  19.763   8.183
   41    HZ   PHE   6           HZ       PHE   6 -25.704  17.730   7.625
   42    H    THR   7           H        THR   7 -33.319  19.681   8.035
   43    HA   THR   7           HA       THR   7 -31.848  20.867  10.155
   44    HB   THR   7           HB       THR   7 -33.416  22.150   8.676
   45    HG1  THR   7           HG1      THR   7 -33.588  22.536  11.520
   46   HG21  THR   7          HG21      THR   7 -35.491  20.697   8.935
   47   HG22  THR   7          HG22      THR   7 -35.577  21.168  10.657
   48   HG23  THR   7          HG23      THR   7 -35.795  22.400   9.393
   49    H    SER   8           H        SER   8 -34.470  18.364  10.200
   50    HA   SER   8           HA       SER   8 -35.181  18.859  12.936
   51    HB2  SER   8           HB2      SER   8 -35.276  16.174  11.434
   52    HB3  SER   8           HB3      SER   8 -36.154  16.567  12.934
   53    HG   SER   8           HG       SER   8 -37.312  18.196  11.612
   54    H    ASP   9           H        ASP   9 -32.529  16.931  11.371
   55    HA   ASP   9           HA       ASP   9 -31.728  15.845  13.971
   56    HB2  ASP   9           HB2      ASP   9 -31.231  14.725  11.726
   57    HB3  ASP   9           HB3      ASP   9 -30.013  15.976  11.436
   58    H    LEU  10           H        LEU  10 -30.572  18.621  11.796
   59    HA   LEU  10           HA       LEU  10 -28.594  19.489  13.655
   60    HB2  LEU  10           HB2      LEU  10 -30.477  21.276  12.051
   61    HB3  LEU  10           HB3      LEU  10 -29.057  21.863  12.934
   62    HG   LEU  10           HG       LEU  10 -28.885  19.880  10.583
   63   HD11  LEU  10          HD11      LEU  10 -28.443  22.912  10.670
   64   HD12  LEU  10          HD12      LEU  10 -28.005  21.889   9.274
   65   HD13  LEU  10          HD13      LEU  10 -29.709  22.043   9.761
   66   HD21  LEU  10          HD21      LEU  10 -26.879  19.713  12.124
   67   HD22  LEU  10          HD22      LEU  10 -26.421  20.463  10.591
   68   HD23  LEU  10          HD23      LEU  10 -26.671  21.480  12.028
   69    H    SER  11           H        SER  11 -32.218  19.876  13.725
   70    HA   SER  11           HA       SER  11 -32.165  21.661  15.943
   71    HB2  SER  11           HB2      SER  11 -34.387  19.644  15.295
   72    HB3  SER  11           HB3      SER  11 -34.516  20.986  16.446
   73    HG   SER  11           HG       SER  11 -34.123  21.240  13.617
   74    H    LYS  12           H        LYS  12 -32.120  17.989  15.766
   75    HA   LYS  12           HA       LYS  12 -32.247  17.751  18.623
   76    HB2  LYS  12           HB2      LYS  12 -31.961  15.489  18.434
   77    HB3  LYS  12           HB3      LYS  12 -32.464  15.796  16.764
   78    HG2  LYS  12           HG2      LYS  12 -29.984  15.748  16.121
   79    HG3  LYS  12           HG3      LYS  12 -29.590  15.432  17.822
   80    HD2  LYS  12           HD2      LYS  12 -31.037  13.338  17.678
   81    HD3  LYS  12           HD3      LYS  12 -31.170  13.598  15.924
   82    HE2  LYS  12           HE2      LYS  12 -28.518  13.257  17.489
   83    HE3  LYS  12           HE3      LYS  12 -29.366  11.931  16.680
   84    HZ1  LYS  12           HZ1      LYS  12 -28.970  12.866  14.524
   85    HZ2  LYS  12           HZ2      LYS  12 -28.325  14.379  15.155
   86    HZ3  LYS  12           HZ3      LYS  12 -27.480  12.904  15.296
   87    H    GLN  13           H        GLN  13 -29.489  18.219  16.330
   88    HA   GLN  13           HA       GLN  13 -27.486  17.773  18.385
   89    HB2  GLN  13           HB2      GLN  13 -27.236  19.507  15.850
   90    HB3  GLN  13           HB3      GLN  13 -25.912  18.963  16.892
   91    HG2  GLN  13           HG2      GLN  13 -27.710  17.237  15.100
   92    HG3  GLN  13           HG3      GLN  13 -25.975  17.520  14.901
   93   HE21  GLN  13          HE21      GLN  13 -24.637  16.816  17.136
   94   HE22  GLN  13          HE22      GLN  13 -25.128  15.257  17.695
   95    H    LYS  14           HN       LYS  14 -29.103  20.735  17.067
   96    HA   LYS  14           HA       LYS  14 -27.790  22.596  18.792
   97    HB2  LYS  14           HB2      LYS  14 -30.621  22.592  17.585
   98    HB3  LYS  14           HB3      LYS  14 -29.980  23.954  18.527
   99    HG2  LYS  14          HC81      LYS  14 -28.135  24.265  16.946
  100    HG3  LYS  14          HC82      LYS  14 -28.647  22.884  15.963
  101    HD2  LYS  14          HC71      LYS  14 -30.812  23.982  15.409
  102    HD3  LYS  14          HC72      LYS  14 -30.411  25.368  16.451
  103    HE2  LYS  14          HC61      LYS  14 -28.888  24.507  13.934
  104    HE3  LYS  14          HC62      LYS  14 -30.061  25.839  14.071
  105    HZ1  LYS  14          H N1      LYS  14 -27.263  25.871  14.989
  106    H    ASP  15           H        ASP  15 -30.774  20.515  19.285
  107    HA   ASP  15           HA       ASP  15 -31.351  21.713  21.812
  108    HB2  ASP  15           HB2      ASP  15 -33.022  20.222  20.582
  109    HB3  ASP  15           HB3      ASP  15 -31.980  18.830  20.907
  110    H    SER  16           H        SER  16 -29.296  18.808  20.880
  111    HA   SER  16           HA       SER  16 -28.699  18.096  23.580
  112    HB2  SER  16           HB2      SER  16 -27.932  16.696  21.628
  113    HB3  SER  16           HB3      SER  16 -26.792  17.974  21.162
  114    HG   SER  16           HG       SER  16 -26.682  16.545  23.657
  115    H    ARG  17           H        ARG  17 -27.158  20.572  21.376
  116    HA   ARG  17           HA       ARG  17 -25.169  21.316  23.301
  117    HB2  ARG  17           HB2      ARG  17 -25.030  21.802  20.862
  118    HB3  ARG  17           HB3      ARG  17 -26.438  22.877  20.952
  119    HG2  ARG  17           HG2      ARG  17 -25.219  24.365  22.564
  120    HG3  ARG  17           HG3      ARG  17 -23.806  23.285  22.458
  121    HD2  ARG  17           HD2      ARG  17 -23.789  23.828  19.864
  122    HD3  ARG  17           HD3      ARG  17 -25.173  24.858  20.197
  123    HE   ARG  17           HE       ARG  17 -23.824  26.529  21.052
  124   HH11  ARG  17          HH11      ARG  17 -21.871  27.485  21.565
  125   HH12  ARG  17          HH12      ARG  17 -20.399  26.522  21.734
  126   HH21  ARG  17          HH21      ARG  17 -21.919  23.443  21.049
  127   HH22  ARG  17          HH22      ARG  17 -20.441  24.294  21.453
  128    H    ARG  18           H        ARG  18 -28.363  22.968  22.438
  129    HA   ARG  18           HA       ARG  18 -27.811  24.894  24.556
  130    HB2  ARG  18           HB2      ARG  18 -30.236  24.540  22.738
  131    HB3  ARG  18           HB3      ARG  18 -30.118  25.763  24.019
  132    HG2  ARG  18           HG2      ARG  18 -28.236  25.567  21.581
  133    HG3  ARG  18           HG3      ARG  18 -29.578  26.714  21.850
  134    HD2  ARG  18           HD2      ARG  18 -28.322  27.488  23.972
  135    HD3  ARG  18           HD3      ARG  18 -26.878  26.606  23.345
  136    HE   ARG  18           HE       ARG  18 -27.758  28.284  21.262
  137   HH11  ARG  18          HH11      ARG  18 -26.766  30.291  20.914
  138   HH12  ARG  18          HH12      ARG  18 -25.946  31.116  22.233
  139   HH21  ARG  18          HH21      ARG  18 -26.410  28.598  24.607
  140   HH22  ARG  18          HH22      ARG  18 -25.746  30.178  24.254
  141    H    ALA  19           H        ALA  19 -29.528  21.810  24.439
  142    HA   ALA  19           HA       ALA  19 -30.855  22.265  26.984
  143    HB1  ALA  19           HB1      ALA  19 -29.913  19.601  25.689
  144    HB2  ALA  19           HB2      ALA  19 -31.099  19.755  27.010
  145    HB3  ALA  19           HB3      ALA  19 -31.487  20.375  25.381
  146    H    GLN  20           H        GLN  20 -27.669  20.739  25.950
  147    HA   GLN  20           HA       GLN  20 -26.729  20.316  28.578
  148    HB2  GLN  20           HB2      GLN  20 -25.639  19.396  26.564
  149    HB3  GLN  20           HB3      GLN  20 -25.146  21.027  26.025
  150    HG2  GLN  20           HG2      GLN  20 -23.760  21.323  28.073
  151    HG3  GLN  20           HG3      GLN  20 -24.241  19.697  28.645
  152   HE21  GLN  20          HE21      GLN  20 -21.575  19.958  28.547
  153   HE22  GLN  20          HE22      GLN  20 -20.929  19.224  27.124
  154    H    ASP  21           H        ASP  21 -26.622  23.268  26.442
  155    HA   ASP  21           HA       ASP  21 -24.892  24.758  28.195
  156    HB2  ASP  21           HB2      ASP  21 -25.630  25.349  25.729
  157    HB3  ASP  21           HB3      ASP  21 -27.163  25.958  26.447
  158    H    PHE  22           H        PHE  22 -28.509  24.462  28.016
  159    HA   PHE  22           HA       PHE  22 -28.971  26.288  30.164
  160    HB2  PHE  22           HB2      PHE  22 -30.763  25.534  28.641
  161    HB3  PHE  22           HB3      PHE  22 -30.660  23.885  29.244
  162    HD1  PHE  22           HD1      PHE  22 -31.431  27.406  30.270
  163    HD2  PHE  22           HD2      PHE  22 -31.691  23.256  31.355
  164    HE1  PHE  22           HE1      PHE  22 -32.922  27.978  32.161
  165    HE2  PHE  22           HE2      PHE  22 -33.406  23.806  33.035
  166    HZ   PHE  22           HZ       PHE  22 -33.929  26.179  33.530
  167    H    ILE  23           H        ILE  23 -28.460  22.675  30.103
  168    HA   ILE  23           HA       ILE  23 -28.863  22.368  32.951
  169    HB   ILE  23           HB       ILE  23 -27.303  20.696  30.897
  170   HG12  ILE  23          HG12      ILE  23 -29.929  19.992  32.361
  171   HG13  ILE  23          HG13      ILE  23 -29.946  20.920  30.851
  172   HG21  ILE  23          HG21      ILE  23 -27.189  18.916  32.624
  173   HG22  ILE  23          HG22      ILE  23 -26.221  20.328  33.087
  174   HG23  ILE  23          HG23      ILE  23 -27.822  20.064  33.849
  175   HD11  ILE  23          HD11      ILE  23 -30.315  18.563  30.348
  176   HD12  ILE  23          HD12      ILE  23 -28.750  19.069  29.653
  177   HD13  ILE  23          HD13      ILE  23 -28.797  18.078  31.143
  178    H    GLU  24           H        GLU  24 -25.918  23.097  30.949
  179    HA   GLU  24           HA       GLU  24 -24.149  23.037  33.191
  180    HB2  GLU  24           HB2      GLU  24 -23.338  23.068  30.796
  181    HB3  GLU  24           HB3      GLU  24 -23.856  24.777  30.678
  182    HG2  GLU  24           HG2      GLU  24 -21.383  24.516  31.171
  183    HG3  GLU  24           HG3      GLU  24 -22.241  25.436  32.432
  184    H    TRP  25           H        TRP  25 -26.044  25.738  31.615
  185    HA   TRP  25           HA       TRP  25 -25.197  27.795  33.312
  186    HB2  TRP  25           HB2      TRP  25 -26.667  28.145  31.399
  187    HB3  TRP  25           HB3      TRP  25 -28.006  27.278  32.191
  188    HD1  TRP  25           HD1      TRP  25 -25.990  30.568  32.567
  189    HE1  TRP  25           HE1      TRP  25 -27.480  32.273  33.703
  190    HE3  TRP  25           HE3      TRP  25 -30.100  27.576  33.607
  191    HZ2  TRP  25           HZ2      TRP  25 -29.899  32.414  34.947
  192    HZ3  TRP  25           HZ3      TRP  25 -31.956  28.612  34.945
  193    HH2  TRP  25           HH2      TRP  25 -31.877  31.006  35.552
  194    H    LEU  26           H        LEU  26 -27.838  25.307  34.005
  195    HA   LEU  26           HA       LEU  26 -28.243  26.363  36.670
  196    HB2  LEU  26           HB2      LEU  26 -28.763  23.537  35.593
  197    HB3  LEU  26           HB3      LEU  26 -29.212  24.099  37.220
  198    HG   LEU  26           HG       LEU  26 -30.288  25.278  34.574
  199   HD11  LEU  26          HD11      LEU  26 -31.069  22.934  34.880
  200   HD12  LEU  26          HD12      LEU  26 -31.524  23.289  36.573
  201   HD13  LEU  26          HD13      LEU  26 -32.402  24.064  35.230
  202   HD21  LEU  26          HD21      LEU  26 -31.117  25.764  37.513
  203   HD22  LEU  26          HD22      LEU  26 -30.468  26.998  36.405
  204   HD23  LEU  26          HD23      LEU  26 -32.062  26.309  36.100
  205    H    LYS  27           H        LYS  27 -26.289  23.437  35.640
  206    HA   LYS  27           HA       LYS  27 -25.417  22.827  38.262
  207    HB2  LYS  27           HB2      LYS  27 -24.999  21.344  36.317
  208    HB3  LYS  27           HB3      LYS  27 -23.942  22.574  35.575
  209    HG2  LYS  27           HG2      LYS  27 -22.261  22.316  37.400
  210    HG3  LYS  27           HG3      LYS  27 -23.358  21.216  38.262
  211    HD2  LYS  27           HD2      LYS  27 -21.585  19.931  37.099
  212    HD3  LYS  27           HD3      LYS  27 -23.195  19.532  36.451
  213    HE2  LYS  27           HE2      LYS  27 -21.515  19.668  34.654
  214    HE3  LYS  27           HE3      LYS  27 -22.753  20.907  34.404
  215    HZ1  LYS  27           HZ1      LYS  27 -21.214  22.634  35.238
  216    HZ2  LYS  27           HZ2      LYS  27 -20.021  21.455  35.663
  217    HZ3  LYS  27           HZ3      LYS  27 -20.424  21.705  34.008
  218    H    ASN  28           H        ASN  28 -23.994  25.020  35.837
  219    HA   ASN  28           HA       ASN  28 -21.695  25.863  37.324
  220    HB2  ASN  28           HB2      ASN  28 -22.146  26.109  34.854
  221    HB3  ASN  28           HB3      ASN  28 -23.367  27.374  35.207
  222   HD21  ASN  28          HD21      ASN  28 -21.589  27.947  33.350
  223   HD22  ASN  28          HD22      ASN  28 -20.363  28.995  33.953
  224    H    GLY  29           H        GLY  29 -25.154  26.985  37.344
  225    HA2  GLY  29           HA2      GLY  29 -24.926  28.055  39.914
  226    HA3  GLY  29           HA3      GLY  29 -24.603  29.423  38.816
  227    H    GLY  30           H        GLY  30 -26.563  28.720  36.680
  228    HA2  GLY  30           HA2      GLY  30 -28.873  28.805  36.317
  229    HA3  GLY  30           HA3      GLY  30 -29.146  28.526  38.042
  230    HA   PRO  31           HA       PRO  31 -29.937  33.129  37.357
  231    HB2  PRO  31           HB2      PRO  31 -30.631  32.550  40.302
  232    HB3  PRO  31           HB3      PRO  31 -31.433  33.709  39.193
  233    HG2  PRO  31           HG2      PRO  31 -32.637  31.319  39.584
  234    HG3  PRO  31           HG3      PRO  31 -32.389  31.860  37.894
  235    HD2  PRO  31           HD2      PRO  31 -30.646  29.880  39.477
  236    HD3  PRO  31           HD3      PRO  31 -31.311  29.690  37.811
  237    H    SER  32           H        SER  32 -28.240  31.397  40.104
  238    HA   SER  32           HA       SER  32 -26.680  33.636  40.931
  239    HB2  SER  32           HB2      SER  32 -26.814  31.472  42.211
  240    HB3  SER  32           HB3      SER  32 -25.808  30.684  40.967
  241    HG   SER  32           HG       SER  32 -24.130  32.312  41.589
  242    H    SER  33           H        SER  33 -26.278  31.453  38.055
  243    HA   SER  33           HA       SER  33 -23.541  32.156  37.579
  244    HB2  SER  33           HB2      SER  33 -24.715  30.307  36.347
  245    HB3  SER  33           HB3      SER  33 -25.700  31.513  35.476
  246    HG   SER  33           HG       SER  33 -23.568  32.303  34.630
  247    H    GLY  34           H        GLY  34 -26.620  34.010  37.063
  248    HA2  GLY  34           HA2      GLY  34 -26.630  36.357  36.795
  249    HA3  GLY  34           HA3      GLY  34 -24.913  36.335  36.377
  250    H    ALA  35           H        ALA  35 -24.684  34.624  34.222
  251    HA   ALA  35           HA       ALA  35 -25.606  36.068  32.062
  252    HB1  ALA  35           HB1      ALA  35 -25.260  33.905  30.696
  253    HB2  ALA  35           HB2      ALA  35 -23.920  34.241  31.820
  254    HB3  ALA  35           HB3      ALA  35 -25.151  33.021  32.232
  255    HA   PRO  36           HA       PRO  36 -29.970  35.099  32.097
  256    HB2  PRO  36           HB2      PRO  36 -30.726  35.346  29.394
  257    HB3  PRO  36           HB3      PRO  36 -30.180  36.746  30.375
  258    HG2  PRO  36           HG2      PRO  36 -28.435  34.975  28.577
  259    HG3  PRO  36           HG3      PRO  36 -28.640  36.754  28.438
  260    HD2  PRO  36           HD2      PRO  36 -26.511  35.759  29.813
  261    HD3  PRO  36           HD3      PRO  36 -27.442  37.110  30.577
  262    HA   PRO  37           HA       PRO  37 -30.066  30.761  31.435
  263    HB2  PRO  37           HB2      PRO  37 -32.723  30.150  30.799
  264    HB3  PRO  37           HB3      PRO  37 -32.173  30.698  32.416
  265    HG2  PRO  37           HG2      PRO  37 -33.337  32.449  30.217
  266    HG3  PRO  37           HG3      PRO  37 -33.887  32.346  31.919
  267    HD2  PRO  37           HD2      PRO  37 -32.196  34.331  31.159
  268    HD3  PRO  37           HD3      PRO  37 -31.821  33.461  32.708
  269    HA   PRO  38           HA       PRO  38 -29.538  30.370  26.806
  270    HB2  PRO  38           HB2      PRO  38 -29.314  27.498  27.871
  271    HB3  PRO  38           HB3      PRO  38 -28.392  28.236  26.528
  272    HG2  PRO  38           HG2      PRO  38 -27.204  28.069  28.949
  273    HG3  PRO  38           HG3      PRO  38 -27.189  29.666  28.135
  274    HD2  PRO  38           HD2      PRO  38 -29.116  28.750  30.371
  275    HD3  PRO  38           HD3      PRO  38 -28.138  30.266  30.227
  276    H    SER  39           H        SER  39 -31.879  30.952  26.579
  277    HA   SER  39           HA       SER  39 -33.630  28.616  25.983
  278    HB2  SER  39           HB2      SER  39 -33.865  28.870  28.431
  279    HB3  SER  39           HB3      SER  39 -34.181  30.620  28.256
  280    HG   SER  39           HG       SER  39 -36.196  29.385  28.376
  281    HN1  NH2  40           H11      SER  39 -33.891  29.477  23.755
  282    HN2  NH2  40           H12      SER  39 -34.675  30.993  23.515
  283    H03  D6M 101          H N2      LYS  14 -28.092  31.651  18.600
  284   H121  D6M 101          H101      LYS  14 -30.177  33.016  19.527
  285   H122  D6M 101          H102      LYS  14 -31.457  33.103  18.305
  286    H04  D6M 101           HC2      LYS  14 -29.274  29.007  17.873
  287   H051  D6M 101          HC31      LYS  14 -26.894  30.365  16.503
  288   H052  D6M 101          HC32      LYS  14 -28.481  30.141  15.743
  289   H061  D6M 101          HC41      LYS  14 -26.757  27.779  16.723
  290   H062  D6M 101          HC42      LYS  14 -26.716  28.412  15.062
  291   H131  D6M 101          H111      LYS  14 -28.508  33.872  17.733
  292   H132  D6M 101          H112      LYS  14 -29.793  35.001  18.196
  293   H141  D6M 101          H121      LYS  14 -29.453  35.092  15.792
  294   H142  D6M 101          H122      LYS  14 -31.078  34.435  16.115
  295   H151  D6M 101          H131      LYS  14 -30.350  32.168  15.578
  296   H152  D6M 101          H132      LYS  14 -28.633  32.652  15.527
  297   H161  D6M 101          H141      LYS  14 -29.101  34.051  13.511
  298   H162  D6M 101          H142      LYS  14 -30.828  33.613  13.569
  299   H171  D6M 101          H151      LYS  14 -30.217  31.190  13.244
  300   H172  D6M 101          H152      LYS  14 -28.489  31.643  13.242
  301   H181  D6M 101          H161      LYS  14 -28.964  33.121  11.185
  302   H182  D6M 101          H162      LYS  14 -30.630  32.485  11.167
  303   H191  D6M 101          H171      LYS  14 -29.721  30.142  10.892
  304   H192  D6M 101          H172      LYS  14 -28.060  30.806  10.928
  305   H201  D6M 101          H181      LYS  14 -28.599  32.174   8.863
  306   H202  D6M 101          H182      LYS  14 -30.214  31.429   8.819
  307   H211  D6M 101          H191      LYS  14 -29.064  29.126   8.678
  308   H212  D6M 101          H192      LYS  14 -27.493  29.966   8.575
  309   H221  D6M 101          H201      LYS  14 -28.298  31.134   6.472
  310   H222  D6M 101          H202      LYS  14 -29.829  30.220   6.595
  311   H231  D6M 101          H211      LYS  14 -28.424  28.045   6.515
  312   H232  D6M 101          H212      LYS  14 -26.995  29.053   6.179
  313   H241  D6M 101          H221      LYS  14 -28.122  29.943   4.102
  314   H242  D6M 101          H222      LYS  14 -29.554  28.932   4.455
  315   H251  D6M 101          H231      LYS  14 -28.116  26.876   4.297
  316   H252  D6M 101          H232      LYS  14 -26.708  27.894   3.883
  317   H261  D6M 101          H241      LYS  14 -29.318  27.670   2.232
  318   H262  D6M 101          H242      LYS  14 -27.938  28.733   1.814
  319   H263  D6M 101          H243      LYS  14 -27.737  26.955   1.791
  Start of MODEL   10
    1    H1   HIS   1           H1       HIS   1 -33.462  18.295  -3.610
    2    H2   HIS   1           H2       HIS   1 -34.113  19.110  -2.236
    3    H3   HIS   1           H3       HIS   1 -34.428  19.677  -3.803
    4    HA   HIS   1           HA       HIS   1 -36.421  18.471  -2.882
    5    HB2  HIS   1           HB2      HIS   1 -35.923  18.421  -5.406
    6    HB3  HIS   1           HB3      HIS   1 -35.113  16.857  -5.160
    7    HD1  HIS   1           HD1      HIS   1 -36.758  14.924  -4.221
    8    HD2  HIS   1           HD2      HIS   1 -38.522  18.401  -5.793
    9    HE1  HIS   1           HE1      HIS   1 -39.155  14.304  -4.702
   10    H    DSN   2           HN       DSN   2 -37.314  16.355  -1.995
   11    HA   DSN   2           HA       DSN   2 -35.400  14.181  -1.596
   12    HB2  DSN   2           HB1      DSN   2 -37.182  13.114  -0.280
   13    HB3  DSN   2           HB2      DSN   2 -37.843  13.740  -1.824
   14    HG   DSN   2           HOG      DSN   2 -39.183  14.360   0.037
   15    H    GLN   3           H        GLN   3 -34.819  13.371   0.698
   16    HA   GLN   3           HA       GLN   3 -34.065  13.784   2.870
   17    HB2  GLN   3           HB2      GLN   3 -33.219  16.431   1.536
   18    HB3  GLN   3           HB3      GLN   3 -32.552  15.737   3.032
   19    HG2  GLN   3           HG2      GLN   3 -31.744  13.721   1.694
   20    HG3  GLN   3           HG3      GLN   3 -32.460  14.430   0.227
   21   HE21  GLN   3          HE21      GLN   3 -30.153  15.487   2.922
   22   HE22  GLN   3          HE22      GLN   3 -29.081  16.267   1.819
   23    H    GLY   4           H        GLY   4 -36.766  14.018   2.926
   24    HA2  GLY   4           HA2      GLY   4 -37.746  16.549   3.710
   25    HA3  GLY   4           HA3      GLY   4 -38.484  14.997   4.169
   26    H    THR   5           H        THR   5 -38.524  17.260   5.874
   27    HA   THR   5           HA       THR   5 -37.738  18.069   7.906
   28    HB   THR   5           HB       THR   5 -38.254  16.561   9.718
   29    HG1  THR   5           HG1      THR   5 -37.124  14.639   8.956
   30   HG21  THR   5          HG21      THR   5 -40.064  15.846   7.333
   31   HG22  THR   5          HG22      THR   5 -40.486  15.779   9.066
   32   HG23  THR   5          HG23      THR   5 -40.168  17.357   8.289
   33    H    PHE   6           H        PHE   6 -35.411  17.778   6.293
   34    HA   PHE   6           HA       PHE   6 -33.375  16.389   7.746
   35    HB2  PHE   6           HB2      PHE   6 -32.994  17.251   5.469
   36    HB3  PHE   6           HB3      PHE   6 -33.175  18.926   6.036
   37    HD1  PHE   6           HD1      PHE   6 -31.175  15.756   6.630
   38    HD2  PHE   6           HD2      PHE   6 -31.159  20.060   6.801
   39    HE1  PHE   6           HE1      PHE   6 -28.734  15.735   7.034
   40    HE2  PHE   6           HE2      PHE   6 -28.704  20.034   7.092
   41    HZ   PHE   6           HZ       PHE   6 -27.481  17.875   7.192
   42    H    THR   7           H        THR   7 -34.631  19.830   8.193
   43    HA   THR   7           HA       THR   7 -32.766  20.507  10.123
   44    HB   THR   7           HB       THR   7 -34.493  22.117   9.324
   45    HG1  THR   7           HG1      THR   7 -34.264  21.891  12.179
   46   HG21  THR   7          HG21      THR   7 -36.397  20.754  11.345
   47   HG22  THR   7          HG22      THR   7 -36.718  22.239  10.422
   48   HG23  THR   7          HG23      THR   7 -36.566  20.675   9.568
   49    H    SER   8           H        SER   8 -35.470  18.092  10.621
   50    HA   SER   8           HA       SER   8 -35.625  18.453  13.426
   51    HB2  SER   8           HB2      SER   8 -37.167  16.949  12.165
   52    HB3  SER   8           HB3      SER   8 -35.841  15.780  11.925
   53    HG   SER   8           HG       SER   8 -37.116  15.297  13.879
   54    H    ASP   9           H        ASP   9 -33.309  16.370  11.527
   55    HA   ASP   9           HA       ASP   9 -32.049  15.392  13.916
   56    HB2  ASP   9           HB2      ASP   9 -31.864  14.337  11.594
   57    HB3  ASP   9           HB3      ASP   9 -30.798  15.681  11.112
   58    H    LEU  10           H        LEU  10 -31.515  18.413  12.003
   59    HA   LEU  10           HA       LEU  10 -29.087  19.117  13.433
   60    HB2  LEU  10           HB2      LEU  10 -30.993  20.824  11.786
   61    HB3  LEU  10           HB3      LEU  10 -29.820  21.547  12.898
   62    HG   LEU  10           HG       LEU  10 -27.944  20.340  11.600
   63   HD11  LEU  10          HD11      LEU  10 -30.129  19.203   9.733
   64   HD12  LEU  10          HD12      LEU  10 -28.350  19.088   9.577
   65   HD13  LEU  10          HD13      LEU  10 -29.153  18.314  10.956
   66   HD21  LEU  10          HD21      LEU  10 -29.912  21.786   9.701
   67   HD22  LEU  10          HD22      LEU  10 -28.744  22.539  10.857
   68   HD23  LEU  10          HD23      LEU  10 -28.149  21.510   9.501
   69    H    SER  11           H        SER  11 -32.715  19.949  13.821
   70    HA   SER  11           HA       SER  11 -32.459  21.589  16.059
   71    HB2  SER  11           HB2      SER  11 -34.608  19.464  15.567
   72    HB3  SER  11           HB3      SER  11 -34.710  20.793  16.742
   73    HG   SER  11           HG       SER  11 -34.601  22.247  14.845
   74    H    LYS  12           H        LYS  12 -32.158  17.962  15.867
   75    HA   LYS  12           HA       LYS  12 -32.085  17.736  18.749
   76    HB2  LYS  12           HB2      LYS  12 -32.699  15.890  17.134
   77    HB3  LYS  12           HB3      LYS  12 -30.972  15.692  16.761
   78    HG2  LYS  12           HG2      LYS  12 -30.513  15.186  19.195
   79    HG3  LYS  12           HG3      LYS  12 -32.224  15.527  19.580
   80    HD2  LYS  12           HD2      LYS  12 -32.898  13.637  17.993
   81    HD3  LYS  12           HD3      LYS  12 -31.173  13.214  17.839
   82    HE2  LYS  12           HE2      LYS  12 -31.056  12.795  20.305
   83    HE3  LYS  12           HE3      LYS  12 -32.735  13.350  20.512
   84    HZ1  LYS  12           HZ1      LYS  12 -32.640  10.862  20.457
   85    HZ2  LYS  12           HZ2      LYS  12 -33.540  11.447  19.110
   86    HZ3  LYS  12           HZ3      LYS  12 -31.946  10.901  18.886
   87    H    GLN  13           H        GLN  13 -29.489  18.156  16.187
   88    HA   GLN  13           HA       GLN  13 -27.328  17.890  18.112
   89    HB2  GLN  13           HB2      GLN  13 -27.402  19.669  15.585
   90    HB3  GLN  13           HB3      GLN  13 -25.983  19.329  16.605
   91    HG2  GLN  13           HG2      GLN  13 -26.400  16.799  16.103
   92    HG3  GLN  13           HG3      GLN  13 -27.499  17.350  14.820
   93   HE21  GLN  13          HE21      GLN  13 -26.514  18.869  13.073
   94   HE22  GLN  13          HE22      GLN  13 -24.837  18.666  12.734
   95    H    LYS  14           HN       LYS  14 -29.477  20.643  17.072
   96    HA   LYS  14           HA       LYS  14 -28.029  22.590  18.619
   97    HB2  LYS  14           HB2      LYS  14 -30.978  22.546  17.734
   98    HB3  LYS  14           HB3      LYS  14 -30.187  23.940  18.505
   99    HG2  LYS  14          HC81      LYS  14 -28.552  24.129  16.711
  100    HG3  LYS  14          HC82      LYS  14 -29.169  22.691  15.866
  101    HD2  LYS  14          HC71      LYS  14 -31.359  23.802  15.467
  102    HD3  LYS  14          HC72      LYS  14 -30.809  25.253  16.350
  103    HE2  LYS  14          HC61      LYS  14 -29.490  24.133  13.787
  104    HE3  LYS  14          HC62      LYS  14 -30.615  25.506  13.823
  105    HZ1  LYS  14          H N1      LYS  14 -27.813  25.501  14.744
  106    H    ASP  15           H        ASP  15 -30.887  20.473  19.378
  107    HA   ASP  15           HA       ASP  15 -31.296  21.373  22.030
  108    HB2  ASP  15           HB2      ASP  15 -32.810  19.721  20.853
  109    HB3  ASP  15           HB3      ASP  15 -31.511  18.503  20.930
  110    H    SER  16           H        SER  16 -28.929  18.892  20.672
  111    HA   SER  16           HA       SER  16 -28.106  18.001  23.238
  112    HB2  SER  16           HB2      SER  16 -27.503  16.851  21.134
  113    HB3  SER  16           HB3      SER  16 -26.396  18.186  20.689
  114    HG   SER  16           HG       SER  16 -25.314  16.365  21.820
  115    H    ARG  17           H        ARG  17 -26.869  20.832  21.244
  116    HA   ARG  17           HA       ARG  17 -24.898  21.456  23.288
  117    HB2  ARG  17           HB2      ARG  17 -24.708  21.977  20.816
  118    HB3  ARG  17           HB3      ARG  17 -26.011  23.179  20.986
  119    HG2  ARG  17           HG2      ARG  17 -24.514  24.310  22.783
  120    HG3  ARG  17           HG3      ARG  17 -23.265  23.104  22.376
  121    HD2  ARG  17           HD2      ARG  17 -22.700  25.115  21.193
  122    HD3  ARG  17           HD3      ARG  17 -23.315  23.953  19.969
  123    HE   ARG  17           HE       ARG  17 -25.490  25.616  20.926
  124   HH11  ARG  17          HH11      ARG  17 -26.211  27.395  19.753
  125   HH12  ARG  17          HH12      ARG  17 -25.197  28.120  18.528
  126   HH21  ARG  17          HH21      ARG  17 -22.493  25.925  18.953
  127   HH22  ARG  17          HH22      ARG  17 -23.117  27.337  18.115
  128    H    ARG  18           H        ARG  18 -28.142  22.873  22.349
  129    HA   ARG  18           HA       ARG  18 -27.941  24.997  24.314
  130    HB2  ARG  18           HB2      ARG  18 -30.305  23.780  22.782
  131    HB3  ARG  18           HB3      ARG  18 -30.533  25.115  23.914
  132    HG2  ARG  18           HG2      ARG  18 -28.347  25.477  21.857
  133    HG3  ARG  18           HG3      ARG  18 -30.024  25.599  21.276
  134    HD2  ARG  18           HD2      ARG  18 -30.536  27.418  22.763
  135    HD3  ARG  18           HD3      ARG  18 -29.012  27.185  23.699
  136    HE   ARG  18           HE       ARG  18 -28.339  27.733  20.970
  137   HH11  ARG  18          HH11      ARG  18 -27.372  29.740  20.544
  138   HH12  ARG  18          HH12      ARG  18 -27.741  31.140  21.544
  139   HH21  ARG  18          HH21      ARG  18 -29.803  29.417  23.788
  140   HH22  ARG  18          HH22      ARG  18 -29.062  30.948  23.360
  141    H    ALA  19           H        ALA  19 -29.476  21.703  24.374
  142    HA   ALA  19           HA       ALA  19 -30.541  21.938  27.006
  143    HB1  ALA  19           HB1      ALA  19 -29.316  19.437  25.666
  144    HB2  ALA  19           HB2      ALA  19 -30.409  19.443  27.076
  145    HB3  ALA  19           HB3      ALA  19 -31.009  19.980  25.480
  146    H    GLN  20           H        GLN  20 -27.220  20.784  25.856
  147    HA   GLN  20           HA       GLN  20 -26.214  20.482  28.516
  148    HB2  GLN  20           HB2      GLN  20 -24.772  21.081  25.877
  149    HB3  GLN  20           HB3      GLN  20 -23.924  20.949  27.438
  150    HG2  GLN  20           HG2      GLN  20 -24.731  18.644  27.769
  151    HG3  GLN  20           HG3      GLN  20 -25.688  18.711  26.272
  152   HE21  GLN  20          HE21      GLN  20 -24.205  16.641  25.948
  153   HE22  GLN  20          HE22      GLN  20 -22.699  16.945  25.164
  154    H    ASP  21           H        ASP  21 -26.580  23.430  26.448
  155    HA   ASP  21           HA       ASP  21 -24.894  25.040  28.166
  156    HB2  ASP  21           HB2      ASP  21 -25.647  25.607  25.750
  157    HB3  ASP  21           HB3      ASP  21 -27.208  26.121  26.447
  158    H    PHE  22           H        PHE  22 -28.470  24.340  28.033
  159    HA   PHE  22           HA       PHE  22 -29.117  26.101  30.229
  160    HB2  PHE  22           HB2      PHE  22 -30.844  25.170  28.675
  161    HB3  PHE  22           HB3      PHE  22 -30.517  23.534  29.255
  162    HD1  PHE  22           HD1      PHE  22 -31.486  26.976  30.499
  163    HD2  PHE  22           HD2      PHE  22 -31.742  22.738  31.170
  164    HE1  PHE  22           HE1      PHE  22 -33.009  27.364  32.404
  165    HE2  PHE  22           HE2      PHE  22 -33.500  23.115  32.859
  166    HZ   PHE  22           HZ       PHE  22 -34.071  25.437  33.553
  167    H    ILE  23           H        ILE  23 -28.194  22.594  30.051
  168    HA   ILE  23           HA       ILE  23 -28.432  22.212  32.915
  169    HB   ILE  23           HB       ILE  23 -26.729  20.775  30.805
  170   HG12  ILE  23          HG12      ILE  23 -29.256  19.770  32.280
  171   HG13  ILE  23          HG13      ILE  23 -29.370  20.643  30.747
  172   HG21  ILE  23          HG21      ILE  23 -26.349  18.985  32.484
  173   HG22  ILE  23          HG22      ILE  23 -25.628  20.522  32.995
  174   HG23  ILE  23          HG23      ILE  23 -27.167  19.982  33.731
  175   HD11  ILE  23          HD11      ILE  23 -27.944  17.937  31.135
  176   HD12  ILE  23          HD12      ILE  23 -29.468  18.248  30.273
  177   HD13  ILE  23          HD13      ILE  23 -27.941  18.900  29.625
  178    H    GLU  24           H        GLU  24 -25.756  23.409  30.743
  179    HA   GLU  24           HA       GLU  24 -23.805  23.539  32.826
  180    HB2  GLU  24           HB2      GLU  24 -23.361  23.998  30.261
  181    HB3  GLU  24           HB3      GLU  24 -23.990  25.627  30.577
  182    HG2  GLU  24           HG2      GLU  24 -21.561  25.679  30.697
  183    HG3  GLU  24           HG3      GLU  24 -22.223  25.959  32.332
  184    H    TRP  25           H        TRP  25 -26.323  25.867  31.624
  185    HA   TRP  25           HA       TRP  25 -25.596  27.986  33.345
  186    HB2  TRP  25           HB2      TRP  25 -27.171  28.176  31.403
  187    HB3  TRP  25           HB3      TRP  25 -28.402  27.273  32.301
  188    HD1  TRP  25           HD1      TRP  25 -26.395  30.619  32.589
  189    HE1  TRP  25           HE1      TRP  25 -27.864  32.311  33.739
  190    HE3  TRP  25           HE3      TRP  25 -30.467  27.596  33.684
  191    HZ2  TRP  25           HZ2      TRP  25 -30.298  32.456  34.946
  192    HZ3  TRP  25           HZ3      TRP  25 -32.337  28.637  34.988
  193    HH2  TRP  25           HH2      TRP  25 -32.292  31.056  35.517
  194    H    LEU  26           H        LEU  26 -28.053  25.304  33.937
  195    HA   LEU  26           HA       LEU  26 -28.584  26.243  36.642
  196    HB2  LEU  26           HB2      LEU  26 -28.859  23.446  35.464
  197    HB3  LEU  26           HB3      LEU  26 -29.456  23.939  37.069
  198    HG   LEU  26           HG       LEU  26 -30.476  25.108  34.398
  199   HD11  LEU  26          HD11      LEU  26 -32.583  23.787  35.051
  200   HD12  LEU  26          HD12      LEU  26 -31.173  22.773  34.628
  201   HD13  LEU  26          HD13      LEU  26 -31.634  23.023  36.343
  202   HD21  LEU  26          HD21      LEU  26 -32.332  26.074  35.837
  203   HD22  LEU  26          HD22      LEU  26 -31.451  25.553  37.302
  204   HD23  LEU  26          HD23      LEU  26 -30.768  26.795  36.218
  205    H    LYS  27           H        LYS  27 -26.437  23.545  35.436
  206    HA   LYS  27           HA       LYS  27 -25.333  22.813  37.921
  207    HB2  LYS  27           HB2      LYS  27 -24.833  21.748  35.667
  208    HB3  LYS  27           HB3      LYS  27 -23.929  23.204  35.211
  209    HG2  LYS  27           HG2      LYS  27 -22.383  22.663  37.294
  210    HG3  LYS  27           HG3      LYS  27 -23.206  21.085  37.311
  211    HD2  LYS  27           HD2      LYS  27 -21.249  20.663  35.978
  212    HD3  LYS  27           HD3      LYS  27 -22.536  20.920  34.770
  213    HE2  LYS  27           HE2      LYS  27 -21.737  23.385  34.620
  214    HE3  LYS  27           HE3      LYS  27 -20.427  22.958  35.736
  215    HZ1  LYS  27           HZ1      LYS  27 -19.643  22.922  33.422
  216    HZ2  LYS  27           HZ2      LYS  27 -19.616  21.303  33.954
  217    HZ3  LYS  27           HZ3      LYS  27 -20.873  21.843  32.917
  218    H    ASN  28           H        ASN  28 -24.599  25.633  35.844
  219    HA   ASN  28           HA       ASN  28 -22.314  26.464  37.498
  220    HB2  ASN  28           HB2      ASN  28 -22.470  26.639  34.999
  221    HB3  ASN  28           HB3      ASN  28 -23.780  27.856  35.182
  222   HD21  ASN  28          HD21      ASN  28 -22.055  28.667  33.535
  223   HD22  ASN  28          HD22      ASN  28 -20.864  29.706  34.219
  224    H    GLY  29           H        GLY  29 -25.561  26.620  38.419
  225    HA2  GLY  29           HA2      GLY  29 -25.773  28.015  40.407
  226    HA3  GLY  29           HA3      GLY  29 -25.235  29.436  39.487
  227    H    GLY  30           H        GLY  30 -26.969  28.197  37.061
  228    HA2  GLY  30           HA2      GLY  30 -29.127  28.646  36.295
  229    HA3  GLY  30           HA3      GLY  30 -29.655  28.438  37.966
  230    HA   PRO  31           HA       PRO  31 -30.164  33.075  37.214
  231    HB2  PRO  31           HB2      PRO  31 -30.789  32.631  40.190
  232    HB3  PRO  31           HB3      PRO  31 -31.553  33.815  39.082
  233    HG2  PRO  31           HG2      PRO  31 -32.879  31.509  39.554
  234    HG3  PRO  31           HG3      PRO  31 -32.637  31.995  37.843
  235    HD2  PRO  31           HD2      PRO  31 -30.987  29.946  39.455
  236    HD3  PRO  31           HD3      PRO  31 -31.690  29.749  37.808
  237    H    SER  32           H        SER  32 -28.488  31.462  40.039
  238    HA   SER  32           HA       SER  32 -26.819  33.756  40.546
  239    HB2  SER  32           HB2      SER  32 -26.326  30.828  41.307
  240    HB3  SER  32           HB3      SER  32 -25.530  32.242  42.041
  241    HG   SER  32           HG       SER  32 -27.737  32.853  42.788
  242    H    SER  33           H        SER  33 -26.594  31.348  37.948
  243    HA   SER  33           HA       SER  33 -23.776  31.288  37.644
  244    HB2  SER  33           HB2      SER  33 -25.361  29.979  36.204
  245    HB3  SER  33           HB3      SER  33 -25.915  31.501  35.438
  246    HG   SER  33           HG       SER  33 -24.160  30.435  34.203
  247    H    GLY  34           H        GLY  34 -26.153  33.932  36.942
  248    HA2  GLY  34           HA2      GLY  34 -25.349  36.194  37.179
  249    HA3  GLY  34           HA3      GLY  34 -23.777  35.743  36.500
  250    H    ALA  35           H        ALA  35 -24.663  34.127  34.253
  251    HA   ALA  35           HA       ALA  35 -25.418  36.290  32.454
  252    HB1  ALA  35           HB1      ALA  35 -25.419  34.438  30.704
  253    HB2  ALA  35           HB2      ALA  35 -23.922  34.453  31.674
  254    HB3  ALA  35           HB3      ALA  35 -25.195  33.242  32.004
  255    HA   PRO  36           HA       PRO  36 -29.873  35.252  32.770
  256    HB2  PRO  36           HB2      PRO  36 -30.814  35.995  30.248
  257    HB3  PRO  36           HB3      PRO  36 -30.197  37.208  31.423
  258    HG2  PRO  36           HG2      PRO  36 -28.596  35.834  29.204
  259    HG3  PRO  36           HG3      PRO  36 -28.863  37.596  29.378
  260    HD2  PRO  36           HD2      PRO  36 -26.604  36.471  30.383
  261    HD3  PRO  36           HD3      PRO  36 -27.479  37.646  31.434
  262    HA   PRO  37           HA       PRO  37 -29.570  31.179  31.323
  263    HB2  PRO  37           HB2      PRO  37 -32.160  30.246  30.746
  264    HB3  PRO  37           HB3      PRO  37 -31.630  30.709  32.375
  265    HG2  PRO  37           HG2      PRO  37 -33.058  32.514  30.382
  266    HG3  PRO  37           HG3      PRO  37 -33.579  32.147  32.053
  267    HD2  PRO  37           HD2      PRO  37 -32.152  34.429  31.526
  268    HD3  PRO  37           HD3      PRO  37 -31.685  33.458  32.975
  269    HA   PRO  38           HA       PRO  38 -29.791  31.103  26.710
  270    HB2  PRO  38           HB2      PRO  38 -29.063  28.537  26.208
  271    HB3  PRO  38           HB3      PRO  38 -27.931  29.628  27.046
  272    HG2  PRO  38           HG2      PRO  38 -29.793  27.611  28.376
  273    HG3  PRO  38           HG3      PRO  38 -28.019  27.752  28.595
  274    HD2  PRO  38           HD2      PRO  38 -29.857  28.953  30.334
  275    HD3  PRO  38           HD3      PRO  38 -28.289  29.751  29.958
  276    H    SER  39           H        SER  39 -32.189  31.551  27.445
  277    HA   SER  39           HA       SER  39 -33.934  29.573  26.184
  278    HB2  SER  39           HB2      SER  39 -33.550  28.547  28.493
  279    HB3  SER  39           HB3      SER  39 -34.204  30.041  29.216
  280    HG   SER  39           HG       SER  39 -35.905  28.376  28.865
  281    HN1  NH2  40           H11      SER  39 -36.361  30.259  26.485
  282    HN2  NH2  40           H12      SER  39 -36.635  31.966  26.560
  283    H03  D6M 101          H N2      LYS  14 -28.835  31.004  18.605
  284   H121  D6M 101          H101      LYS  14 -32.245  32.417  18.334
  285   H122  D6M 101          H102      LYS  14 -30.584  33.002  18.189
  286    H04  D6M 101           HC2      LYS  14 -29.954  28.498  17.427
  287   H051  D6M 101          HC31      LYS  14 -27.432  29.961  16.452
  288   H052  D6M 101          HC32      LYS  14 -28.957  29.864  15.548
  289   H061  D6M 101          HC41      LYS  14 -27.281  27.410  16.414
  290   H062  D6M 101          HC42      LYS  14 -27.208  28.161  14.800
  291   H131  D6M 101          H111      LYS  14 -31.511  33.093  20.548
  292   H132  D6M 101          H112      LYS  14 -29.992  32.183  20.415
  293   H141  D6M 101          H121      LYS  14 -31.527  31.005  21.915
  294   H142  D6M 101          H122      LYS  14 -31.222  30.010  20.474
  295   H151  D6M 101          H131      LYS  14 -33.436  30.674  19.524
  296   H152  D6M 101          H132      LYS  14 -33.730  31.777  20.895
  297   H161  D6M 101          H141      LYS  14 -33.761  29.854  22.469
  298   H162  D6M 101          H142      LYS  14 -33.334  28.726  21.153
  299   H171  D6M 101          H151      LYS  14 -35.474  29.346  19.964
  300   H172  D6M 101          H152      LYS  14 -35.935  30.390  21.335
  301   H181  D6M 101          H161      LYS  14 -35.452  27.336  21.495
  302   H182  D6M 101          H162      LYS  14 -37.040  28.119  21.316
  303   H191  D6M 101          H171      LYS  14 -36.703  29.309  23.519
  304   H192  D6M 101          H172      LYS  14 -35.189  28.398  23.765
  305   H201  D6M 101          H181      LYS  14 -36.491  26.224  23.587
  306   H202  D6M 101          H182      LYS  14 -37.989  27.170  23.386
  307   H211  D6M 101          H191      LYS  14 -37.539  28.241  25.670
  308   H212  D6M 101          H192      LYS  14 -36.161  27.124  25.869
  309   H221  D6M 101          H201      LYS  14 -37.793  25.171  25.613
  310   H222  D6M 101          H202      LYS  14 -39.123  26.346  25.458
  311   H231  D6M 101          H211      LYS  14 -38.575  27.246  27.759
  312   H232  D6M 101          H212      LYS  14 -37.314  25.992  27.929
  313   H241  D6M 101          H221      LYS  14 -39.038  24.193  27.712
  314   H242  D6M 101          H222      LYS  14 -40.313  25.417  27.443
  315   H251  D6M 101          H231      LYS  14 -39.856  26.367  29.740
  316   H252  D6M 101          H232      LYS  14 -38.644  25.090  30.014
  317   H261  D6M 101          H241      LYS  14 -40.806  24.442  31.070
  318   H262  D6M 101          H242      LYS  14 -41.665  24.662  29.517
  319   H263  D6M 101          H243      LYS  14 -40.478  23.338  29.701