A0A077ZL88_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZL88, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 324 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.4	Very low	44.4	Very low	212 Å²	212	123.3 Å²	123.3	100%	1.044	61%	0.613	S	S	*	*				0	-44.4	0	-90.8	177.9	153.2	0	0	113.3	T4	M1-T4 PolarHBondContact O-OG1 3.27Å
2	F	36.3	Very low	44.4	Very low	169 Å²	169	122.9 Å²	122.9	74%	0.741	61%	0.614	S	S	*	*	H	α-helix	trans	-64.1	-42.2	179.2	-105.1	-89.1	0	0	0	114.4	T4 Y5 W6	F2-T4 PolarHBondContact O-N 3.43Å; F2-Y5 PolarHBondContact O-N 3.35Å; F2-W6 AromaticContact CD1-NE1 3.74Å; F2-W6 PolarHBondContact O-N 3Å
3	C	40.1	Very low	44.4	Very low	100 Å²	100	117.5 Å²	117.5	68%	0.676	60%	0.595	S	S	*	*	H	α-helix	trans	-60.8	-39.2	-179.6	-106.2	0	0	0	0	114	W6 I7	C3-W6 PolarHBondContact O-N 3.27Å; C3-I7 WeakPolarHBondContact O-CD1 3.47Å; C3-I7 VanDerWaalsContact O-CG1 3.28Å; C3-I7 WeakPolarHBondContact O-CG1 3.3Å; C3-I7 PolarHBondContact O-N 2.85Å; C3-I7 VanDerWaalsContact O-N 3.11Å
4	T	43.4	Very low	44.5	Very low	93 Å²	93	112 Å²	112	57%	0.571	57%	0.57	S	S	*	*	H	α-helix	trans	-72.3	-35.3	-176.3	43.7	0	0	0	0	112.9	M1 F2 I7 T8	M1-T4 PolarHBondContact O-OG1 3.27Å; F2-T4 PolarHBondContact O-N 3.43Å; T4-I7 PolarHBondContact O-N 3.49Å; T4-T8 PolarHBondContact O-N 3.12Å; T4-T8 VanDerWaalsContact O-N 3.14Å; T4-T8 PolarHBondContact O-OG1 3.38Å
5	Y	40.2	Very low	44.3	Very low	150 Å²	150	106.9 Å²	106.9	59%	0.588	55%	0.552	S	S	*	*	H	α-helix	trans	-63.4	-42.7	174.4	178.5	-98.2	0	0	0	111.3	F2 T8 T9	F2-Y5 PolarHBondContact O-N 3.35Å; Y5-T8 PolarHBondContact O-OG1 3.4Å; Y5-T9 WeakPolarHBondContact O-CB 3.4Å; Y5-T9 PolarHBondContact O-N 3.12Å; Y5-T9 PolarHBondContact O-OG1 2.73Å
6	W	50.4	Low	43.9	Very low	165 Å²	165	105.2 Å²	105.2	63%	0.625	55%	0.547	S	S	*	.	H	α-helix	trans	-66.2	-39.1	177.6	-74.2	112.7	0	0	0	112.3	F2 C3 F10	F2-W6 AromaticContact CD1-NE1 3.74Å; F2-W6 PolarHBondContact O-N 3Å; C3-W6 PolarHBondContact O-N 3.27Å; W6-F10 WeakPolarHBondContact O-CB 3.5Å; W6-F10 PolarHBondContact O-N 3.17Å
7	I	50.8	Low	43.6	Very low	112 Å²	112	105.8 Å²	105.8	57%	0.574	55%	0.551	S	S	*	*	H	α-helix	trans	-61.8	-52.5	177.1	-67.4	163.8	0	0	0	110.7	C3 T4 T9 F10 T11	C3-I7 WeakPolarHBondContact O-CD1 3.47Å; C3-I7 VanDerWaalsContact O-CG1 3.28Å; C3-I7 WeakPolarHBondContact O-CG1 3.3Å; C3-I7 PolarHBondContact O-N 2.85Å; C3-I7 VanDerWaalsContact O-N 3.11Å; T4-I7 PolarHBondContact O-N 3.49Å; I7-T9 PolarHBondContact O-N 3.42Å; I7-F10 PolarHBondContact O-N 2.84Å; I7-T11 PolarHBondContact O-N 3.49Å; I7-T11 PolarHBondContact O-OG1 3.37Å
8	T	44.7	Very low	43.3	Very low	77 Å²	77	110.3 Å²	110.3	47%	0.472	56%	0.56	S	S	.	*	H	α-helix	trans	-64.8	-39.8	-179.5	36.8	0	0	0	0	113.3	T4 Y5 F10 T11 L12	T4-T8 PolarHBondContact O-N 3.12Å; T4-T8 VanDerWaalsContact O-N 3.14Å; T4-T8 PolarHBondContact O-OG1 3.38Å; Y5-T8 PolarHBondContact O-OG1 3.4Å; T8-F10 VanDerWaalsContact C-N 3.27Å; T8-F10 PolarHBondContact O-N 3.2Å; T8-T11 WeakPolarHBondContact CA-OG1 3.45Å; T8-T11 PolarHBondContact O-N 3.19Å; T8-T11 PolarHBondContact O-OG1 2.88Å; T8-L12 WeakPolarHBondContact O-CB 3.37Å; T8-L12 PolarHBondContact O-N 3.33Å
9	T	42.2	Very low	42.8	Very low	51 Å²	51	108.2 Å²	108.2	31%	0.313	56%	0.555	S	S	.	*	H	α-helix	trans	-64.4	-36.3	176.1	-47.1	0	0	0	0	110.8	Y5 I7 S13	Y5-T9 WeakPolarHBondContact O-CB 3.4Å; Y5-T9 PolarHBondContact O-N 3.12Å; Y5-T9 PolarHBondContact O-OG1 2.73Å; I7-T9 PolarHBondContact O-N 3.42Å; T9-S13 WeakPolarHBondContact O-CB 3.33Å; T9-S13 PolarHBondContact O-N 3.11Å; T9-S13 PolarHBondContact O-OG 3.39Å
10	F	49.4	Very low	42.3	Very low	145 Å²	145	110.5 Å²	110.5	64%	0.636	56%	0.563	S	S	*	*	H	α-helix	trans	-69.7	-42.1	175.4	-166.3	-95	0	0	0	112.6	W6 I7 T8 L12 S13 T14	W6-F10 WeakPolarHBondContact O-CB 3.5Å; W6-F10 PolarHBondContact O-N 3.17Å; I7-F10 PolarHBondContact O-N 2.84Å; T8-F10 VanDerWaalsContact C-N 3.27Å; T8-F10 PolarHBondContact O-N 3.2Å; F10-L12 VanDerWaalsContact C-N 3.35Å; F10-L12 PolarHBondContact O-N 3.24Å; F10-S13 WeakPolarHBondContact CA-OG 3.45Å; F10-S13 PolarHBondContact O-N 2.83Å; F10-S13 PolarHBondContact O-OG 2.78Å; F10-T14 HydrophobicContact CD1-CG2 4Å; F10-T14 HydrophobicContact CE1-CG2 3.68Å; F10-T14 HydrophobicContact CZ-CG2 3.97Å; F10-T14 WeakPolarHBondContact O-CB 3.34Å; F10-T14 WeakPolarHBondContact O-CG2 3.42Å; F10-T14 PolarHBondContact O-N 3.02Å; F10-T14 PolarHBondContact O-OG1 3.44Å
11	T	45.2	Very low	41.9	Very low	82 Å²	82	108.9 Å²	108.9	50%	0.503	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-40.7	174.8	2.9	0	0	0	0	111.9	I7 T8 T14 A15	I7-T11 PolarHBondContact O-N 3.49Å; I7-T11 PolarHBondContact O-OG1 3.37Å; T8-T11 WeakPolarHBondContact CA-OG1 3.45Å; T8-T11 PolarHBondContact O-N 3.19Å; T8-T11 PolarHBondContact O-OG1 2.88Å; T11-T14 WeakPolarHBondContact CA-OG1 3.32Å; T11-T14 PolarHBondContact O-OG1 3.31Å; T11-A15 VanDerWaalsContact O-CB 3.27Å; T11-A15 WeakPolarHBondContact O-CB 3.34Å; T11-A15 PolarHBondContact O-N 2.8Å
12	L	44.5	Very low	41.1	Very low	119 Å²	119	107.8 Å²	107.8	62%	0.623	55%	0.552	S	S	*	*	H	α-helix	trans	-67.2	-45.5	177.5	-88.1	156.2	0	0	0	112.2	T8 F10 A15 V16	T8-L12 WeakPolarHBondContact O-CB 3.37Å; T8-L12 PolarHBondContact O-N 3.33Å; F10-L12 VanDerWaalsContact C-N 3.35Å; F10-L12 PolarHBondContact O-N 3.24Å; L12-A15 PolarHBondContact O-N 3.41Å; L12-V16 WeakPolarHBondContact O-CG2 3.43Å; L12-V16 PolarHBondContact O-N 3.11Å
13	S	44.1	Very low	40.9	Very low	53 Å²	53	105.3 Å²	105.3	37%	0.371	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-37.9	179.4	44.1	0	0	0	0	112.3	T9 F10 L17	T9-S13 WeakPolarHBondContact O-CB 3.33Å; T9-S13 PolarHBondContact O-N 3.11Å; T9-S13 PolarHBondContact O-OG 3.39Å; F10-S13 WeakPolarHBondContact CA-OG 3.45Å; F10-S13 PolarHBondContact O-N 2.83Å; F10-S13 PolarHBondContact O-OG 2.78Å; S13-L17 WeakPolarHBondContact O-CB 3.09Å; S13-L17 WeakPolarHBondContact O-CD1 3Å; S13-L17 WeakPolarHBondContact O-CG 3.37Å; S13-L17 PolarHBondContact O-N 3.38Å
14	T	45.7	Very low	40.5	Very low	40 Å²	40	109 Å²	109	25%	0.245	56%	0.56	C	S	.	*	H	α-helix	trans	-66.9	-42.4	172.3	49.6	0	0	0	0	112.1	F10 T11 V16 L17 W18	F10-T14 HydrophobicContact CD1-CG2 4Å; F10-T14 HydrophobicContact CE1-CG2 3.68Å; F10-T14 HydrophobicContact CZ-CG2 3.97Å; F10-T14 WeakPolarHBondContact O-CB 3.34Å; F10-T14 WeakPolarHBondContact O-CG2 3.42Å; F10-T14 PolarHBondContact O-N 3.02Å; F10-T14 PolarHBondContact O-OG1 3.44Å; T11-T14 WeakPolarHBondContact CA-OG1 3.32Å; T11-T14 PolarHBondContact O-OG1 3.31Å; T14-V16 VanDerWaalsContact C-N 3.34Å; T14-V16 PolarHBondContact O-N 3.15Å; T14-L17 PolarHBondContact O-N 3.25Å; T14-W18 WeakPolarHBondContact O-CB 3.5Å; T14-W18 PolarHBondContact O-N 3.36Å
15	A	42.2	Very low	40	Very low	36 Å²	36	112.5 Å²	112.5	30%	0.298	57%	0.574	S	S	.	*	H	α-helix	trans	-59.8	-42.6	176.1	0	0	0	0	0	112.4	T11 L12 W18 C19	T11-A15 VanDerWaalsContact O-CB 3.27Å; T11-A15 WeakPolarHBondContact O-CB 3.34Å; T11-A15 PolarHBondContact O-N 2.8Å; L12-A15 PolarHBondContact O-N 3.41Å; A15-W18 PolarHBondContact O-N 2.93Å; A15-C19 WeakPolarHBondContact O-CB 3.4Å; A15-C19 PolarHBondContact O-N 3.02Å; A15-C19 PolarHBondContact O-SG 3Å
16	V	38.4	Very low	39.5	Very low	79 Å²	79	113 Å²	113	48%	0.479	59%	0.586	S	S	.	*	H	α-helix	trans	-64.1	-44.2	175.5	172.3	0	0	0	0	111.1	L12 T14 W18 C19 H20	L12-V16 WeakPolarHBondContact O-CG2 3.43Å; L12-V16 PolarHBondContact O-N 3.11Å; T14-V16 VanDerWaalsContact C-N 3.34Å; T14-V16 PolarHBondContact O-N 3.15Å; V16-W18 PolarHBondContact O-N 3.03Å; V16-C19 PolarHBondContact O-N 3.47Å; V16-H20 PolarHBondContact O-CD2 2.91Å; V16-H20 PolarHBondContact O-N 3.19Å; V16-H20 VanDerWaalsContact O-N 3.12Å
17	L	37.3	Very low	38.5	Very low	115 Å²	115	113.3 Å²	113.3	60%	0.602	60%	0.6	S	S	*	*	H	α-helix	trans	-62.7	-41.2	177	-77.7	164.8	0	0	0	112.2	S13 T14 H20 A21	S13-L17 WeakPolarHBondContact O-CB 3.09Å; S13-L17 WeakPolarHBondContact O-CD1 3Å; S13-L17 WeakPolarHBondContact O-CG 3.37Å; S13-L17 PolarHBondContact O-N 3.38Å; T14-L17 PolarHBondContact O-N 3.25Å; L17-H20 CarbonylContact O-C 3.54Å; L17-H20 PolarHBondContact O-N 3.47Å; L17-H20 VanDerWaalsContact O-N 3.12Å; L17-A21 VanDerWaalsContact O-CB 3.3Å; L17-A21 WeakPolarHBondContact O-CB 3.28Å; L17-A21 PolarHBondContact O-N 3.19Å
18	W	38.5	Very low	37.6	Very low	188 Å²	188	114.7 Å²	114.7	71%	0.712	60%	0.599	S	S	*	*	H	α-helix	trans	-67.7	-36.4	178	-82	59.7	0	0	0	112.2	T14 A15 V16 H20 A21	T14-W18 WeakPolarHBondContact O-CB 3.5Å; T14-W18 PolarHBondContact O-N 3.36Å; A15-W18 PolarHBondContact O-N 2.93Å; V16-W18 PolarHBondContact O-N 3.03Å; W18-H20 PolarHBondContact O-N 2.72Å; W18-A21 PolarHBondContact O-N 2.92Å
19	C	34.9	Very low	37.1	Very low	69 Å²	69	116.5 Å²	116.5	47%	0.466	61%	0.606	S	S	.	*	H	α-helix	trans	-63.5	-29.4	171	-74	0	0	0	0	112.7	A15 V16	A15-C19 WeakPolarHBondContact O-CB 3.4Å; A15-C19 PolarHBondContact O-N 3.02Å; A15-C19 PolarHBondContact O-SG 3Å; V16-C19 PolarHBondContact O-N 3.47Å
20	H	32.8	Very low	36.5	Very low	155 Å²	155	119.1 Å²	119.1	72%	0.718	61%	0.613	S	S	*	*	H	α-helix	trans	-91.2	-20	178.3	-77.1	-61.9	0	0	0	114.6	V16 L17 W18	V16-H20 PolarHBondContact O-CD2 2.91Å; V16-H20 PolarHBondContact O-N 3.19Å; V16-H20 VanDerWaalsContact O-N 3.12Å; L17-H20 CarbonylContact O-C 3.54Å; L17-H20 PolarHBondContact O-N 3.47Å; L17-H20 VanDerWaalsContact O-N 3.12Å; W18-H20 PolarHBondContact O-N 2.72Å
21	A	33.9	Very low	35.7	Very low	76 Å²	76	115.7 Å²	115.7	63%	0.628	60%	0.604	S	S	*	*	H	α-helix	trans	-86.9	-4.3	-177.4	0	0	0	0	0	114	L17 W18	L17-A21 VanDerWaalsContact O-CB 3.3Å; L17-A21 WeakPolarHBondContact O-CB 3.28Å; L17-A21 PolarHBondContact O-N 3.19Å; W18-A21 PolarHBondContact O-N 2.92Å
22	Y	28.3	Very low	35.1	Very low	189 Å²	189	117 Å²	117	74%	0.741	61%	0.608	S	S	*	*			trans	-73.6	127.4	177.7	-113.1	-92.8	0	0	0	111	E24	Y22-E24 PolarHBondContact O-N 3.46Å
23	P	32.5	Very low	34.3	Very low	118 Å²	118	113.5 Å²	113.5	77%	0.766	59%	0.593	S	S	*	*	S	Bend	trans	-85.8	2.8	-152.9	-12	30.7	0	0	0	116.8
24	E	31.5	Very low	33.8	Very low	178 Å²	178	115.9 Å²	115.9	83%	0.832	60%	0.601	S	S	*	*			trans	-131.4	105	-174.6	-70.2	-174	167.2	0	0	112.4	Y22 L26	Y22-E24 PolarHBondContact O-N 3.46Å; E24-L26 VanDerWaalsContact C-N 3.27Å; E24-L26 PolarHBondContact O-N 3.01Å
25	L	31.7	Very low	33.2	Very low	166 Å²	166	119.7 Å²	119.7	87%	0.869	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-1.9	-173.5	-89.8	152.4	0	0	0	115.3
26	L	30.2	Very low	32.9	Very low	161 Å²	161	123.2 Å²	123.2	84%	0.843	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-6.6	-159.3	-81	162.2	0	0	0	117.8	E24	E24-L26 VanDerWaalsContact C-N 3.27Å; E24-L26 PolarHBondContact O-N 3.01Å
27	D	29.9	Very low	32.7	Very low	171 Å²	171	123.6 Å²	123.6	91%	0.914	62%	0.617	S	S	*	*	S	Bend	trans	-127	46.8	174.8	-94.5	-28	0	0	0	113	D29	D27-D29 PolarHBondContact O-N 3.11Å
28	Y	31.7	Very low	32.6	Very low	140 Å²	140	122.6 Å²	122.6	55%	0.549	61%	0.605	S	S	.	*			trans	-85	90.8	-172.8	-162.7	-94.8	0	0	0	112.1	K30	Y28-K30 HydrophobicContact CD1-CB 4.37Å; Y28-K30 HydrophobicContact CD1-CD 3.85Å; Y28-K30 VanDerWaalsContact CD1-CE 3.44Å; Y28-K30 HydrophobicContact CD1-CG 3.46Å; Y28-K30 VanDerWaalsContact CD1-CG 3.46Å; Y28-K30 HydrophobicContact CE1-CB 4Å; Y28-K30 HydrophobicContact CE1-CD 3.47Å; Y28-K30 VanDerWaalsContact CE1-CD 3.47Å; Y28-K30 HydrophobicContact CE1-CG 3.36Å; Y28-K30 PolarHBondContact O-N 3.16Å
29	D	32.9	Very low	32.4	Very low	115 Å²	115	119.3 Å²	119.3	62%	0.615	59%	0.592	S	S	*	*			trans	-83.2	104.1	164	-161.8	1.8	0	0	0	109.9	D27 T31 D32	D27-D29 PolarHBondContact O-N 3.11Å; D29-T31 PolarHBondContact O-N 3.42Å; D29-T31 VanDerWaalsContact O-N 3.15Å; D29-T31 PolarHBondContact OD1-OG1 2.92Å; D29-T31 PolarHBondContact OD2-OG1 2.64Å; D29-T31 VanDerWaalsContact OD2-OG1 3.1Å; D29-D32 WeakPolarHBondContact O-CB 3.43Å; D29-D32 PolarHBondContact O-N 3.44Å
30	K	31.6	Very low	32.5	Very low	107 Å²	107	119.7 Å²	119.7	47%	0.465	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.9	-19.6	-170.5	-46.9	-145.3	163.5	-173.3	0	113.3	Y28 D32 C33	Y28-K30 HydrophobicContact CD1-CB 4.37Å; Y28-K30 HydrophobicContact CD1-CD 3.85Å; Y28-K30 VanDerWaalsContact CD1-CE 3.44Å; Y28-K30 HydrophobicContact CD1-CG 3.46Å; Y28-K30 VanDerWaalsContact CD1-CG 3.46Å; Y28-K30 HydrophobicContact CE1-CB 4Å; Y28-K30 HydrophobicContact CE1-CD 3.47Å; Y28-K30 VanDerWaalsContact CE1-CD 3.47Å; Y28-K30 HydrophobicContact CE1-CG 3.36Å; Y28-K30 PolarHBondContact O-N 3.16Å; K30-D32 PolarHBondContact O-N 2.98Å; K30-C33 PolarHBondContact O-N 3.49Å
31	T	31.8	Very low	32.6	Very low	72 Å²	72	118.7 Å²	118.7	44%	0.442	59%	0.586	S	S	.	*	H	α-helix	trans	-56.1	-33.6	171.4	39.8	0	0	0	0	110.9	D29 C33 I34 Y35	D29-T31 PolarHBondContact O-N 3.42Å; D29-T31 VanDerWaalsContact O-N 3.15Å; D29-T31 PolarHBondContact OD1-OG1 2.92Å; D29-T31 PolarHBondContact OD2-OG1 2.64Å; D29-T31 VanDerWaalsContact OD2-OG1 3.1Å; T31-C33 VanDerWaalsContact C-N 3.32Å; T31-C33 PolarHBondContact O-N 2.74Å; T31-I34 PolarHBondContact O-N 3.43Å; T31-Y35 WeakPolarHBondContact O-CB 3.39Å; T31-Y35 PolarHBondContact O-N 2.89Å
32	D	31.7	Very low	32.5	Very low	110 Å²	110	120.6 Å²	120.6	59%	0.588	58%	0.581	S	S	*	*	H	α-helix	trans	-70.2	-29.9	-176.9	-126.4	8.5	0	0	0	112.2	D29 K30 H36	D29-D32 WeakPolarHBondContact O-CB 3.43Å; D29-D32 PolarHBondContact O-N 3.44Å; K30-D32 PolarHBondContact O-N 2.98Å; D32-H36 WeakPolarHBondContact O-CA 3.27Å; D32-H36 WeakPolarHBondContact O-CB 3.34Å; D32-H36 PolarHBondContact O-N 3.11Å
33	C	29.4	Very low	32.8	Very low	46 Å²	46	116.5 Å²	116.5	31%	0.311	56%	0.564	S	S	.	*	H	α-helix	trans	-75.2	-40	179.6	-146	0	0	0	0	111.8	K30 T31 H36 F37	K30-C33 PolarHBondContact O-N 3.49Å; T31-C33 VanDerWaalsContact C-N 3.32Å; T31-C33 PolarHBondContact O-N 2.74Å; C33-H36 PolarHBondContact O-N 2.8Å; C33-F37 WeakPolarHBondContact O-CB 3.5Å; C33-F37 PolarHBondContact O-N 2.77Å
34	I	32.4	Very low	32.8	Very low	103 Å²	103	113.7 Å²	113.7	53%	0.528	54%	0.542	S	S	.	.	H	α-helix	trans	-70.5	-44.6	173.2	-64.9	178.6	0	0	0	109.8	T31 H36 F37 W38	T31-I34 PolarHBondContact O-N 3.43Å; I34-H36 VanDerWaalsContact C-N 3.28Å; I34-H36 PolarHBondContact O-N 2.78Å; I34-F37 PolarHBondContact O-N 3.25Å; I34-W38 VanDerWaalsContact O-CB 3.25Å; I34-W38 WeakPolarHBondContact O-CB 3.19Å; I34-W38 PolarHBondContact O-N 3.1Å
35	Y	33.3	Very low	32.8	Very low	119 Å²	119	107.1 Å²	107.1	47%	0.467	51%	0.513	S	S	.	.	H	α-helix	trans	-58.7	-42.1	174.3	-175.9	-104.5	0	0	0	111	T31 R39	T31-Y35 WeakPolarHBondContact O-CB 3.39Å; T31-Y35 PolarHBondContact O-N 2.89Å; Y35-R39 VanDerWaalsContact CE1-CD 3.49Å; Y35-R39 WeakPolarHBondContact O-CA 3.36Å; Y35-R39 WeakPolarHBondContact O-CB 3.4Å; Y35-R39 PolarHBondContact O-N 3.46Å; Y35-R39 PolarHBondContact OH-NH1 3.46Å
36	H	36.4	Very low	32.8	Very low	110 Å²	110	105.6 Å²	105.6	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-62.2	-50.7	174.7	-174.7	-57.3	0	0	0	111.4	D32 C33 I34 N40	D32-H36 WeakPolarHBondContact O-CA 3.27Å; D32-H36 WeakPolarHBondContact O-CB 3.34Å; D32-H36 PolarHBondContact O-N 3.11Å; C33-H36 PolarHBondContact O-N 2.8Å; I34-H36 VanDerWaalsContact C-N 3.28Å; I34-H36 PolarHBondContact O-N 2.78Å; H36-N40 PolarHBondContact CD2-ND2 3.27Å; H36-N40 PolarHBondContact CE1-ND2 3.26Å; H36-N40 VanDerWaalsContact CG-ND2 3.29Å; H36-N40 PolarHBondContact ND1-ND2 3.37Å; H36-N40 VanDerWaalsContact ND1-ND2 3.11Å; H36-N40 PolarHBondContact NE2-ND2 2.84Å; H36-N40 WeakPolarHBondContact O-CA 3.17Å; H36-N40 WeakPolarHBondContact O-CB 3.3Å; H36-N40 PolarHBondContact O-N 2.01Å; H36-N40 PolarHBondContact O-ND2 3.32Å
37	F	33.7	Very low	33	Very low	87 Å²	87	98.7 Å²	98.7	38%	0.382	46%	0.462	S	S	.	.	H	α-helix	trans	-62	-46.8	177.5	-102	-86.9	0	0	0	111.4	C33 I34 R39 E41 H42	C33-F37 WeakPolarHBondContact O-CB 3.5Å; C33-F37 PolarHBondContact O-N 2.77Å; I34-F37 PolarHBondContact O-N 3.25Å; F37-R39 PolarHBondContact O-N 2.8Å; F37-E41 HydrophobicContact CD1-CB 4.15Å; F37-E41 HydrophobicContact CD1-CG 3.63Å; F37-E41 HydrophobicContact CE1-CG 3.85Å; F37-E41 HydrophobicContact CG-CG 4.5Å; F37-E41 WeakPolarHBondContact O-CA 3.37Å; F37-E41 WeakPolarHBondContact O-CB 3.45Å; F37-E41 PolarHBondContact O-N 3.08Å; F37-H42 PolarHBondContact O-N 3.07Å
38	W	35.5	Very low	33.2	Very low	95 Å²	95	94.5 Å²	94.5	36%	0.36	44%	0.437	S	S	.	.	I	π-helix	trans	-68.2	-40.2	-177	-132.7	77.7	0	0	0	112.3	I34 H42 R43 L44	I34-W38 VanDerWaalsContact O-CB 3.25Å; I34-W38 WeakPolarHBondContact O-CB 3.19Å; I34-W38 PolarHBondContact O-N 3.1Å; W38-H42 CarbonylContact O-C 3.58Å; W38-H42 PolarHBondContact O-N 2.03Å; W38-R43 PolarHBondContact O-N 3.27Å; W38-L44 HydrophobicContact CE3-CB 4.37Å; W38-L44 HydrophobicContact CH2-CB 3.74Å; W38-L44 HydrophobicContact CZ2-CB 4.35Å; W38-L44 HydrophobicContact CZ3-CB 3.78Å; W38-L44 WeakPolarHBondContact CZ3-O 3.49Å
39	R	34	Very low	33.2	Very low	119 Å²	119	89.1 Å²	89.1	45%	0.449	42%	0.422	S	S	.	.	I	π-helix	trans	-73	-40.3	176.4	-177.5	173.5	167.7	170.7	-7.9	113	Y35 F37	Y35-R39 VanDerWaalsContact CE1-CD 3.49Å; Y35-R39 WeakPolarHBondContact O-CA 3.36Å; Y35-R39 WeakPolarHBondContact O-CB 3.4Å; Y35-R39 PolarHBondContact O-N 3.46Å; Y35-R39 PolarHBondContact OH-NH1 3.46Å; F37-R39 PolarHBondContact O-N 2.8Å
40	N	37.2	Very low	33.1	Very low	76 Å²	76	85.3 Å²	85.3	41%	0.406	40%	0.401	S	S	.	.	I	π-helix	trans	-97.1	-37.6	-171	-60.9	-35.2	0	0	0	113.3	H36	H36-N40 PolarHBondContact CD2-ND2 3.27Å; H36-N40 PolarHBondContact CE1-ND2 3.26Å; H36-N40 VanDerWaalsContact CG-ND2 3.29Å; H36-N40 PolarHBondContact ND1-ND2 3.37Å; H36-N40 VanDerWaalsContact ND1-ND2 3.11Å; H36-N40 PolarHBondContact NE2-ND2 2.84Å; H36-N40 WeakPolarHBondContact O-CA 3.17Å; H36-N40 WeakPolarHBondContact O-CB 3.3Å; H36-N40 PolarHBondContact O-N 2.01Å; H36-N40 PolarHBondContact O-ND2 3.32Å
41	E	34.2	Very low	33.2	Very low	135 Å²	135	82.9 Å²	82.9	63%	0.631	39%	0.392	S	S	*	.	I	π-helix	trans	-89	-52.4	177.6	-69.8	-96.1	158.8	0	0	111.9	F37	F37-E41 HydrophobicContact CD1-CB 4.15Å; F37-E41 HydrophobicContact CD1-CG 3.63Å; F37-E41 HydrophobicContact CE1-CG 3.85Å; F37-E41 HydrophobicContact CG-CG 4.5Å; F37-E41 WeakPolarHBondContact O-CA 3.37Å; F37-E41 WeakPolarHBondContact O-CB 3.45Å; F37-E41 PolarHBondContact O-N 3.08Å
42	H	32.5	Very low	33.3	Very low	116 Å²	116	81.1 Å²	81.1	54%	0.537	38%	0.382	S	S	.	.	I	π-helix	trans	-89.1	-22.7	-174.3	-66.9	-56.8	0	0	0	114.5	F37 W38 L44	F37-H42 PolarHBondContact O-N 3.07Å; W38-H42 CarbonylContact O-C 3.58Å; W38-H42 PolarHBondContact O-N 2.03Å; H42-L44 WeakPolarHBondContact O-CG 3.42Å; H42-L44 PolarHBondContact O-N 2.93Å
43	R	34.2	Very low	33.4	Very low	102 Å²	102	76.6 Å²	76.6	39%	0.385	36%	0.36	S	S	.	.			trans	51.8	28.8	173.4	-56.8	177.5	176	179	-4.2	114.6	W38	W38-R43 PolarHBondContact O-N 3.27Å
44	L	32.6	Very low	33.8	Very low	59 Å²	59	77.1 Å²	77.1	31%	0.309	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-103.9	151	177.7	-72.8	161.8	0	0	0	109.3	W38 H42 Y248	W38-L44 HydrophobicContact CE3-CB 4.37Å; W38-L44 HydrophobicContact CH2-CB 3.74Å; W38-L44 HydrophobicContact CZ2-CB 4.35Å; W38-L44 HydrophobicContact CZ3-CB 3.78Å; W38-L44 WeakPolarHBondContact CZ3-O 3.49Å; H42-L44 WeakPolarHBondContact O-CG 3.42Å; H42-L44 PolarHBondContact O-N 2.93Å; L44-Y248 HydrophobicContact CD2-CD1 3.85Å; L44-Y248 HydrophobicContact CD2-CE1 3.25Å; L44-Y248 HydrophobicContact CG-CE1 4.24Å
45	D	32.9	Very low	33.7	Very low	41 Å²	41	77 Å²	77	22%	0.219	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-103.4	160.8	166.1	-62	-74.5	0	0	0	111.1	S247 T249	D45-S247 WeakPolarHBondContact CB-O 3.31Å; D45-S247 PolarHBondContact N-O 3.12Å; D45-T249 HydrophobicContact CB-CG2 4.21Å; D45-T249 PolarHBondContact OD1-OG1 2.77Å; D45-T249 WeakPolarHBondContact OD2-CA 3.23Å; D45-T249 WeakPolarHBondContact OD2-CB 3.48Å; D45-T249 WeakPolarHBondContact OD2-CG2 3.48Å; D45-T249 PolarHBondContact OD2-N 3.44Å; D45-T249 PolarHBondContact OD2-OG1 2.88Å
46	Y	31	Very low	33.7	Very low	133 Å²	133	77.2 Å²	77.2	52%	0.522	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-52.4	149.7	177.8	-76.5	-89.8	0	0	0	111.3	M48	Y46-M48 VanDerWaalsContact O-CG 3.28Å; Y46-M48 WeakPolarHBondContact O-CG 2.95Å; Y46-M48 PolarHBondContact O-N 2.81Å
47	P	34.7	Very low	33.8	Very low	16 Å²	16	73.6 Å²	73.6	10%	0.104	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.1	136	170.6	20.6	-31.7	0	0	0	109.3	T79 N138 C246	P47-T79 HydrophobicContact CB-CG2 4.09Å; P47-T79 HydrophobicContact CG-CG2 3.7Å; P47-N138 PolarHBondContact O-ND2 2.8Å; P47-N138 PolarHBondContact O-OD1 3.32Å; P47-C246 VanDerWaalsContact CA-SG 3.58Å
48	M	33.3	Very low	33.8	Very low	83 Å²	83	75.9 Å²	75.9	41%	0.409	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	-17.9	-174.6	-61.5	-159.8	-44.2	0	0	113.7	Y46 L67 N138 F245 S247	Y46-M48 VanDerWaalsContact O-CG 3.28Å; Y46-M48 WeakPolarHBondContact O-CG 2.95Å; Y46-M48 PolarHBondContact O-N 2.81Å; M48-L67 HydrophobicContact CE-CD2 3.83Å; M48-N138 WeakPolarHBondContact CA-OD1 3.34Å; M48-F245 PolarHBondContact N-O 3.49Å; M48-S247 WeakPolarHBondContact CE-OG 3.44Å; M48-S247 PolarHBondContact SD-OG 2.79Å
49	A	31.8	Very low	33.8	Very low	27 Å²	27	75.3 Å²	75.3	22%	0.223	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	144	-176.1	0	0	0	0	0	111.9	S244 F245	A49-S244 CarbonylContact O-C 3.51Å; A49-S244 WeakPolarHBondContact O-CA 3.41Å; A49-F245 HydrophobicContact CB-CB 4.42Å; A49-F245 PolarHBondContact N-O 3.39Å; A49-F245 PolarHBondContact O-N 3.49Å
50	I	30.5	Very low	33.9	Very low	35 Å²	35	74.7 Å²	74.7	18%	0.179	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.9	167.6	-63.3	174.7	0	0	0	106.9	V136 Y242 L243	I50-V136 HydrophobicContact CD1-CG1 3.77Å; I50-Y242 HydrophobicContact CG2-CD1 4.02Å; I50-Y242 HydrophobicContact CG2-CG 4.29Å; I50-L243 CarbonylContact C-O 3.58Å; I50-L243 WeakPolarHBondContact CA-O 3.31Å
51	M	35.1	Very low	34	Very low	57 Å²	57	71.6 Å²	71.6	28%	0.281	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	147.3	179.7	-65.9	179.8	68.1	0	0	110.8	A53 Y242 L243 F245	M51-A53 PolarHBondContact O-N 3.23Å; M51-Y242 WeakPolarHBondContact O-CA 3.35Å; M51-L243 PolarHBondContact N-O 2.74Å; M51-L243 PolarHBondContact O-N 2.85Å; M51-F245 HydrophobicContact CB-CD2 4.22Å; M51-F245 HydrophobicContact CB-CE2 4Å; M51-F245 HydrophobicContact CG-CD2 4.14Å; M51-F245 HydrophobicContact CG-CE2 4.27Å; M51-F245 HydrophobicContact SD-CD2 4.1Å; M51-F245 HydrophobicContact SD-CE2 4.05Å
52	P	32.4	Very low	34.1	Very low	35 Å²	35	69.9 Å²	69.9	23%	0.227	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	118.3	168.4	25.4	-29.9	0	0	0	109.6	I54 T240 H241	P52-I54 PolarHBondContact O-N 3.1Å; P52-I54 VanDerWaalsContact O-N 3.08Å; P52-T240 HydrophobicContact CB-CG2 3.6Å; P52-H241 CarbonylContact C-O 3.6Å
53	A	34.9	Very low	34.2	Very low	15 Å²	15	70.6 Å²	70.6	12%	0.124	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	100.2	172	0	0	0	0	0	108.9	M51 H241 L243	M51-A53 PolarHBondContact O-N 3.23Å; A53-H241 WeakPolarHBondContact CA-O 3.01Å; A53-H241 HydrophobicContact CB-CB 3.83Å; A53-H241 WeakPolarHBondContact CB-O 3.36Å; A53-H241 PolarHBondContact N-O 2.81Å; A53-L243 HydrophobicContact CB-CD1 3.58Å; A53-L243 HydrophobicContact CB-CD2 4.24Å; A53-L243 HydrophobicContact CB-CG 3.5Å; A53-L243 VanDerWaalsContact CB-CG 3.5Å
54	I	36.6	Very low	34.3	Very low	56 Å²	56	68.9 Å²	68.9	29%	0.287	35%	0.349	S	S	.	.			trans	-81.8	128.3	151.9	-49.7	173.8	0	0	0	104.5	P52 K56 L57 Y231	P52-I54 PolarHBondContact O-N 3.1Å; P52-I54 VanDerWaalsContact O-N 3.08Å; I54-K56 HydrophobicContact CG2-CB 4.47Å; I54-K56 PolarHBondContact O-N 2.77Å; I54-L57 WeakPolarHBondContact O-CB 3.27Å; I54-L57 PolarHBondContact O-N 2.84Å; I54-Y231 HydrophobicContact CD1-CD1 3.91Å; I54-Y231 HydrophobicContact CD1-CE1 3.32Å; I54-Y231 HydrophobicContact CG1-CE1 4.24Å
55	P	30.2	Very low	34.4	Very low	102 Å²	102	68.3 Å²	68.3	66%	0.662	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-27.9	-178.4	-29	33.6	0	0	0	114.1	L57 M58	P55-L57 VanDerWaalsContact C-N 3.28Å; P55-L57 PolarHBondContact O-N 3.45Å; P55-M58 WeakPolarHBondContact O-CB 3.16Å; P55-M58 PolarHBondContact O-N 3.4Å; P55-M58 VanDerWaalsContact O-N 3.15Å
56	K	34.4	Very low	34.4	Very low	123 Å²	123	68 Å²	68	54%	0.535	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20	174.4	-91.1	178.6	175.3	169.1	0	115.3	I54 M58 P59 Y60 E234	I54-K56 HydrophobicContact CG2-CB 4.47Å; I54-K56 PolarHBondContact O-N 2.77Å; K56-M58 PolarHBondContact O-N 3.27Å; K56-P59 WeakPolarHBondContact O-CD 2.93Å; K56-Y60 WeakPolarHBondContact O-CD2 2.95Å; K56-Y60 WeakPolarHBondContact O-CE2 3.47Å; K56-E234 IonicContact NZ-OE1 3.93Å; K56-E234 PolarHBondContact NZ-OE1 2.89Å; K56-E234 IonicContact NZ-OE2 3.26Å
57	L	37.2	Very low	34.7	Very low	33 Å²	33	63.4 Å²	63.4	17%	0.173	34%	0.337	C	S	.	.	H	α-helix	trans	-71.7	-14.7	173.6	-70.6	165.2	0	0	0	112.2	I54 P55 Y60 G61 F64	I54-L57 WeakPolarHBondContact O-CB 3.27Å; I54-L57 PolarHBondContact O-N 2.84Å; P55-L57 VanDerWaalsContact C-N 3.28Å; P55-L57 PolarHBondContact O-N 3.45Å; L57-Y60 CarbonylContact O-C 3.44Å; L57-Y60 WeakPolarHBondContact O-CA 2.98Å; L57-Y60 PolarHBondContact O-N 3.29Å; L57-G61 PolarHBondContact O-N 3.44Å; L57-F64 HydrophobicContact CB-CE2 4.43Å; L57-F64 HydrophobicContact CD2-CE1 4.22Å; L57-F64 HydrophobicContact CD2-CE2 3.44Å; L57-F64 VanDerWaalsContact CD2-CE2 3.44Å; L57-F64 HydrophobicContact CD2-CZ 3.16Å
58	M	33.6	Very low	34.8	Very low	135 Å²	135	66.1 Å²	66.1	67%	0.665	35%	0.347	S	S	*	.	H	α-helix	trans	-63.6	-41.2	-175.2	-83.2	-170.3	150.4	0	0	115.1	P55 K56 Y60	P55-M58 WeakPolarHBondContact O-CB 3.16Å; P55-M58 PolarHBondContact O-N 3.4Å; P55-M58 VanDerWaalsContact O-N 3.15Å; K56-M58 PolarHBondContact O-N 3.27Å; M58-Y60 VanDerWaalsContact C-N 3.27Å
59	P	36.7	Very low	35.1	Very low	83 Å²	83	65.4 Å²	65.4	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-70.9	-25.1	168.8	25.3	-32.8	0	0	0	112.2	K56 Y63	K56-P59 WeakPolarHBondContact O-CD 2.93Å; P59-Y63 WeakPolarHBondContact O-CD2 3.18Å; P59-Y63 WeakPolarHBondContact O-CE2 3.35Å
60	Y	35.3	Very low	35.5	Very low	107 Å²	107	65.1 Å²	65.1	42%	0.42	34%	0.34	S	S	.	.	H	α-helix	trans	-88.7	-6.2	-177.4	-52.4	-64.2	0	0	0	114.5	K56 L57 M58 D62 Y63 F64	K56-Y60 WeakPolarHBondContact O-CD2 2.95Å; K56-Y60 WeakPolarHBondContact O-CE2 3.47Å; L57-Y60 CarbonylContact O-C 3.44Å; L57-Y60 WeakPolarHBondContact O-CA 2.98Å; L57-Y60 PolarHBondContact O-N 3.29Å; M58-Y60 VanDerWaalsContact C-N 3.27Å; Y60-D62 PolarHBondContact O-N 3.34Å; Y60-D62 VanDerWaalsContact O-N 3.17Å; Y60-Y63 VanDerWaalsContact CA-CD2 3.45Å; Y60-Y63 HydrophobicContact CD1-CD2 4.32Å; Y60-Y63 HydrophobicContact CD1-CE2 4.45Å; Y60-Y63 WeakPolarHBondContact O-CA 3.44Å; Y60-Y63 VanDerWaalsContact O-CB 3.27Å; Y60-Y63 WeakPolarHBondContact O-CB 3.18Å; Y60-Y63 PolarHBondContact O-N 3.14Å; Y60-F64 WeakPolarHBondContact O-CD2 2.89Å; Y60-F64 VanDerWaalsContact O-CE2 3.22Å; Y60-F64 WeakPolarHBondContact O-CE2 3.44Å; Y60-F64 PolarHBondContact O-N 3.39Å
61	G	39.4	Very low	35.6	Very low	10 Å²	10	70.1 Å²	70.1	10%	0.103	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-50.2	-42.8	-176.5	0	0	0	0	0	113.3	L57 Y63 F64	L57-G61 PolarHBondContact O-N 3.44Å; G61-Y63 VanDerWaalsContact C-N 3.26Å; G61-Y63 PolarHBondContact O-N 2.99Å; G61-F64 PolarHBondContact O-N 3.47Å
62	D	36	Very low	35.3	Very low	100 Å²	100	69.9 Å²	69.9	54%	0.535	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-75.3	-12.6	179.2	-68.3	-41.4	0	0	0	113.6	Y60	Y60-D62 PolarHBondContact O-N 3.34Å; Y60-D62 VanDerWaalsContact O-N 3.17Å
63	Y	35.2	Very low	35.1	Very low	130 Å²	130	71.1 Å²	71.1	51%	0.51	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-92.6	-11.8	178.8	-58.2	-101.6	0	0	0	112.8	P59 Y60 G61 A65 Y273	P59-Y63 WeakPolarHBondContact O-CD2 3.18Å; P59-Y63 WeakPolarHBondContact O-CE2 3.35Å; Y60-Y63 VanDerWaalsContact CA-CD2 3.45Å; Y60-Y63 HydrophobicContact CD1-CD2 4.32Å; Y60-Y63 HydrophobicContact CD1-CE2 4.45Å; Y60-Y63 WeakPolarHBondContact O-CA 3.44Å; Y60-Y63 VanDerWaalsContact O-CB 3.27Å; Y60-Y63 WeakPolarHBondContact O-CB 3.18Å; Y60-Y63 PolarHBondContact O-N 3.14Å; G61-Y63 VanDerWaalsContact C-N 3.26Å; G61-Y63 PolarHBondContact O-N 2.99Å; Y63-A65 PolarHBondContact O-N 3.37Å; Y63-Y273 AromaticContact CD1-CE2 3.79Å; Y63-Y273 HydrophobicContact CD1-CE2 3.79Å; Y63-Y273 AromaticContact CD1-CZ 3.92Å; Y63-Y273 WeakPolarHBondContact CD1-OH 3.42Å; Y63-Y273 HydrophobicContact CE1-CE2 4.2Å
64	F	36.8	Very low	34.7	Very low	67 Å²	67	71.5 Å²	71.5	29%	0.294	39%	0.385	S	S	.	.	S	Bend	trans	-75.8	40.5	176.3	-68	-69.4	0	0	0	112.5	L57 Y60 G61 L67 F245	L57-F64 HydrophobicContact CB-CE2 4.43Å; L57-F64 HydrophobicContact CD2-CE1 4.22Å; L57-F64 HydrophobicContact CD2-CE2 3.44Å; L57-F64 VanDerWaalsContact CD2-CE2 3.44Å; L57-F64 HydrophobicContact CD2-CZ 3.16Å; Y60-F64 WeakPolarHBondContact O-CD2 2.89Å; Y60-F64 VanDerWaalsContact O-CE2 3.22Å; Y60-F64 WeakPolarHBondContact O-CE2 3.44Å; Y60-F64 PolarHBondContact O-N 3.39Å; G61-F64 PolarHBondContact O-N 3.47Å; F64-L67 CarbonylContact C-O 3.58Å; F64-L67 HydrophobicContact CB-CB 4.47Å; F64-L67 VanDerWaalsContact O-CA 3.28Å; F64-L67 WeakPolarHBondContact O-CA 3.37Å; F64-L67 WeakPolarHBondContact O-CB 3.5Å; F64-L67 PolarHBondContact O-N 2.68Å; F64-F245 HydrophobicContact CD2-CE1 4.37Å
65	A	34	Very low	34.3	Very low	46 Å²	46	75.4 Å²	75.4	38%	0.38	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	140.1	-179.6	0	0	0	0	0	111.6	Y63 L67	Y63-A65 PolarHBondContact O-N 3.37Å; A65-L67 VanDerWaalsContact C-N 3.32Å
66	P	34.1	Very low	34.1	Very low	34 Å²	34	75.1 Å²	75.1	22%	0.221	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	cis	-87.4	16.9	2.8	36.2	-37.5	0	0	0	114.1	L210 S247 Y248	P66-L210 HydrophobicContact CG-CD2 3.96Å; P66-S247 VanDerWaalsContact O-CA 3.29Å; P66-S247 WeakPolarHBondContact O-CA 3.47Å; P66-Y248 PolarHBondContact O-N 2.96Å; P66-Y248 VanDerWaalsContact O-N 3.09Å
67	L	36.7	Very low	33.7	Very low	38 Å²	38	71.6 Å²	71.6	20%	0.199	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.3	-177.6	-56	171.1	0	0	0	112.8	M48 F64 A65 F245 C246	M48-L67 HydrophobicContact CE-CD2 3.83Å; F64-L67 CarbonylContact C-O 3.58Å; F64-L67 HydrophobicContact CB-CB 4.47Å; F64-L67 VanDerWaalsContact O-CA 3.28Å; F64-L67 WeakPolarHBondContact O-CA 3.37Å; F64-L67 WeakPolarHBondContact O-CB 3.5Å; F64-L67 PolarHBondContact O-N 2.68Å; A65-L67 VanDerWaalsContact C-N 3.32Å; L67-F245 HydrophobicContact CB-CB 4.04Å; L67-F245 HydrophobicContact CB-CD1 4.13Å; L67-F245 HydrophobicContact CB-CG 4.47Å; L67-F245 HydrophobicContact CD1-CB 4.3Å; L67-F245 HydrophobicContact CD2-CB 4.49Å; L67-C246 CarbonylContact C-O 3.6Å; L67-C246 VanDerWaalsContact CA-O 3.25Å; L67-C246 WeakPolarHBondContact CA-O 3.4Å
68	K	37.1	Very low	33.4	Very low	72 Å²	72	73.6 Å²	73.6	31%	0.313	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.7	167.2	-99.4	-163.7	176.8	-173.8	0	111.9	C70 F245 C246 Y248	K68-C70 PolarHBondContact O-N 3.02Å; K68-F245 CarbonylContact O-C 3.59Å; K68-F245 VanDerWaalsContact O-CA 3.3Å; K68-F245 WeakPolarHBondContact O-CA 3.43Å; K68-C246 PolarHBondContact N-O 2.87Å; K68-C246 PolarHBondContact O-N 2.83Å; K68-Y248 HydrophobicContact CB-CE2 4.36Å; K68-Y248 HydrophobicContact CD-CE2 4Å; K68-Y248 HydrophobicContact CG-CE2 4.14Å
69	L	39.3	Very low	33.4	Very low	69 Å²	69	68.3 Å²	68.3	36%	0.361	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	122	171.7	-173.5	73.1	0	0	0	110.4	T71 L243 S244 F245	L69-T71 PolarHBondContact O-N 3.24Å; L69-L243 HydrophobicContact CD1-CB 3.56Å; L69-L243 HydrophobicContact CD1-CD1 4.08Å; L69-L243 HydrophobicContact CD1-CD2 3.7Å; L69-L243 HydrophobicContact CD1-CG 3.92Å; L69-S244 WeakPolarHBondContact CA-O 3.39Å; L69-F245 HydrophobicContact CD1-CZ 4.45Å
70	C	40.3	Very low	32.9	Very low	20 Å²	20	68.5 Å²	68.5	14%	0.135	38%	0.378	C	S	.	.			trans	-76.5	107.6	178.3	-41.9	0	0	0	0	108.4	K68 A72 S244 C246	K68-C70 PolarHBondContact O-N 3.02Å; C70-A72 PolarHBondContact O-N 3.05Å; C70-A72 VanDerWaalsContact O-N 3.13Å; C70-S244 PolarHBondContact N-O 3.36Å; C70-S244 PolarHBondContact SG-O 2.81Å; C70-C246 WeakPolarHBondContact CB-SG 3.48Å; C70-C246 WeakPolarHBondContact SG-CB 3.38Å; C70-C246 PolarHBondContact SG-N 2.86Å; C70-C246 CovalentContact SG-SG 2.05Å; C70-C246 PolarHBondContact SG-SG 3.18Å
71	T	31.7	Very low	32.6	Very low	140 Å²	140	66.2 Å²	66.2	86%	0.859	39%	0.387	S	S	*	.	S	Bend	trans	-70.8	-5.1	-171.6	46.4	0	0	0	0	115.3	L69	L69-T71 PolarHBondContact O-N 3.24Å
72	A	28.4	Very low	32.2	Very low	52 Å²	52	70.2 Å²	70.2	43%	0.43	40%	0.401	S	S	.	.			trans	-127.6	91.8	-173.9	0	0	0	0	0	112.1	C70 I80	C70-A72 PolarHBondContact O-N 3.05Å; C70-A72 VanDerWaalsContact O-N 3.13Å; A72-I80 HydrophobicContact CB-CD1 3.84Å; A72-I80 HydrophobicContact CB-CG1 4.45Å
73	I	29.4	Very low	31.8	Very low	61 Å²	61	66.8 Å²	66.8	31%	0.313	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-113.2	138.2	171	-52.6	178.8	0	0	0	106.9	G77 R78 S244	I73-G77 WeakPolarHBondContact CG2-O 3.28Å; I73-R78 CarbonylContact C-O 3.59Å; I73-R78 WeakPolarHBondContact CA-O 3.43Å; I73-S244 WeakPolarHBondContact CD1-OG 3.08Å
74	T	26.9	Very low	31.5	Very low	24 Å²	24	67 Å²	67	15%	0.147	38%	0.383	C	S	.	.			trans	-65.1	162.6	171.3	70.9	0	0	0	0	110.8	E76 G77 R78 I80 L83	T74-E76 WeakPolarHBondContact CB-OE2 3.47Å; T74-E76 PolarHBondContact O-N 3.34Å; T74-E76 PolarHBondContact OG1-OE2 3.1Å; T74-G77 PolarHBondContact O-N 2.92Å; T74-R78 PolarHBondContact N-O 2.64Å; T74-R78 WeakPolarHBondContact OG1-CB 3.38Å; T74-R78 PolarHBondContact OG1-N 2.75Å; T74-I80 HydrophobicContact CG2-CG1 3.98Å; T74-L83 HydrophobicContact CG2-CD1 3.57Å
75	P	26.7	Very low	31.1	Very low	137 Å²	137	64.9 Å²	64.9	89%	0.89	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-27	176.7	-27.3	36.1	0	0	0	114	G77	P75-G77 VanDerWaalsContact C-N 3.33Å
76	E	27.2	Very low	30.9	Very low	97 Å²	97	69 Å²	69	45%	0.453	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	13.4	175.2	-44.5	86.4	-180	0	0	114.4	T74	T74-E76 WeakPolarHBondContact CB-OE2 3.47Å; T74-E76 PolarHBondContact O-N 3.34Å; T74-E76 PolarHBondContact OG1-OE2 3.1Å
77	G	26.8	Very low	30.8	Very low	48 Å²	48	70.9 Å²	70.9	50%	0.495	42%	0.421	S	S	.	.	S	Bend	trans	84.1	8.4	175.6	0	0	0	0	0	115.1	I73 T74 P75	I73-G77 WeakPolarHBondContact CG2-O 3.28Å; T74-G77 PolarHBondContact O-N 2.92Å; P75-G77 VanDerWaalsContact C-N 3.33Å
78	R	29	Very low	30.4	Very low	75 Å²	75	74.6 Å²	74.6	28%	0.283	44%	0.439	S	S	.	.			trans	-91.8	134.3	-175.7	-56.9	-178.1	179.5	-173.4	-0.5	111.5	I73 T74 I80	I73-R78 CarbonylContact C-O 3.59Å; I73-R78 WeakPolarHBondContact CA-O 3.43Å; T74-R78 PolarHBondContact N-O 2.64Å; T74-R78 WeakPolarHBondContact OG1-CB 3.38Å; T74-R78 PolarHBondContact OG1-N 2.75Å; R78-I80 PolarHBondContact O-N 3.4Å
79	T	33.7	Very low	30.2	Very low	25 Å²	25	79.4 Å²	79.4	15%	0.153	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-71.6	124.1	174.6	46.2	0	0	0	0	109.6	P47 G81 F82	P47-T79 HydrophobicContact CB-CG2 4.09Å; P47-T79 HydrophobicContact CG-CG2 3.7Å; T79-G81 PolarHBondContact O-N 3.1Å; T79-F82 PolarHBondContact O-N 3.15Å; T79-F82 WeakPolarHBondContact OG1-CD2 3.45Å; T79-F82 WeakPolarHBondContact OG1-CE2 3.23Å
80	I	27	Very low	29.7	Very low	87 Å²	87	82 Å²	82	45%	0.446	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-54.9	-28	-166.4	-65.1	-177.5	0	0	0	113.8	A72 T74 R78 F82 L83	A72-I80 HydrophobicContact CB-CD1 3.84Å; A72-I80 HydrophobicContact CB-CG1 4.45Å; T74-I80 HydrophobicContact CG2-CG1 3.98Å; R78-I80 PolarHBondContact O-N 3.4Å; I80-F82 PolarHBondContact O-N 3.4Å; I80-L83 PolarHBondContact O-N 3.43Å
81	G	29.7	Very low	29	Very low	58 Å²	58	82.4 Å²	82.4	60%	0.598	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-56	-23.8	175.7	0	0	0	0	0	114.6	T79	T79-G81 PolarHBondContact O-N 3.1Å
82	F	30.7	Very low	28.9	Very low	94 Å²	94	81.2 Å²	81.2	41%	0.412	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-85.2	-12.5	-177.5	-77.2	-93.9	0	0	0	115	T79 I80	T79-F82 PolarHBondContact O-N 3.15Å; T79-F82 WeakPolarHBondContact OG1-CD2 3.45Å; T79-F82 WeakPolarHBondContact OG1-CE2 3.23Å; I80-F82 PolarHBondContact O-N 3.4Å
83	L	27.6	Very low	29.2	Very low	28 Å²	28	84.3 Å²	84.3	15%	0.147	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-95.4	-0	-178.5	-64.7	174.5	0	0	0	113	T74 I80 P85 I101	T74-L83 HydrophobicContact CG2-CD1 3.57Å; I80-L83 PolarHBondContact O-N 3.43Å; L83-P85 VanDerWaalsContact O-CD 3.31Å; L83-P85 WeakPolarHBondContact O-CD 3.09Å; L83-I101 HydrophobicContact CB-CG1 4.34Å; L83-I101 HydrophobicContact CB-CG2 4.39Å; L83-I101 HydrophobicContact CD1-CG2 4.11Å
84	W	28.5	Very low	29.3	Very low	134 Å²	134	83.7 Å²	83.7	51%	0.508	50%	0.495	S	S	.	.	S	Bend	trans	-80.9	115	179.5	-148.7	-85.8	0	0	0	109.9	V86	W84-V86 PolarHBondContact O-N 3.13Å
85	P	27.7	Very low	29.7	Very low	24 Å²	24	89 Å²	89	16%	0.156	52%	0.522	C	S	.	.			trans	-63.6	111.1	-174.1	21.9	-30.1	0	0	0	110.9	L83 G87	L83-P85 VanDerWaalsContact O-CD 3.31Å; L83-P85 WeakPolarHBondContact O-CD 3.09Å; P85-G87 PolarHBondContact O-N 2.85Å
86	V	30.7	Very low	30.1	Very low	133 Å²	133	89.6 Å²	89.6	81%	0.806	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	126.2	175	-152.9	0	0	0	0	108.2	W84	W84-V86 PolarHBondContact O-N 3.13Å
87	G	32.7	Very low	30.7	Very low	72 Å²	72	85.7 Å²	85.7	74%	0.742	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	-2.9	173.2	0	0	0	0	0	117.6	P85	P85-G87 PolarHBondContact O-N 2.85Å
88	M	27.8	Very low	31	Very low	117 Å²	117	87.8 Å²	87.8	58%	0.576	50%	0.495	S	S	*	.			trans	-94.2	104.6	175	-73.9	-164	157.1	0	0	111.9	T90 L91	M88-T90 VanDerWaalsContact C-N 3.29Å; M88-T90 PolarHBondContact O-N 2.73Å; M88-L91 HydrophobicContact CB-CD1 4.3Å
89	K	32.8	Very low	31.3	Very low	173 Å²	173	90.7 Å²	90.7	75%	0.752	51%	0.512	S	S	*	.	S	Bend	trans	-59.8	-14.3	-160.5	-70.2	-179.1	177.5	-179.5	0	117.9
90	T	28.4	Very low	31.6	Very low	124 Å²	124	92 Å²	92	76%	0.761	52%	0.516	S	S	*	.	S	Bend	trans	-150.1	68	-166.9	53.6	0	0	0	0	113	M88	M88-T90 VanDerWaalsContact C-N 3.29Å; M88-T90 PolarHBondContact O-N 2.73Å
91	L	26.3	Very low	32	Very low	28 Å²	28	89.8 Å²	89.8	15%	0.147	51%	0.505	C	S	.	.			trans	-139.6	12.7	-176.1	-87.3	175.3	0	0	0	116.6	M88 S93 S94 K96 A97	M88-L91 HydrophobicContact CB-CD1 4.3Å; L91-S93 PolarHBondContact O-N 3.43Å; L91-S94 WeakPolarHBondContact CD2-OG 3.05Å; L91-K96 HydrophobicContact CD2-CB 3.62Å; L91-A97 HydrophobicContact CB-CB 3.87Å; L91-A97 HydrophobicContact CD1-CB 4.42Å; L91-A97 HydrophobicContact CD2-CB 3.83Å; L91-A97 HydrophobicContact CG-CB 4.23Å; L91-A97 VanDerWaalsContact O-CB 3.27Å; L91-A97 WeakPolarHBondContact O-CB 3.08Å
92	C	29.3	Very low	32.1	Very low	114 Å²	114	94.5 Å²	94.5	77%	0.77	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-4.9	177.3	-62.7	0	0	0	0	114.7
93	S	34.5	Very low	32.3	Very low	118 Å²	118	92.6 Å²	92.6	83%	0.825	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.1	26.8	-178.1	73.5	0	0	0	0	116	L91	L91-S93 PolarHBondContact O-N 3.43Å
94	S	31.2	Very low	32.6	Very low	48 Å²	48	95.8 Å²	95.8	34%	0.336	52%	0.517	S	S	.	.	S	Bend	trans	-124.4	144.8	179.5	98.1	0	0	0	0	112.2	L91 K96 A97	L91-S94 WeakPolarHBondContact CD2-OG 3.05Å; S94-K96 PolarHBondContact O-N 3.38Å; S94-K96 WeakPolarHBondContact OG-CB 3.36Å; S94-K96 PolarHBondContact OG-N 2.92Å; S94-A97 WeakPolarHBondContact O-CB 3.14Å; S94-A97 PolarHBondContact O-N 2.76Å
95	D	35.6	Very low	32.6	Very low	134 Å²	134	91.6 Å²	91.6	72%	0.717	51%	0.507	S	S	*	.	H	α-helix	trans	-49.6	-25.2	177.5	-62.2	-38.7	0	0	0	112.9	A97 L98 E99	D95-A97 VanDerWaalsContact C-N 3.29Å; D95-A97 PolarHBondContact O-N 3.45Å; D95-L98 PolarHBondContact O-N 3.14Å; D95-E99 PolarHBondContact O-N 2.5Å
96	K	35.8	Very low	32.5	Very low	150 Å²	150	97.9 Å²	97.9	65%	0.652	53%	0.531	S	S	*	.	H	α-helix	trans	-63.1	-28.4	174.4	-66.2	-177.5	178.5	-177.5	0	114.1	L91 S94 H100	L91-K96 HydrophobicContact CD2-CB 3.62Å; S94-K96 PolarHBondContact O-N 3.38Å; S94-K96 WeakPolarHBondContact OG-CB 3.36Å; S94-K96 PolarHBondContact OG-N 2.92Å; K96-H100 WeakPolarHBondContact O-CB 3.47Å; K96-H100 PolarHBondContact O-N 3.26Å
97	A	38.9	Very low	32.3	Very low	15 Å²	15	95.5 Å²	95.5	12%	0.124	52%	0.52	C	S	.	.	H	α-helix	trans	-71.8	-44	177.8	0	0	0	0	0	110.3	L91 S94 D95 H100 I101	L91-A97 HydrophobicContact CB-CB 3.87Å; L91-A97 HydrophobicContact CD1-CB 4.42Å; L91-A97 HydrophobicContact CD2-CB 3.83Å; L91-A97 HydrophobicContact CG-CB 4.23Å; L91-A97 VanDerWaalsContact O-CB 3.27Å; L91-A97 WeakPolarHBondContact O-CB 3.08Å; S94-A97 WeakPolarHBondContact O-CB 3.14Å; S94-A97 PolarHBondContact O-N 2.76Å; D95-A97 VanDerWaalsContact C-N 3.29Å; D95-A97 PolarHBondContact O-N 3.45Å; A97-H100 PolarHBondContact O-N 3.11Å; A97-I101 WeakPolarHBondContact O-CG1 2.92Å; A97-I101 PolarHBondContact O-N 2.98Å
98	L	33.8	Very low	32.1	Very low	93 Å²	93	98 Å²	98	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-44.8	173.2	-73.5	168.3	0	0	0	110.5	D95 H100 I101 W102	D95-L98 PolarHBondContact O-N 3.14Å; L98-H100 VanDerWaalsContact C-N 3.31Å; L98-H100 PolarHBondContact O-N 2.74Å; L98-I101 PolarHBondContact O-N 3.48Å; L98-W102 HydrophobicContact CB-CE3 4.32Å; L98-W102 HydrophobicContact CB-CZ3 4.44Å; L98-W102 HydrophobicContact CD2-CZ3 4.27Å; L98-W102 WeakPolarHBondContact O-CB 3.42Å; L98-W102 PolarHBondContact O-N 2.84Å
99	E	35.8	Very low	32	Very low	136 Å²	136	97.9 Å²	97.9	64%	0.636	52%	0.52	S	S	*	.	H	α-helix	trans	-60.1	-38.1	172.9	-83.6	-164.9	148.5	0	0	112.5	D95 W102 S103	D95-E99 PolarHBondContact O-N 2.5Å; E99-W102 CarbonylContact O-C 3.52Å; E99-W102 PolarHBondContact O-N 3.45Å; E99-S103 VanDerWaalsContact O-CB 3.22Å; E99-S103 WeakPolarHBondContact O-CB 3.06Å; E99-S103 PolarHBondContact O-N 3.41Å; E99-S103 PolarHBondContact O-OG 3.45Å
100	H	39	Very low	31.7	Very low	51 Å²	51	96.5 Å²	96.5	24%	0.236	52%	0.521	C	S	.	.	H	α-helix	trans	-63.8	-47.7	177.1	-175.4	77.6	0	0	0	111.3	K96 A97 L98 W102 S103 Q104	K96-H100 WeakPolarHBondContact O-CB 3.47Å; K96-H100 PolarHBondContact O-N 3.26Å; A97-H100 PolarHBondContact O-N 3.11Å; L98-H100 VanDerWaalsContact C-N 3.31Å; L98-H100 PolarHBondContact O-N 2.74Å; H100-W102 VanDerWaalsContact C-N 3.29Å; H100-W102 PolarHBondContact O-N 3.11Å; H100-S103 WeakPolarHBondContact CA-OG 3.45Å; H100-S103 PolarHBondContact O-N 2.85Å; H100-S103 VanDerWaalsContact O-N 3.17Å; H100-S103 PolarHBondContact O-OG 3.03Å; H100-Q104 WeakPolarHBondContact O-CG 3.31Å; H100-Q104 PolarHBondContact O-N 3.2Å
101	I	34.5	Very low	31.6	Very low	41 Å²	41	102.7 Å²	102.7	21%	0.21	53%	0.531	C	S	.	.	H	α-helix	trans	-56.9	-46.2	173.5	-66.7	168.2	0	0	0	110	L83 A97 L98 S103 Q104 T105	L83-I101 HydrophobicContact CB-CG1 4.34Å; L83-I101 HydrophobicContact CB-CG2 4.39Å; L83-I101 HydrophobicContact CD1-CG2 4.11Å; A97-I101 WeakPolarHBondContact O-CG1 2.92Å; A97-I101 PolarHBondContact O-N 2.98Å; L98-I101 PolarHBondContact O-N 3.48Å; I101-S103 PolarHBondContact O-N 3.06Å; I101-Q104 PolarHBondContact O-N 3.42Å; I101-T105 PolarHBondContact O-N 3.43Å; I101-T105 VanDerWaalsContact O-N 3.14Å; I101-T105 PolarHBondContact O-OG1 3.05Å
102	W	33.5	Very low	31.7	Very low	157 Å²	157	108.3 Å²	108.3	60%	0.595	56%	0.561	S	S	*	*	H	α-helix	trans	-67.5	-30.4	178	-111.1	-66.4	0	0	0	114.1	L98 E99 H100 T105 K106	L98-W102 HydrophobicContact CB-CE3 4.32Å; L98-W102 HydrophobicContact CB-CZ3 4.44Å; L98-W102 HydrophobicContact CD2-CZ3 4.27Å; L98-W102 WeakPolarHBondContact O-CB 3.42Å; L98-W102 PolarHBondContact O-N 2.84Å; E99-W102 CarbonylContact O-C 3.52Å; E99-W102 PolarHBondContact O-N 3.45Å; H100-W102 VanDerWaalsContact C-N 3.29Å; H100-W102 PolarHBondContact O-N 3.11Å; W102-T105 WeakPolarHBondContact CA-OG1 3.25Å; W102-T105 PolarHBondContact O-OG1 3.32Å; W102-K106 WeakPolarHBondContact O-CB 3.21Å; W102-K106 WeakPolarHBondContact O-CG 3.36Å; W102-K106 PolarHBondContact O-N 2.87Å; W102-K106 VanDerWaalsContact O-N 3.16Å
103	S	34.4	Very low	31.6	Very low	55 Å²	55	109 Å²	109	39%	0.385	56%	0.561	S	S	.	*	H	α-helix	trans	-75.1	-38	178.9	73.7	0	0	0	0	111.1	E99 H100 I101 K106 S107	E99-S103 VanDerWaalsContact O-CB 3.22Å; E99-S103 WeakPolarHBondContact O-CB 3.06Å; E99-S103 PolarHBondContact O-N 3.41Å; E99-S103 PolarHBondContact O-OG 3.45Å; H100-S103 WeakPolarHBondContact CA-OG 3.45Å; H100-S103 PolarHBondContact O-N 2.85Å; H100-S103 VanDerWaalsContact O-N 3.17Å; H100-S103 PolarHBondContact O-OG 3.03Å; I101-S103 PolarHBondContact O-N 3.06Å; S103-K106 PolarHBondContact O-N 3.48Å; S103-K106 VanDerWaalsContact O-N 3.17Å; S103-S107 WeakPolarHBondContact O-CB 3.24Å; S103-S107 PolarHBondContact O-N 3.24Å
104	Q	32.9	Very low	31.2	Very low	95 Å²	95	110.2 Å²	110.2	44%	0.444	56%	0.564	S	S	.	*	H	α-helix	trans	-68.8	-34.1	175.7	-71.9	-82.4	-29	0	0	111.6	H100 I101 K106	H100-Q104 WeakPolarHBondContact O-CG 3.31Å; H100-Q104 PolarHBondContact O-N 3.2Å; I101-Q104 PolarHBondContact O-N 3.42Å; Q104-K106 VanDerWaalsContact C-N 3.34Å
105	T	29.3	Very low	30.8	Very low	46 Å²	46	111.5 Å²	111.5	28%	0.282	59%	0.585	S	S	.	*	H	α-helix	trans	-71.7	-27.8	171	46.6	0	0	0	0	112.4	I101 W102	I101-T105 PolarHBondContact O-N 3.43Å; I101-T105 VanDerWaalsContact O-N 3.14Å; I101-T105 PolarHBondContact O-OG1 3.05Å; W102-T105 WeakPolarHBondContact CA-OG1 3.25Å; W102-T105 PolarHBondContact O-OG1 3.32Å
106	K	26.2	Very low	30.1	Very low	156 Å²	156	116.5 Å²	116.5	68%	0.678	59%	0.594	S	S	*	*	H	α-helix	trans	-83.1	-35.1	176.4	-77.4	-179.4	178.5	178.4	0	114.7	W102 S103 Q104 M108 T109	W102-K106 WeakPolarHBondContact O-CB 3.21Å; W102-K106 WeakPolarHBondContact O-CG 3.36Å; W102-K106 PolarHBondContact O-N 2.87Å; W102-K106 VanDerWaalsContact O-N 3.16Å; S103-K106 PolarHBondContact O-N 3.48Å; S103-K106 VanDerWaalsContact O-N 3.17Å; Q104-K106 VanDerWaalsContact C-N 3.34Å; K106-M108 PolarHBondContact O-N 2.98Å; K106-T109 PolarHBondContact O-OG1 2.65Å
107	S	26.2	Very low	29.6	Very low	82 Å²	82	115.1 Å²	115.1	57%	0.573	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	6.2	-164.5	90.7	0	0	0	0	116.4	S103 T109	S103-S107 WeakPolarHBondContact O-CB 3.24Å; S103-S107 PolarHBondContact O-N 3.24Å; S107-T109 PolarHBondContact O-N 3.44Å
108	M	27.9	Very low	28.8	Very low	126 Å²	126	123.7 Å²	123.7	62%	0.621	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-0.6	175.3	-95.2	177.9	38.1	0	0	114.1	K106 N110	K106-M108 PolarHBondContact O-N 2.98Å; M108-N110 PolarHBondContact O-N 2.78Å
109	T	26.3	Very low	28.2	Very low	114 Å²	114	127 Å²	127	70%	0.699	65%	0.646	S	S	*	*	S	Bend	trans	-85.5	99.9	166	38.4	0	0	0	0	110.3	K106 S107	K106-T109 PolarHBondContact O-OG1 2.65Å; S107-T109 PolarHBondContact O-N 3.44Å
110	N	27.2	Very low	27.7	Very low	144 Å²	144	126 Å²	126	77%	0.77	65%	0.649	S	S	*	*			trans	65.4	110.3	163.3	-62.1	-36.1	0	0	0	117.1	M108	M108-N110 PolarHBondContact O-N 2.78Å
111	R	24.8	Very low	26.8	Very low	254 Å²	254	129.8 Å²	129.8	96%	0.958	68%	0.675	S	S	*	*				-166	119.8	127.3	-103.9	155.8	-166	-151.7	4.3	113.4
112	N	27.9	Very low	26.3	Very low	145 Å²	145	138.5 Å²	138.5	78%	0.775	71%	0.705	S	S	*	*			trans	-44.6	144.4	154	-92.2	-29.5	0	0	0	112.5
113	T	28.6	Very low	25.8	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	71%	0.706	S	S	*	*				-162	135.8	129.8	30.2	0	0	0	0	108.7
114	T	24.7	Very low	25.1	Very low	145 Å²	145	140.9 Å²	140.9	89%	0.89	73%	0.731	S	S	*	*	S	Bend	trans	77.6	83.5	173.8	66.7	0	0	0	0	116.8
115	G	24.5	Very low	24.8	Very low	74 Å²	74	141.8 Å²	141.8	76%	0.763	74%	0.738	S	S	*	*			trans	-64.2	126.2	-178.4	0	0	0	0	0	115
116	R	20.4	Very low	24.5	Very low	239 Å²	239	148.1 Å²	148.1	90%	0.902	76%	0.762	S	S	*	*				-163.6	72.2	119.9	-103.3	178.8	176.5	179	-0.1	107.2	F118	R116-F118 PolarHBondContact O-N 2.78Å
117	L	24.4	Very low	24.4	Very low	122 Å²	122	152.8 Å²	152.8	64%	0.639	78%	0.775	S	S	*	*			trans	-62.3	117.1	164.4	-87.2	145.5	0	0	0	106.8	N119	L117-N119 PolarHBondContact O-N 3.03Å
118	F	22.3	Very low	24.5	Very low	194 Å²	194	155.1 Å²	155.1	85%	0.851	79%	0.786	S	S	*	*			trans	-51.8	126.5	168.2	-70.6	-86.8	0	0	0	107.7	R116 V120	R116-F118 PolarHBondContact O-N 2.78Å; F118-V120 VanDerWaalsContact C-N 3.34Å; F118-V120 PolarHBondContact O-N 3Å
119	N	21.6	Very low	24.4	Very low	162 Å²	162	155.6 Å²	155.6	87%	0.866	79%	0.787	S	S	*	*			trans	-59.3	99.7	176.9	-82.9	-29.1	0	0	0	108.4	L117 V121	L117-N119 PolarHBondContact O-N 3.03Å; N119-V121 PolarHBondContact O-N 2.87Å
120	V	24.6	Very low	24.3	Very low	117 Å²	117	161.1 Å²	161.1	71%	0.709	80%	0.795	S	S	*	*			trans	-68.6	105.5	176.3	179.5	0	0	0	0	106.9	F118 R122	F118-V120 VanDerWaalsContact C-N 3.34Å; F118-V120 PolarHBondContact O-N 3Å; V120-R122 PolarHBondContact O-N 2.8Å
121	V	21.6	Very low	24.4	Very low	130 Å²	130	159.7 Å²	159.7	79%	0.788	79%	0.793	S	S	*	*			trans	-61.8	104.1	167.1	-179.3	0	0	0	0	106.7	N119 P123	N119-V121 PolarHBondContact O-N 2.87Å; V121-P123 VanDerWaalsContact O-CD 3.22Å; V121-P123 WeakPolarHBondContact O-CD 3.15Å
122	R	22.7	Very low	24.6	Very low	223 Å²	223	152.9 Å²	152.9	84%	0.842	77%	0.77	S	S	*	*			trans	-59.4	116.3	171.1	-73.4	-177.1	-178.8	178.3	0.4	107.5	V120 N124	V120-R122 PolarHBondContact O-N 2.8Å; R122-N124 PolarHBondContact O-N 3.06Å; R122-N124 VanDerWaalsContact O-N 3.14Å
123	P	22.7	Very low	24.8	Very low	94 Å²	94	152.2 Å²	152.2	61%	0.61	76%	0.757	S	S	*	*			trans	-64.6	122	169.3	-11.6	27.1	0	0	0	106.5	V121 L125	V121-P123 VanDerWaalsContact O-CD 3.22Å; V121-P123 WeakPolarHBondContact O-CD 3.15Å; P123-L125 HydrophobicContact CB-CD1 4.04Å; P123-L125 HydrophobicContact CB-CG 4.12Å; P123-L125 HydrophobicContact CG-CD1 4.44Å; P123-L125 PolarHBondContact O-N 2.81Å
124	N	21	Very low	24.8	Very low	168 Å²	168	151.1 Å²	151.1	90%	0.898	74%	0.743	S	S	*	*			trans	-67.4	73.2	174.4	-124.8	-16.8	0	0	0	108.1	R122 K126	R122-N124 PolarHBondContact O-N 3.06Å; R122-N124 VanDerWaalsContact O-N 3.14Å; N124-K126 VanDerWaalsContact C-N 3.28Å; N124-K126 PolarHBondContact O-N 3.09Å
125	L	25.4	Very low	25.1	Very low	114 Å²	114	148.3 Å²	148.3	60%	0.597	72%	0.716	S	S	*	*			trans	-76.1	85	-178.2	-82.9	151.8	0	0	0	107.9	P123 R127	P123-L125 HydrophobicContact CB-CD1 4.04Å; P123-L125 HydrophobicContact CB-CG 4.12Å; P123-L125 HydrophobicContact CG-CD1 4.44Å; P123-L125 PolarHBondContact O-N 2.81Å; L125-R127 PolarHBondContact O-N 3.11Å
126	K	23	Very low	25.4	Very low	180 Å²	180	145.7 Å²	145.7	78%	0.783	69%	0.685	S	S	*	*			trans	-51.3	131.3	156.4	-74.7	-175.8	177.2	-179.4	0	107.2	N124 T128	N124-K126 VanDerWaalsContact C-N 3.28Å; N124-K126 PolarHBondContact O-N 3.09Å; K126-T128 PolarHBondContact O-N 3.21Å
127	R	25.7	Very low	26.2	Very low	254 Å²	254	135.9 Å²	135.9	96%	0.958	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	25	-161.2	-149.2	176.6	-175.7	174.6	0.2	115.7	L125	L125-R127 PolarHBondContact O-N 3.11Å
128	T	26.8	Very low	26.7	Very low	130 Å²	130	131.3 Å²	131.3	80%	0.798	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	3.8	-168.5	39.6	0	0	0	0	116	K126	K126-T128 PolarHBondContact O-N 3.21Å
129	E	25.7	Very low	27.3	Very low	136 Å²	136	123 Å²	123	64%	0.636	60%	0.595	S	S	*	*	S	Bend	trans	-108.3	118.6	169.6	-74.4	-172.6	-172.8	0	0	111.7	R203	E129-R203 IonicContact OE2-NH1 3.62Å
130	R	25.2	Very low	28.1	Very low	231 Å²	231	117.6 Å²	117.6	87%	0.872	56%	0.563	S	S	*	*			trans	-36.9	138.7	-176.2	-65	174.3	177	172	-2.1	113.3	K132	R130-K132 PolarHBondContact O-N 2.74Å
131	P	29.4	Very low	29.2	Very low	113 Å²	113	112.7 Å²	112.7	73%	0.734	53%	0.534	S	S	*	.			trans	-64.1	111.7	-171	26.9	-32.6	0	0	0	109.7	R133	P131-R133 PolarHBondContact O-N 3.09Å
132	K	29	Very low	30.6	Very low	111 Å²	111	108 Å²	108	48%	0.483	50%	0.504	S	S	.	.			trans	-61.4	101.7	169.3	-58	176.4	-150	-175.1	0	107.3	R130 E134 R203	R130-K132 PolarHBondContact O-N 2.74Å; K132-E134 PolarHBondContact O-N 3.16Å; K132-R203 HydrophobicContact CD-CG 4Å
133	R	32.4	Very low	32	Very low	131 Å²	131	100.7 Å²	100.7	49%	0.494	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-67.3	117.3	178.4	-69.7	172.8	-175.8	175.5	-2.2	108	P131 K205	P131-R133 PolarHBondContact O-N 3.09Å; R133-K205 WeakPolarHBondContact O-CE 3.37Å; R133-K205 PolarHBondContact O-NZ 2.89Å
134	E	27.2	Very low	33.4	Very low	106 Å²	106	97.3 Å²	97.3	50%	0.495	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-80	145.6	173.6	-61.6	-175.3	167.8	0	0	109.3	K132 V141 K159	K132-E134 PolarHBondContact O-N 3.16Å; E134-V141 HydrophobicContact CB-CG1 4.47Å; E134-V141 HydrophobicContact CB-CG2 4.31Å; E134-K159 IonicContact OE1-NZ 3.93Å; E134-K159 IonicContact OE2-NZ 3.54Å; E134-K159 PolarHBondContact OE2-NZ 2.93Å
135	W	31.7	Very low	35	Very low	86 Å²	86	89.7 Å²	89.7	33%	0.326	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-97.4	134.3	177.5	-72.4	79.4	0	0	0	111	V141 K205 V207	W135-V141 WeakPolarHBondContact O-CA 3.26Å; W135-V141 WeakPolarHBondContact O-CG2 3.46Å; W135-K205 HydrophobicContact CZ2-CB 4.11Å; W135-K205 HydrophobicContact CZ2-CD 4.29Å; W135-V207 HydrophobicContact CH2-CB 4.22Å; W135-V207 HydrophobicContact CH2-CG1 4.14Å; W135-V207 HydrophobicContact CH2-CG2 3.5Å; W135-V207 VanDerWaalsContact CH2-CG2 3.5Å; W135-V207 HydrophobicContact CZ2-CG2 3.74Å; W135-V207 HydrophobicContact CZ3-CG1 4.49Å; W135-V207 HydrophobicContact CZ3-CG2 4.43Å
136	V	31.6	Very low	36.7	Very low	19 Å²	19	89.3 Å²	89.3	12%	0.115	42%	0.424	C	S	.	.			trans	-116.5	116.9	-171.1	-176.6	0	0	0	0	108.4	I50 G139 V141 I161	I50-V136 HydrophobicContact CD1-CG1 3.77Å; V136-G139 VanDerWaalsContact CG1-CA 3.42Å; V136-V141 HydrophobicContact CG2-CG2 4.34Å; V136-I161 HydrophobicContact CB-CD1 4.08Å; V136-I161 HydrophobicContact CB-CG1 4.26Å; V136-I161 HydrophobicContact CG1-CD1 3.29Å; V136-I161 HydrophobicContact CG1-CG1 3.63Å; V136-I161 HydrophobicContact CG2-CD1 3.65Å; V136-I161 HydrophobicContact CG2-CG1 3.61Å
137	I	35.6	Very low	38.9	Very low	33 Å²	33	82 Å²	82	17%	0.169	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-114.7	114.6	176	-57.4	147	0	0	0	106.4	G139 Y140 I142 L185 Y186	I137-G139 PolarHBondContact O-N 3.43Å; I137-G139 VanDerWaalsContact O-N 3.17Å; I137-Y140 PolarHBondContact N-O 2.8Å; I137-Y140 PolarHBondContact O-N 3.27Å; I137-I142 HydrophobicContact CD1-CD1 3.71Å; I137-I142 HydrophobicContact CD1-CG1 4.04Å; I137-L185 HydrophobicContact CB-CD1 4.49Å; I137-L185 HydrophobicContact CG2-CD1 3.8Å; I137-Y186 HydrophobicContact CD1-CE2 4.36Å; I137-Y186 WeakPolarHBondContact CD1-OH 3.45Å; I137-Y186 WeakPolarHBondContact CG1-OH 3.34Å; I137-Y186 HydrophobicContact CG2-CE2 4.12Å; I137-Y186 WeakPolarHBondContact CG2-OH 3.21Å
138	N	35.1	Very low	40.8	Very low	25 Å²	25	73.5 Å²	73.5	13%	0.134	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	33.8	-175.9	-68.8	16.6	0	0	0	114.4	P47 M48 Y140 L185	P47-N138 PolarHBondContact O-ND2 2.8Å; P47-N138 PolarHBondContact O-OD1 3.32Å; M48-N138 WeakPolarHBondContact CA-OD1 3.34Å; N138-Y140 VanDerWaalsContact C-N 3.32Å; N138-Y140 VanDerWaalsContact O-CD2 3.27Å; N138-Y140 WeakPolarHBondContact O-CD2 3.23Å; N138-L185 HydrophobicContact CB-CD1 4.35Å; N138-L185 HydrophobicContact CB-CD2 3.7Å; N138-L185 VanDerWaalsContact CG-CD2 3.41Å; N138-L185 WeakPolarHBondContact ND2-CD2 3.5Å
139	G	34.7	Very low	42.4	Very low	19 Å²	19	73.1 Å²	73.1	20%	0.196	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-3	-176.8	0	0	0	0	0	114.9	V136 I137 I161	V136-G139 VanDerWaalsContact CG1-CA 3.42Å; I137-G139 PolarHBondContact O-N 3.43Å; I137-G139 VanDerWaalsContact O-N 3.17Å; G139-I161 PolarHBondContact O-N 2.97Å
140	Y	39.9	Very low	44.2	Very low	49 Å²	49	77 Å²	77	19%	0.192	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.2	180	-60.9	-93.7	0	0	0	111.7	I137 N138 K159 L160 L183	I137-Y140 PolarHBondContact N-O 2.8Å; I137-Y140 PolarHBondContact O-N 3.27Å; N138-Y140 VanDerWaalsContact C-N 3.32Å; N138-Y140 VanDerWaalsContact O-CD2 3.27Å; N138-Y140 WeakPolarHBondContact O-CD2 3.23Å; Y140-K159 CarbonylContact C-O 3.52Å; Y140-K159 WeakPolarHBondContact CA-O 3.23Å; Y140-L160 HydrophobicContact CD1-CD2 3.68Å; Y140-L160 HydrophobicContact CD1-CG 3.76Å; Y140-L160 HydrophobicContact CE1-CD1 4.16Å; Y140-L160 HydrophobicContact CE1-CD2 3.25Å; Y140-L160 HydrophobicContact CE1-CG 3.4Å; Y140-L160 VanDerWaalsContact CE1-CG 3.4Å; Y140-L160 HydrophobicContact CE2-CD2 4.14Å; Y140-L160 HydrophobicContact CG-CD2 4.31Å; Y140-L160 VanDerWaalsContact CZ-CD2 3.5Å; Y140-L183 HydrophobicContact CE2-CD1 4.45Å
141	V	47.5	Very low	45.9	Very low	14 Å²	14	67 Å²	67	9%	0.085	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.8	170	-177.9	0	0	0	0	108.1	E134 W135 V136 V143 Y158 K159	E134-V141 HydrophobicContact CB-CG1 4.47Å; E134-V141 HydrophobicContact CB-CG2 4.31Å; W135-V141 WeakPolarHBondContact O-CA 3.26Å; W135-V141 WeakPolarHBondContact O-CG2 3.46Å; V136-V141 HydrophobicContact CG2-CG2 4.34Å; V141-V143 HydrophobicContact CG1-CG1 4.3Å; V141-V143 PolarHBondContact O-N 2.99Å; V141-Y158 CarbonylContact O-C 3.59Å; V141-Y158 WeakPolarHBondContact O-CA 3.36Å; V141-K159 HydrophobicContact CB-CB 4.29Å; V141-K159 PolarHBondContact N-O 2.83Å; V141-K159 PolarHBondContact O-N 3.29Å
142	I	49.7	Very low	47.6	Very low	32 Å²	32	67.5 Å²	67.5	16%	0.164	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.1	172.6	-61.5	-179.9	0	0	0	108.1	I137 I145 V156 Y158 Y186 L192	I137-I142 HydrophobicContact CD1-CD1 3.71Å; I137-I142 HydrophobicContact CD1-CG1 4.04Å; I142-I145 HydrophobicContact CG2-CD1 4.08Å; I142-I145 HydrophobicContact CG2-CG1 3.86Å; I142-V156 HydrophobicContact CG2-CG1 4.07Å; I142-Y158 HydrophobicContact CD1-CE1 4.17Å; I142-Y158 HydrophobicContact CG1-CD1 3.96Å; I142-Y158 HydrophobicContact CG1-CE1 3.84Å; I142-Y186 HydrophobicContact CD1-CE2 3.82Å; I142-L192 HydrophobicContact CD1-CD2 4.15Å
143	V	53.7	Low	49.4	Very low	69 Å²	69	64.1 Å²	64.1	42%	0.418	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-17.7	-178.8	-57.6	0	0	0	0	112.9	V141 A157 K159 V166	V141-V143 HydrophobicContact CG1-CG1 4.3Å; V141-V143 PolarHBondContact O-N 2.99Å; V143-A157 HydrophobicContact CG2-CB 3.4Å; V143-A157 VanDerWaalsContact CG2-CB 3.4Å; V143-A157 WeakPolarHBondContact CG2-O 3.24Å; V143-A157 PolarHBondContact N-O 3.39Å; V143-K159 HydrophobicContact CG1-CB 3.89Å; V143-K159 HydrophobicContact CG1-CD 4.46Å; V143-V166 HydrophobicContact CG2-CG1 3.62Å; V143-V166 HydrophobicContact CG2-CG2 4.24Å
144	G	51.5	Low	50.6	Low	23 Å²	23	58 Å²	58	24%	0.237	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.4	155.5	177.7	0	0	0	0	0	113.2	A157	G144-A157 PolarHBondContact O-N 3.17Å
145	I	55.4	Low	52.2	Low	8 Å²	8	55.3 Å²	55.3	4%	0.041	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	127	178.5	-56.9	178.1	0	0	0	108.3	I142 Y154 N155 V156 L192 E193	I142-I145 HydrophobicContact CG2-CD1 4.08Å; I142-I145 HydrophobicContact CG2-CG1 3.86Å; I145-Y154 HydrophobicContact CG2-CD1 3.89Å; I145-N155 WeakPolarHBondContact CA-O 3.42Å; I145-V156 HydrophobicContact CG1-CG1 4.05Å; I145-V156 HydrophobicContact CG1-CG2 4.18Å; I145-V156 HydrophobicContact CG2-CG2 4.17Å; I145-L192 HydrophobicContact CD1-CB 4.16Å; I145-L192 HydrophobicContact CD1-CD2 3.32Å; I145-L192 HydrophobicContact CD1-CG 3.42Å; I145-L192 VanDerWaalsContact CD1-CG 3.42Å; I145-E193 HydrophobicContact CG2-CB 4.09Å; I145-E193 HydrophobicContact CG2-CG 4.46Å
146	N	60.8	Low	53.4	Low	107 Å²	107	51.2 Å²	51.2	57%	0.572	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	122.7	175.9	-77.8	-24.3	0	0	0	110.9	N155	N146-N155 PolarHBondContact N-O 3.48Å; N146-N155 PolarHBondContact O-N 3.48Å
147	S	68.8	Low	54.5	Low	27 Å²	27	51 Å²	51	19%	0.189	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	130	167.1	-172.8	0	0	0	0	111.2	G151 L153 E193	S147-G151 PolarHBondContact OG-N 3.5Å; S147-L153 VanDerWaalsContact CA-O 3.26Å; S147-L153 WeakPolarHBondContact CA-O 3.21Å; S147-L153 PolarHBondContact OG-O 3.32Å; S147-L153 VanDerWaalsContact OG-O 3.1Å; S147-E193 WeakPolarHBondContact CB-OE1 3.28Å; S147-E193 WeakPolarHBondContact CB-OE2 3.25Å; S147-E193 PolarHBondContact N-OE1 2.89Å
148	T	65.6	Low	55.4	Low	75 Å²	75	49.5 Å²	49.5	46%	0.46	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-24.1	-180	54	0	0	0	0	113.4	L153 N155	T148-L153 PolarHBondContact N-O 3.47Å; T148-L153 VanDerWaalsContact OG1-CB 3.23Å; T148-L153 WeakPolarHBondContact OG1-CB 3.29Å; T148-N155 WeakPolarHBondContact CG2-ND2 3.31Å
149	Q	59.3	Low	56	Low	121 Å²	121	50.5 Å²	50.5	57%	0.565	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	124.3	-176.9	-63.8	-177.7	1.9	0	0	110.2	G151 K152	Q149-G151 CarbonylContact O-C 3.6Å; Q149-G151 WeakPolarHBondContact O-CA 3.18Å; Q149-G151 PolarHBondContact O-N 2.89Å; Q149-K152 PolarHBondContact O-N 3.47Å
150	K	64.8	Low	56.4	Low	219 Å²	219	53.1 Å²	53.1	95%	0.952	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	25.9	34	168.6	-67.1	-171.2	178.2	-178.3	0	117.4	K152	K150-K152 PolarHBondContact O-N 3.2Å
151	G	59.8	Low	56.4	Low	21 Å²	21	55 Å²	55	22%	0.216	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	19.2	-171.9	0	0	0	0	0	117	S147 Q149 Y154	S147-G151 PolarHBondContact OG-N 3.5Å; Q149-G151 CarbonylContact O-C 3.6Å; Q149-G151 WeakPolarHBondContact O-CA 3.18Å; Q149-G151 PolarHBondContact O-N 2.89Å; G151-Y154 WeakPolarHBondContact CA-OH 2.94Å; G151-Y154 VanDerWaalsContact O-CE2 3.28Å; G151-Y154 WeakPolarHBondContact O-CE2 3.42Å
152	K	66.2	Low	56	Low	122 Å²	122	61.2 Å²	61.2	53%	0.53	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-23.9	175.6	-68.7	-163.7	175.7	-163.8	0	114.4	Q149 K150 T172 V173	Q149-K152 PolarHBondContact O-N 3.47Å; K150-K152 PolarHBondContact O-N 3.2Å; K152-T172 CarbonylContact O-C 3.55Å; K152-T172 WeakPolarHBondContact O-CA 3.49Å; K152-V173 WeakPolarHBondContact CA-O 3.1Å; K152-V173 PolarHBondContact O-N 3.45Å
153	L	66.1	Low	55.5	Low	41 Å²	41	61.3 Å²	61.3	22%	0.215	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.7	-179.7	-72.2	168.1	0	0	0	109.3	S147 T148 T170 H171 T172	S147-L153 VanDerWaalsContact CA-O 3.26Å; S147-L153 WeakPolarHBondContact CA-O 3.21Å; S147-L153 PolarHBondContact OG-O 3.32Å; S147-L153 VanDerWaalsContact OG-O 3.1Å; T148-L153 PolarHBondContact N-O 3.47Å; T148-L153 VanDerWaalsContact OG1-CB 3.23Å; T148-L153 WeakPolarHBondContact OG1-CB 3.29Å; L153-T170 HydrophobicContact CD2-CG2 4.14Å; L153-H171 CarbonylContact C-O 3.49Å; L153-H171 WeakPolarHBondContact CA-O 3.47Å; L153-T172 HydrophobicContact CD2-CG2 4.12Å; L153-T172 WeakPolarHBondContact CD2-OG1 2.99Å
154	Y	57.9	Low	55	Low	2 Å²	2	62.1 Å²	62.1	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	119.6	-176.7	-73.8	-92.6	0	0	0	110.7	I145 G151 T170 H171 V173 F189 T190 E193	I145-Y154 HydrophobicContact CG2-CD1 3.89Å; G151-Y154 WeakPolarHBondContact CA-OH 2.94Å; G151-Y154 VanDerWaalsContact O-CE2 3.28Å; G151-Y154 WeakPolarHBondContact O-CE2 3.42Å; Y154-T170 CarbonylContact O-C 3.52Å; Y154-T170 WeakPolarHBondContact O-CA 3.28Å; Y154-H171 PolarHBondContact N-O 3.21Å; Y154-H171 PolarHBondContact O-N 3.36Å; Y154-V173 HydrophobicContact CD2-CB 4.11Å; Y154-V173 HydrophobicContact CD2-CG2 3.45Å; Y154-V173 VanDerWaalsContact CD2-CG2 3.45Å; Y154-V173 HydrophobicContact CE2-CB 4.01Å; Y154-V173 HydrophobicContact CE2-CG1 4.46Å; Y154-V173 HydrophobicContact CE2-CG2 3.66Å; Y154-F189 HydrophobicContact CD1-CB 3.74Å; Y154-F189 HydrophobicContact CD1-CG 4.45Å; Y154-F189 HydrophobicContact CD2-CB 3.8Å; Y154-F189 HydrophobicContact CD2-CD2 4.43Å; Y154-F189 HydrophobicContact CD2-CG 4.45Å; Y154-F189 HydrophobicContact CE1-CB 3.85Å; Y154-F189 HydrophobicContact CE2-CB 3.91Å; Y154-F189 HydrophobicContact CG-CB 3.71Å; Y154-F189 HydrophobicContact CG-CD2 4.37Å; Y154-F189 HydrophobicContact CG-CG 4.17Å; Y154-T190 WeakPolarHBondContact OH-CA 3.48Å; Y154-T190 PolarHBondContact OH-OG1 3.46Å; Y154-E193 HydrophobicContact CD1-CB 4.42Å; Y154-E193 HydrophobicContact CE1-CB 3.83Å; Y154-E193 HydrophobicContact CE1-CG 4.32Å; Y154-E193 WeakPolarHBondContact CE1-OE2 3.12Å
155	N	61.2	Low	54.8	Low	49 Å²	49	65.8 Å²	65.8	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.4	170.6	-66	-18.5	0	0	0	108.5	I145 N146 T148 V168 M169 T170	I145-N155 WeakPolarHBondContact CA-O 3.42Å; N146-N155 PolarHBondContact N-O 3.48Å; N146-N155 PolarHBondContact O-N 3.48Å; T148-N155 WeakPolarHBondContact CG2-ND2 3.31Å; N155-V168 HydrophobicContact CB-CG1 4.13Å; N155-M169 CarbonylContact C-O 3.36Å; N155-M169 WeakPolarHBondContact CA-O 3.38Å; N155-T170 WeakPolarHBondContact OD1-CG2 3.4Å; N155-T170 PolarHBondContact OD1-OG1 3.27Å; N155-T170 VanDerWaalsContact OD1-OG1 3.06Å
156	V	57.4	Low	54.6	Low	0 Å²	0	69 Å²	69	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126	179.4	-175.9	0	0	0	0	108.9	I142 I145 Y158 V168 M169 F189	I142-V156 HydrophobicContact CG2-CG1 4.07Å; I145-V156 HydrophobicContact CG1-CG1 4.05Å; I145-V156 HydrophobicContact CG1-CG2 4.18Å; I145-V156 HydrophobicContact CG2-CG2 4.17Å; V156-Y158 HydrophobicContact CB-CD2 4.31Å; V156-Y158 HydrophobicContact CB-CE2 3.56Å; V156-Y158 HydrophobicContact CG1-CD1 4.14Å; V156-Y158 HydrophobicContact CG1-CD2 4.03Å; V156-Y158 HydrophobicContact CG1-CE1 3.58Å; V156-Y158 HydrophobicContact CG1-CE2 3.46Å; V156-Y158 VanDerWaalsContact CG1-CE2 3.46Å; V156-Y158 HydrophobicContact CG1-CG 4.35Å; V156-Y158 WeakPolarHBondContact CG1-OH 3.5Å; V156-V168 WeakPolarHBondContact O-CA 3.27Å; V156-M169 PolarHBondContact N-O 3.49Å; V156-M169 PolarHBondContact O-N 2.89Å; V156-F189 HydrophobicContact CG2-CD1 4.18Å; V156-F189 HydrophobicContact CG2-CE1 3.64Å; V156-F189 HydrophobicContact CG2-CZ 3.89Å
157	A	54.1	Low	54.2	Low	16 Å²	16	66.2 Å²	66.2	13%	0.132	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.3	176.2	0	0	0	0	0	109.3	V143 G144 V166 S167 V168	V143-A157 HydrophobicContact CG2-CB 3.4Å; V143-A157 VanDerWaalsContact CG2-CB 3.4Å; V143-A157 WeakPolarHBondContact CG2-O 3.24Å; V143-A157 PolarHBondContact N-O 3.39Å; G144-A157 PolarHBondContact O-N 3.17Å; A157-V166 HydrophobicContact CB-CG1 3.81Å; A157-S167 CarbonylContact C-O 3.55Å; A157-S167 WeakPolarHBondContact CA-O 2.94Å; A157-V168 HydrophobicContact CB-CG2 4.08Å
158	Y	54.1	Low	53.8	Low	1 Å²	1	69.4 Å²	69.4	0%	0.004	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	144.3	-179.3	-62.5	-78.3	0	0	0	110.3	V141 I142 V156 V166 S167 M169 H171 L185	V141-Y158 CarbonylContact O-C 3.59Å; V141-Y158 WeakPolarHBondContact O-CA 3.36Å; I142-Y158 HydrophobicContact CD1-CE1 4.17Å; I142-Y158 HydrophobicContact CG1-CD1 3.96Å; I142-Y158 HydrophobicContact CG1-CE1 3.84Å; V156-Y158 HydrophobicContact CB-CD2 4.31Å; V156-Y158 HydrophobicContact CB-CE2 3.56Å; V156-Y158 HydrophobicContact CG1-CD1 4.14Å; V156-Y158 HydrophobicContact CG1-CD2 4.03Å; V156-Y158 HydrophobicContact CG1-CE1 3.58Å; V156-Y158 HydrophobicContact CG1-CE2 3.46Å; V156-Y158 VanDerWaalsContact CG1-CE2 3.46Å; V156-Y158 HydrophobicContact CG1-CG 4.35Å; V156-Y158 WeakPolarHBondContact CG1-OH 3.5Å; Y158-V166 CarbonylContact O-C 3.52Å; Y158-V166 VanDerWaalsContact O-CA 3.23Å; Y158-V166 WeakPolarHBondContact O-CA 3.33Å; Y158-V166 WeakPolarHBondContact O-CG1 3.46Å; Y158-S167 PolarHBondContact N-O 3.01Å; Y158-S167 PolarHBondContact O-N 2.85Å; Y158-S167 PolarHBondContact O-OG 2.95Å; Y158-M169 HydrophobicContact CD2-CB 4.33Å; Y158-M169 HydrophobicContact CD2-CG 4.3Å; Y158-M169 HydrophobicContact CD2-SD 4.5Å; Y158-M169 HydrophobicContact CE2-CB 4.09Å; Y158-M169 HydrophobicContact CE2-CG 4.46Å; Y158-H171 AromaticContact CE2-NE2 3.49Å; Y158-H171 WeakPolarHBondContact CE2-NE2 3.44Å; Y158-H171 AromaticContact CZ-NE2 3.74Å; Y158-H171 PolarHBondContact OH-NE2 3.23Å; Y158-H171 VanDerWaalsContact OH-NE2 3.09Å; Y158-L185 HydrophobicContact CE1-CD1 4.14Å
159	K	47.5	Very low	53.3	Low	45 Å²	45	68.4 Å²	68.4	20%	0.196	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	123.2	173.3	179.7	-165.4	166.4	-154.6	0	108.3	E134 Y140 V141 V143 S163 V166	E134-K159 IonicContact OE1-NZ 3.93Å; E134-K159 IonicContact OE2-NZ 3.54Å; E134-K159 PolarHBondContact OE2-NZ 2.93Å; Y140-K159 CarbonylContact C-O 3.52Å; Y140-K159 WeakPolarHBondContact CA-O 3.23Å; V141-K159 HydrophobicContact CB-CB 4.29Å; V141-K159 PolarHBondContact N-O 2.83Å; V141-K159 PolarHBondContact O-N 3.29Å; V143-K159 HydrophobicContact CG1-CB 3.89Å; V143-K159 HydrophobicContact CG1-CD 4.46Å; K159-S163 VanDerWaalsContact CE-O 3.32Å; K159-S163 WeakPolarHBondContact CE-O 3.42Å; K159-S163 WeakPolarHBondContact CG-O 3.48Å; K159-V166 HydrophobicContact CB-CG2 4.23Å; K159-V166 HydrophobicContact CG-CG2 4.46Å
160	L	44.1	Very low	53.3	Low	75 Å²	75	66.7 Å²	66.7	39%	0.393	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	139.3	169.5	-76.6	160.6	0	0	0	109	Y140 E162 S163	Y140-L160 HydrophobicContact CD1-CD2 3.68Å; Y140-L160 HydrophobicContact CD1-CG 3.76Å; Y140-L160 HydrophobicContact CE1-CD1 4.16Å; Y140-L160 HydrophobicContact CE1-CD2 3.25Å; Y140-L160 HydrophobicContact CE1-CG 3.4Å; Y140-L160 VanDerWaalsContact CE1-CG 3.4Å; Y140-L160 HydrophobicContact CE2-CD2 4.14Å; Y140-L160 HydrophobicContact CG-CD2 4.31Å; Y140-L160 VanDerWaalsContact CZ-CD2 3.5Å; L160-E162 PolarHBondContact O-N 3.45Å; L160-E162 VanDerWaalsContact O-N 3.08Å; L160-S163 PolarHBondContact O-N 2.84Å
161	I	38.9	Very low	53	Low	89 Å²	89	56.4 Å²	56.4	46%	0.456	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-43.8	-177.4	-56.3	164.6	0	0	0	111.8	V136 G139	V136-I161 HydrophobicContact CB-CD1 4.08Å; V136-I161 HydrophobicContact CB-CG1 4.26Å; V136-I161 HydrophobicContact CG1-CD1 3.29Å; V136-I161 HydrophobicContact CG1-CG1 3.63Å; V136-I161 HydrophobicContact CG2-CD1 3.65Å; V136-I161 HydrophobicContact CG2-CG1 3.61Å; G139-I161 PolarHBondContact O-N 2.97Å
162	E	38.7	Very low	52.8	Low	143 Å²	143	57.7 Å²	57.7	67%	0.668	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.5	-176	-58.5	-177.6	153.5	0	0	113.6	L160	L160-E162 PolarHBondContact O-N 3.45Å; L160-E162 VanDerWaalsContact O-N 3.08Å
163	S	39	Very low	52.1	Low	35 Å²	35	52.1 Å²	52.1	25%	0.245	30%	0.3	C	S	.	.			trans	-98.5	136.4	-176.4	-163.6	0	0	0	0	111.4	K159 L160 N165	K159-S163 VanDerWaalsContact CE-O 3.32Å; K159-S163 WeakPolarHBondContact CE-O 3.42Å; K159-S163 WeakPolarHBondContact CG-O 3.48Å; L160-S163 PolarHBondContact O-N 2.84Å; S163-N165 PolarHBondContact O-N 3.49Å; S163-N165 PolarHBondContact OG-N 3.45Å
164	A	44.7	Very low	51.4	Low	85 Å²	85	54.2 Å²	54.2	70%	0.702	31%	0.312	S	S	*	.	S	Bend	trans	-69.5	-16.6	167	0	0	0	0	0	112.2
165	N	45.4	Very low	51.2	Low	101 Å²	101	61.5 Å²	61.5	54%	0.54	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-86.7	130.8	-172.9	-64.5	-18.4	0	0	0	111.1	S163	S163-N165 PolarHBondContact O-N 3.49Å; S163-N165 PolarHBondContact OG-N 3.45Å
166	V	53.2	Low	50.5	Low	76 Å²	76	60.7 Å²	60.7	46%	0.461	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.3	168.3	179.1	0	0	0	0	107.8	V143 A157 Y158 K159	V143-V166 HydrophobicContact CG2-CG1 3.62Å; V143-V166 HydrophobicContact CG2-CG2 4.24Å; A157-V166 HydrophobicContact CB-CG1 3.81Å; Y158-V166 CarbonylContact O-C 3.52Å; Y158-V166 VanDerWaalsContact O-CA 3.23Å; Y158-V166 WeakPolarHBondContact O-CA 3.33Å; Y158-V166 WeakPolarHBondContact O-CG1 3.46Å; K159-V166 HydrophobicContact CB-CG2 4.23Å; K159-V166 HydrophobicContact CG-CG2 4.46Å
167	S	52	Low	49.7	Very low	47 Å²	47	64 Å²	64	33%	0.329	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.6	169.4	53.1	0	0	0	0	109.7	A157 Y158	A157-S167 CarbonylContact C-O 3.55Å; A157-S167 WeakPolarHBondContact CA-O 2.94Å; Y158-S167 PolarHBondContact N-O 3.01Å; Y158-S167 PolarHBondContact O-N 2.85Å; Y158-S167 PolarHBondContact O-OG 2.95Å
168	V	59	Low	49.3	Very low	95 Å²	95	64.1 Å²	64.1	58%	0.576	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.4	174.5	-176.8	0	0	0	0	108.1	N155 V156 A157	N155-V168 HydrophobicContact CB-CG1 4.13Å; V156-V168 WeakPolarHBondContact O-CA 3.27Å; A157-V168 HydrophobicContact CB-CG2 4.08Å
169	M	56.5	Low	48.6	Very low	54 Å²	54	68.1 Å²	68.1	27%	0.266	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.3	177.4	-64.6	-169.1	179.5	0	0	110.8	N155 V156 Y158 L183	N155-M169 CarbonylContact C-O 3.36Å; N155-M169 WeakPolarHBondContact CA-O 3.38Å; V156-M169 PolarHBondContact N-O 3.49Å; V156-M169 PolarHBondContact O-N 2.89Å; Y158-M169 HydrophobicContact CD2-CB 4.33Å; Y158-M169 HydrophobicContact CD2-CG 4.3Å; Y158-M169 HydrophobicContact CD2-SD 4.5Å; Y158-M169 HydrophobicContact CE2-CB 4.09Å; Y158-M169 HydrophobicContact CE2-CG 4.46Å; M169-L183 HydrophobicContact CE-CD1 3.35Å; M169-L183 HydrophobicContact CE-CG 3.98Å; M169-L183 HydrophobicContact SD-CB 3.87Å; M169-L183 HydrophobicContact SD-CD1 3.38Å; M169-L183 WeakPolarHBondContact SD-CD1 3.2Å; M169-L183 HydrophobicContact SD-CG 3.63Å
170	T	59	Low	48.3	Very low	85 Å²	85	73 Å²	73	52%	0.521	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.8	178.7	-53.7	0	0	0	0	109.6	L153 Y154 N155	L153-T170 HydrophobicContact CD2-CG2 4.14Å; Y154-T170 CarbonylContact O-C 3.52Å; Y154-T170 WeakPolarHBondContact O-CA 3.28Å; N155-T170 WeakPolarHBondContact OD1-CG2 3.4Å; N155-T170 PolarHBondContact OD1-OG1 3.27Å; N155-T170 VanDerWaalsContact OD1-OG1 3.06Å
171	H	58	Low	48.2	Very low	2 Å²	2	73.8 Å²	73.8	1%	0.009	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.1	176.4	-59.9	-86.4	0	0	0	110.3	L153 Y154 Y158 V178 F189	L153-H171 CarbonylContact C-O 3.49Å; L153-H171 WeakPolarHBondContact CA-O 3.47Å; Y154-H171 PolarHBondContact N-O 3.21Å; Y154-H171 PolarHBondContact O-N 3.36Å; Y158-H171 AromaticContact CE2-NE2 3.49Å; Y158-H171 WeakPolarHBondContact CE2-NE2 3.44Å; Y158-H171 AromaticContact CZ-NE2 3.74Å; Y158-H171 PolarHBondContact OH-NE2 3.23Å; Y158-H171 VanDerWaalsContact OH-NE2 3.09Å; H171-V178 HydrophobicContact CB-CG1 4.14Å; H171-F189 HydrophobicContact CB-CD2 4.03Å; H171-F189 HydrophobicContact CB-CE2 3.45Å; H171-F189 VanDerWaalsContact CB-CE2 3.45Å; H171-F189 HydrophobicContact CB-CZ 4.26Å; H171-F189 AromaticContact CD2-CE2 3.95Å; H171-F189 AromaticContact CD2-CZ 3.87Å; H171-F189 AromaticContact CG-CE2 3.46Å; H171-F189 VanDerWaalsContact CG-CE2 3.46Å; H171-F189 AromaticContact CG-CZ 3.79Å; H171-F189 AromaticContact ND1-CE2 3.92Å
172	T	55.1	Low	48.1	Very low	49 Å²	49	76.6 Å²	76.6	30%	0.301	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.9	175.1	-51.8	0	0	0	0	109.8	K152 L153 V178 V179	K152-T172 CarbonylContact O-C 3.55Å; K152-T172 WeakPolarHBondContact O-CA 3.49Å; L153-T172 HydrophobicContact CD2-CG2 4.12Å; L153-T172 WeakPolarHBondContact CD2-OG1 2.99Å; T172-V178 CarbonylContact O-C 3.55Å; T172-V178 VanDerWaalsContact O-CA 3.31Å; T172-V178 WeakPolarHBondContact O-CA 3.4Å; T172-V178 WeakPolarHBondContact O-CG1 3.28Å; T172-V179 PolarHBondContact O-N 3.22Å
173	V	51.5	Low	48	Very low	4 Å²	4	71.7 Å²	71.7	2%	0.024	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.6	179.6	176.6	0	0	0	0	109.3	K152 Y154 V177 V178 F189	K152-V173 WeakPolarHBondContact CA-O 3.1Å; K152-V173 PolarHBondContact O-N 3.45Å; Y154-V173 HydrophobicContact CD2-CB 4.11Å; Y154-V173 HydrophobicContact CD2-CG2 3.45Å; Y154-V173 VanDerWaalsContact CD2-CG2 3.45Å; Y154-V173 HydrophobicContact CE2-CB 4.01Å; Y154-V173 HydrophobicContact CE2-CG1 4.46Å; Y154-V173 HydrophobicContact CE2-CG2 3.66Å; V173-V177 CarbonylContact C-O 3.49Å; V173-V177 VanDerWaalsContact CA-O 3.3Å; V173-V177 WeakPolarHBondContact CA-O 3.48Å; V173-V178 HydrophobicContact CG2-CG2 3.8Å; V173-F189 HydrophobicContact CG2-CB 4.33Å; V173-F189 HydrophobicContact CG2-CD2 3.92Å
174	D	52.7	Low	47.7	Very low	85 Å²	85	71.5 Å²	71.5	46%	0.455	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.8	174.1	-166.4	23.9	0	0	0	109.4	G176 V177 V179	D174-G176 PolarHBondContact O-N 3.22Å; D174-G176 VanDerWaalsContact O-N 3.11Å; D174-V177 PolarHBondContact N-O 3.02Å; D174-V177 PolarHBondContact O-N 3.27Å; D174-V177 VanDerWaalsContact O-O 3.04Å; D174-V179 HydrophobicContact CB-CG2 3.34Å
175	N	52.2	Low	47.6	Very low	156 Å²	156	69.7 Å²	69.7	83%	0.834	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	36.1	-172.9	-69.8	-19.9	0	0	0	114.9	V177	N175-V177 VanDerWaalsContact C-N 3.26Å; N175-V177 PolarHBondContact O-N 3.43Å
176	G	46.8	Very low	47.3	Very low	32 Å²	32	66.9 Å²	66.9	33%	0.33	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	7.3	-178.9	0	0	0	0	0	114.7	D174	D174-G176 PolarHBondContact O-N 3.22Å; D174-G176 VanDerWaalsContact O-N 3.11Å
177	V	40.7	Very low	46.5	Very low	68 Å²	68	71.1 Å²	71.1	41%	0.412	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.2	-178.8	-173.2	0	0	0	0	111	V173 D174 N175 V179 Y187	V173-V177 CarbonylContact C-O 3.49Å; V173-V177 VanDerWaalsContact CA-O 3.3Å; V173-V177 WeakPolarHBondContact CA-O 3.48Å; D174-V177 PolarHBondContact N-O 3.02Å; D174-V177 PolarHBondContact O-N 3.27Å; D174-V177 VanDerWaalsContact O-O 3.04Å; N175-V177 VanDerWaalsContact C-N 3.26Å; N175-V177 PolarHBondContact O-N 3.43Å; V177-V179 PolarHBondContact O-N 3.05Å; V177-Y187 CarbonylContact C-O 3.57Å; V177-Y187 WeakPolarHBondContact CA-O 3.12Å; V177-Y187 HydrophobicContact CG1-CD1 3.86Å
178	V	45.6	Very low	46.1	Very low	20 Å²	20	71.6 Å²	71.6	12%	0.121	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126	175.7	-173.2	0	0	0	0	111.7	H171 T172 V173 A184 Y186 Y187 F189	H171-V178 HydrophobicContact CB-CG1 4.14Å; T172-V178 CarbonylContact O-C 3.55Å; T172-V178 VanDerWaalsContact O-CA 3.31Å; T172-V178 WeakPolarHBondContact O-CA 3.4Å; T172-V178 WeakPolarHBondContact O-CG1 3.28Å; V173-V178 HydrophobicContact CG2-CG2 3.8Å; V178-A184 HydrophobicContact CB-CB 3.85Å; V178-A184 HydrophobicContact CG1-CB 3.28Å; V178-A184 HydrophobicContact CG2-CB 4.32Å; V178-Y186 WeakPolarHBondContact CG2-O 3.04Å; V178-Y187 PolarHBondContact N-O 3.5Å; V178-Y187 VanDerWaalsContact N-O 3.13Å; V178-F189 HydrophobicContact CB-CE2 4.48Å; V178-F189 HydrophobicContact CG1-CE2 4.37Å; V178-F189 HydrophobicContact CG2-CD2 3.28Å; V178-F189 HydrophobicContact CG2-CE2 3.3Å; V178-F189 HydrophobicContact CG2-CG 4.42Å; V178-F189 HydrophobicContact CG2-CZ 4.47Å
179	V	40.6	Very low	45.5	Very low	84 Å²	84	67 Å²	67	51%	0.509	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-27.1	-174.3	-171.3	0	0	0	0	113.4	T172 D174 V177	T172-V179 PolarHBondContact O-N 3.22Å; D174-V179 HydrophobicContact CB-CG2 3.34Å; V177-V179 PolarHBondContact O-N 3.05Å
180	K	39.8	Very low	45.1	Very low	147 Å²	147	66.8 Å²	66.8	64%	0.639	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	103	-178.2	-75	-170.5	175.9	-175	0	111.4
181	P	41.9	Very low	44.4	Very low	93 Å²	93	65.3 Å²	65.3	60%	0.604	35%	0.354	S	S	*	.			trans	-101	90.2	-174	37	-30.1	0	0	0	111.2	L183 A184	P181-L183 VanDerWaalsContact C-N 3.3Å; P181-A184 HydrophobicContact CB-CB 3.71Å
182	D	38.5	Very low	43.8	Very low	148 Å²	148	66 Å²	66	79%	0.791	36%	0.358	S	S	*	.	S	Bend	trans	-74.8	-31.3	156.2	-75.9	-13.9	0	0	0	109.6
183	L	36.8	Very low	43.2	Very low	40 Å²	40	64.6 Å²	64.6	21%	0.209	35%	0.348	C	S	.	.	S	Bend	trans	-155.9	36.4	172.8	-71.6	-175.5	0	0	0	112.4	Y140 M169 P181 L185	Y140-L183 HydrophobicContact CE2-CD1 4.45Å; M169-L183 HydrophobicContact CE-CD1 3.35Å; M169-L183 HydrophobicContact CE-CG 3.98Å; M169-L183 HydrophobicContact SD-CB 3.87Å; M169-L183 HydrophobicContact SD-CD1 3.38Å; M169-L183 WeakPolarHBondContact SD-CD1 3.2Å; M169-L183 HydrophobicContact SD-CG 3.63Å; P181-L183 VanDerWaalsContact C-N 3.3Å; L183-L185 WeakPolarHBondContact O-CG 3.41Å; L183-L185 PolarHBondContact O-N 3.46Å
184	A	32.3	Very low	43.1	Very low	30 Å²	30	71.7 Å²	71.7	25%	0.248	37%	0.374	C	S	.	.			trans	-72.3	98	-174.7	0	0	0	0	0	112.1	V178 P181	V178-A184 HydrophobicContact CB-CB 3.85Å; V178-A184 HydrophobicContact CG1-CB 3.28Å; V178-A184 HydrophobicContact CG2-CB 4.32Å; P181-A184 HydrophobicContact CB-CB 3.71Å
185	L	42.1	Very low	42.4	Very low	47 Å²	47	68.2 Å²	68.2	25%	0.246	36%	0.357	C	S	.	.			trans	-83.2	-17.1	-178.1	-65.2	166.8	0	0	0	113.9	I137 N138 Y158 L183	I137-L185 HydrophobicContact CB-CD1 4.49Å; I137-L185 HydrophobicContact CG2-CD1 3.8Å; N138-L185 HydrophobicContact CB-CD1 4.35Å; N138-L185 HydrophobicContact CB-CD2 3.7Å; N138-L185 VanDerWaalsContact CG-CD2 3.41Å; N138-L185 WeakPolarHBondContact ND2-CD2 3.5Å; Y158-L185 HydrophobicContact CE1-CD1 4.14Å; L183-L185 WeakPolarHBondContact O-CG 3.41Å; L183-L185 PolarHBondContact O-N 3.46Å
186	Y	38.1	Very low	42	Very low	43 Å²	43	61.3 Å²	61.3	17%	0.169	32%	0.321	C	S	.	.			trans	-130.9	125.6	-171.1	-64.2	-79.6	0	0	0	109.6	I137 I142 V178 N188 F189 L192	I137-Y186 HydrophobicContact CD1-CE2 4.36Å; I137-Y186 WeakPolarHBondContact CD1-OH 3.45Å; I137-Y186 WeakPolarHBondContact CG1-OH 3.34Å; I137-Y186 HydrophobicContact CG2-CE2 4.12Å; I137-Y186 WeakPolarHBondContact CG2-OH 3.21Å; I142-Y186 HydrophobicContact CD1-CE2 3.82Å; V178-Y186 WeakPolarHBondContact CG2-O 3.04Å; Y186-N188 PolarHBondContact O-N 3.24Å; Y186-F189 HydrophobicContact CD2-CE1 4.22Å; Y186-L192 HydrophobicContact CD2-CD2 3.62Å; Y186-L192 HydrophobicContact CE2-CD2 3.89Å; Y186-L192 HydrophobicContact CG-CD2 3.99Å
187	Y	38	Very low	41.9	Very low	164 Å²	164	67.2 Å²	67.2	64%	0.643	33%	0.334	S	S	*	.	S	Bend	trans	-63.4	-35.1	174.6	-68.7	-70.4	0	0	0	110.9	V177 V178	V177-Y187 CarbonylContact C-O 3.57Å; V177-Y187 WeakPolarHBondContact CA-O 3.12Å; V177-Y187 HydrophobicContact CG1-CD1 3.86Å; V178-Y187 PolarHBondContact N-O 3.5Å; V178-Y187 VanDerWaalsContact N-O 3.13Å
188	N	42.9	Very low	41.8	Very low	57 Å²	57	68.2 Å²	68.2	31%	0.305	34%	0.339	S	S	.	.			trans	-121.1	94.3	-174.7	-177.2	-8.7	0	0	0	112.7	Y186 T190 D191	Y186-N188 PolarHBondContact O-N 3.24Å; N188-T190 VanDerWaalsContact C-N 3.31Å; N188-T190 WeakPolarHBondContact OD1-CB 3.41Å; N188-T190 PolarHBondContact OD1-N 2.72Å; N188-T190 VanDerWaalsContact OD1-N 3.1Å; N188-D191 PolarHBondContact ND2-OD2 3.27Å; N188-D191 PolarHBondContact OD1-N 3.37Å
189	F	46.6	Very low	41.4	Very low	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-73.8	-17.8	175.9	-82.1	-60.2	0	0	0	114.1	Y154 V156 H171 V173 V178 Y186 L192 E193	Y154-F189 HydrophobicContact CD1-CB 3.74Å; Y154-F189 HydrophobicContact CD1-CG 4.45Å; Y154-F189 HydrophobicContact CD2-CB 3.8Å; Y154-F189 HydrophobicContact CD2-CD2 4.43Å; Y154-F189 HydrophobicContact CD2-CG 4.45Å; Y154-F189 HydrophobicContact CE1-CB 3.85Å; Y154-F189 HydrophobicContact CE2-CB 3.91Å; Y154-F189 HydrophobicContact CG-CB 3.71Å; Y154-F189 HydrophobicContact CG-CD2 4.37Å; Y154-F189 HydrophobicContact CG-CG 4.17Å; V156-F189 HydrophobicContact CG2-CD1 4.18Å; V156-F189 HydrophobicContact CG2-CE1 3.64Å; V156-F189 HydrophobicContact CG2-CZ 3.89Å; H171-F189 HydrophobicContact CB-CD2 4.03Å; H171-F189 HydrophobicContact CB-CE2 3.45Å; H171-F189 VanDerWaalsContact CB-CE2 3.45Å; H171-F189 HydrophobicContact CB-CZ 4.26Å; H171-F189 AromaticContact CD2-CE2 3.95Å; H171-F189 AromaticContact CD2-CZ 3.87Å; H171-F189 AromaticContact CG-CE2 3.46Å; H171-F189 VanDerWaalsContact CG-CE2 3.46Å; H171-F189 AromaticContact CG-CZ 3.79Å; H171-F189 AromaticContact ND1-CE2 3.92Å; V173-F189 HydrophobicContact CG2-CB 4.33Å; V173-F189 HydrophobicContact CG2-CD2 3.92Å; V178-F189 HydrophobicContact CB-CE2 4.48Å; V178-F189 HydrophobicContact CG1-CE2 4.37Å; V178-F189 HydrophobicContact CG2-CD2 3.28Å; V178-F189 HydrophobicContact CG2-CE2 3.3Å; V178-F189 HydrophobicContact CG2-CG 4.42Å; V178-F189 HydrophobicContact CG2-CZ 4.47Å; Y186-F189 HydrophobicContact CD2-CE1 4.22Å; F189-L192 HydrophobicContact CD1-CB 4.48Å; F189-L192 HydrophobicContact CD1-CD2 3.91Å; F189-L192 HydrophobicContact CE1-CD2 4.01Å; F189-L192 PolarHBondContact O-N 2.8Å; F189-E193 VanDerWaalsContact O-CB 3.31Å; F189-E193 WeakPolarHBondContact O-CB 3.38Å; F189-E193 PolarHBondContact O-N 3.1Å
190	T	47.7	Very low	41.3	Very low	48 Å²	48	70.3 Å²	70.3	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-43.2	-179.2	-54.8	0	0	0	0	111.2	Y154 N188 R194	Y154-T190 WeakPolarHBondContact OH-CA 3.48Å; Y154-T190 PolarHBondContact OH-OG1 3.46Å; N188-T190 VanDerWaalsContact C-N 3.31Å; N188-T190 WeakPolarHBondContact OD1-CB 3.41Å; N188-T190 PolarHBondContact OD1-N 2.72Å; N188-T190 VanDerWaalsContact OD1-N 3.1Å; T190-R194 WeakPolarHBondContact O-CB 3.42Å; T190-R194 PolarHBondContact O-N 3.25Å
191	D	44.2	Very low	41	Very low	54 Å²	54	68.5 Å²	68.5	29%	0.289	35%	0.346	S	S	.	.	H	α-helix	trans	-70.5	-36.8	176.2	-69.6	-34.4	0	0	0	111.8	N188 R194 S195 Y217	N188-D191 PolarHBondContact ND2-OD2 3.27Å; N188-D191 PolarHBondContact OD1-N 3.37Å; D191-R194 PolarHBondContact O-N 3.46Å; D191-R194 IonicContact OD1-NH1 2.74Å; D191-R194 PolarHBondContact OD1-NH1 2.9Å; D191-S195 VanDerWaalsContact O-CB 3.24Å; D191-S195 WeakPolarHBondContact O-CB 3.27Å; D191-S195 PolarHBondContact O-N 2.82Å; D191-Y217 HydrophobicContact CB-CE2 4.3Å
192	L	44.8	Very low	40.8	Very low	18 Å²	18	68 Å²	68	9%	0.094	34%	0.344	C	S	.	.	H	α-helix	trans	-66.3	-41.6	176.4	-165.6	66.3	0	0	0	111.9	I142 I145 Y186 F189 S195 A196	I142-L192 HydrophobicContact CD1-CD2 4.15Å; I145-L192 HydrophobicContact CD1-CB 4.16Å; I145-L192 HydrophobicContact CD1-CD2 3.32Å; I145-L192 HydrophobicContact CD1-CG 3.42Å; I145-L192 VanDerWaalsContact CD1-CG 3.42Å; Y186-L192 HydrophobicContact CD2-CD2 3.62Å; Y186-L192 HydrophobicContact CE2-CD2 3.89Å; Y186-L192 HydrophobicContact CG-CD2 3.99Å; F189-L192 HydrophobicContact CD1-CB 4.48Å; F189-L192 HydrophobicContact CD1-CD2 3.91Å; F189-L192 HydrophobicContact CE1-CD2 4.01Å; F189-L192 PolarHBondContact O-N 2.8Å; L192-S195 PolarHBondContact O-N 2.85Å; L192-A196 WeakPolarHBondContact O-CB 3.18Å; L192-A196 PolarHBondContact O-N 3.13Å
193	E	44.4	Very low	40.7	Very low	18 Å²	18	68.3 Å²	68.3	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-65.1	-45.2	174.3	179.2	-178.4	-141.2	0	0	111.5	I145 S147 Y154 F189 S195 A196 R197	I145-E193 HydrophobicContact CG2-CB 4.09Å; I145-E193 HydrophobicContact CG2-CG 4.46Å; S147-E193 WeakPolarHBondContact CB-OE1 3.28Å; S147-E193 WeakPolarHBondContact CB-OE2 3.25Å; S147-E193 PolarHBondContact N-OE1 2.89Å; Y154-E193 HydrophobicContact CD1-CB 4.42Å; Y154-E193 HydrophobicContact CE1-CB 3.83Å; Y154-E193 HydrophobicContact CE1-CG 4.32Å; Y154-E193 WeakPolarHBondContact CE1-OE2 3.12Å; F189-E193 VanDerWaalsContact O-CB 3.31Å; F189-E193 WeakPolarHBondContact O-CB 3.38Å; F189-E193 PolarHBondContact O-N 3.1Å; E193-S195 VanDerWaalsContact C-N 3.31Å; E193-S195 PolarHBondContact O-N 2.97Å; E193-A196 PolarHBondContact O-N 2.86Å; E193-R197 HydrophobicContact CG-CG 4.27Å; E193-R197 WeakPolarHBondContact O-CB 3.3Å; E193-R197 WeakPolarHBondContact O-CG 3.27Å; E193-R197 PolarHBondContact O-N 3.41Å; E193-R197 IonicContact OE1-CZ 3.66Å; E193-R197 IonicContact OE1-NE 3.17Å; E193-R197 PolarHBondContact OE1-NE 3.49Å; E193-R197 IonicContact OE1-NH2 3.2Å; E193-R197 PolarHBondContact OE1-NH2 2.84Å
194	R	48.3	Very low	40.4	Very low	153 Å²	153	70.1 Å²	70.1	58%	0.577	34%	0.342	S	S	*	.	H	α-helix	trans	-59	-46.9	176	-174.5	-174.2	-69.1	139	-2.7	110.3	T190 D191 A196 R197 V198	T190-R194 WeakPolarHBondContact O-CB 3.42Å; T190-R194 PolarHBondContact O-N 3.25Å; D191-R194 PolarHBondContact O-N 3.46Å; D191-R194 IonicContact OD1-NH1 2.74Å; D191-R194 PolarHBondContact OD1-NH1 2.9Å; R194-A196 VanDerWaalsContact C-N 3.35Å; R194-A196 PolarHBondContact O-N 2.8Å; R194-R197 PolarHBondContact O-N 3.47Å; R194-V198 HydrophobicContact CG-CG2 4.43Å; R194-V198 WeakPolarHBondContact O-CB 3.32Å; R194-V198 WeakPolarHBondContact O-CG2 3.07Å; R194-V198 PolarHBondContact O-N 2.81Å
195	S	38.9	Very low	40.5	Very low	13 Å²	13	69.9 Å²	69.9	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-43.3	177.9	-160.1	0	0	0	0	111.3	D191 L192 E193 H199 I206	D191-S195 VanDerWaalsContact O-CB 3.24Å; D191-S195 WeakPolarHBondContact O-CB 3.27Å; D191-S195 PolarHBondContact O-N 2.82Å; L192-S195 PolarHBondContact O-N 2.85Å; E193-S195 VanDerWaalsContact C-N 3.31Å; E193-S195 PolarHBondContact O-N 2.97Å; S195-H199 VanDerWaalsContact O-CB 3.25Å; S195-H199 WeakPolarHBondContact O-CB 3.31Å; S195-H199 PolarHBondContact O-CD2 3.22Å; S195-H199 PolarHBondContact O-N 3.42Å; S195-I206 WeakPolarHBondContact OG-CD1 3.2Å
196	A	43.4	Very low	40	Very low	11 Å²	11	69.4 Å²	69.4	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-60.7	-49.8	176.6	0	0	0	0	0	112.4	L192 E193 R194 L200	L192-A196 WeakPolarHBondContact O-CB 3.18Å; L192-A196 PolarHBondContact O-N 3.13Å; E193-A196 PolarHBondContact O-N 2.86Å; R194-A196 VanDerWaalsContact C-N 3.35Å; R194-A196 PolarHBondContact O-N 2.8Å; A196-L200 HydrophobicContact CB-CD1 3.49Å; A196-L200 VanDerWaalsContact CB-CD1 3.49Å; A196-L200 HydrophobicContact CB-CG 4.18Å; A196-L200 WeakPolarHBondContact O-CB 3.36Å; A196-L200 WeakPolarHBondContact O-CG 3.34Å; A196-L200 PolarHBondContact O-N 3.35Å
197	R	45	Very low	39.8	Very low	156 Å²	156	68.8 Å²	68.8	59%	0.589	33%	0.333	S	S	*	.	H	α-helix	trans	-67.4	-38.7	-178.1	-73.2	-177.7	-177.6	-167.7	2.5	113.2	E193 R194	E193-R197 HydrophobicContact CG-CG 4.27Å; E193-R197 WeakPolarHBondContact O-CB 3.3Å; E193-R197 WeakPolarHBondContact O-CG 3.27Å; E193-R197 PolarHBondContact O-N 3.41Å; E193-R197 IonicContact OE1-CZ 3.66Å; E193-R197 IonicContact OE1-NE 3.17Å; E193-R197 PolarHBondContact OE1-NE 3.49Å; E193-R197 IonicContact OE1-NH2 3.2Å; E193-R197 PolarHBondContact OE1-NH2 2.84Å; R194-R197 PolarHBondContact O-N 3.47Å
198	V	37.7	Very low	39.6	Very low	88 Å²	88	64 Å²	64	53%	0.533	32%	0.321	S	S	.	.	H	α-helix	trans	-77.4	-30.3	-178.5	-176.3	0	0	0	0	111.1	R194	R194-V198 HydrophobicContact CG-CG2 4.43Å; R194-V198 WeakPolarHBondContact O-CB 3.32Å; R194-V198 WeakPolarHBondContact O-CG2 3.07Å; R194-V198 PolarHBondContact O-N 2.81Å
199	H	38.7	Very low	39	Very low	61 Å²	61	65.2 Å²	65.2	28%	0.282	33%	0.327	S	S	.	.	H	α-helix	trans	-125.4	-5.9	-164.2	-53.3	-61.7	0	0	0	115.8	S195 V201	S195-H199 VanDerWaalsContact O-CB 3.25Å; S195-H199 WeakPolarHBondContact O-CB 3.31Å; S195-H199 PolarHBondContact O-CD2 3.22Å; S195-H199 PolarHBondContact O-N 3.42Å; H199-V201 PolarHBondContact O-N 2.89Å; H199-V201 VanDerWaalsContact O-N 3.09Å
200	L	37	Very low	38.2	Very low	88 Å²	88	69 Å²	69	46%	0.461	35%	0.347	S	S	.	.			trans	-79.3	24.6	171.5	-68	171	0	0	0	113.2	A196 S202	A196-L200 HydrophobicContact CB-CD1 3.49Å; A196-L200 VanDerWaalsContact CB-CD1 3.49Å; A196-L200 HydrophobicContact CB-CG 4.18Å; A196-L200 WeakPolarHBondContact O-CB 3.36Å; A196-L200 WeakPolarHBondContact O-CG 3.34Å; A196-L200 PolarHBondContact O-N 3.35Å; L200-S202 PolarHBondContact O-N 2.76Å
201	V	35	Very low	37.4	Very low	109 Å²	109	68.9 Å²	68.9	66%	0.661	35%	0.351	S	S	*	.	S	Bend	trans	-79.4	93.4	169.3	-170.2	0	0	0	0	107.2	H199	H199-V201 PolarHBondContact O-N 2.89Å; H199-V201 VanDerWaalsContact O-N 3.09Å
202	S	37.2	Very low	36.7	Very low	82 Å²	82	72 Å²	72	57%	0.573	37%	0.367	S	S	*	.	S	Bend	trans	59.4	99.4	173.4	168.4	0	0	0	0	115.5	L200 E204	L200-S202 PolarHBondContact O-N 2.76Å; S202-E204 PolarHBondContact O-N 3.17Å
203	R	35.5	Very low	36	Very low	154 Å²	154	76.3 Å²	76.3	58%	0.581	39%	0.39	S	S	*	.	S	Bend	trans	63.1	14.5	154.1	-48.4	176.8	-173.7	-171.1	2.7	116.2	E129 K132	E129-R203 IonicContact OE2-NH1 3.62Å; K132-R203 HydrophobicContact CD-CG 4Å
204	E	30.5	Very low	35.3	Very low	78 Å²	78	81.6 Å²	81.6	36%	0.364	41%	0.413	S	S	.	.			trans	-94	153.2	176.5	-64.7	-170.5	118.1	0	0	112.3	S202 H219 S221	S202-E204 PolarHBondContact O-N 3.17Å; E204-H219 WeakPolarHBondContact CB-NE2 3.4Å; E204-H219 IonicContact OE1-CE1 2.83Å; E204-H219 PolarHBondContact OE1-CE1 3.32Å; E204-H219 VanDerWaalsContact OE1-CE1 3.26Å; E204-H219 IonicContact OE1-ND1 3.12Å; E204-H219 IonicContact OE2-CE1 3.24Å; E204-H219 PolarHBondContact OE2-CE1 3.03Å; E204-H219 IonicContact OE2-NE2 3.19Å; E204-S221 WeakPolarHBondContact OE1-CB 3.5Å; E204-S221 PolarHBondContact OE1-OG 3.3Å
205	K	33.9	Very low	34.5	Very low	25 Å²	25	79.1 Å²	79.1	11%	0.109	41%	0.411	C	S	.	.			trans	-124.4	123.9	-156.9	-70.5	-179.6	132.7	-131	0	109.2	R133 W135 E220	R133-K205 WeakPolarHBondContact O-CE 3.37Å; R133-K205 PolarHBondContact O-NZ 2.89Å; W135-K205 HydrophobicContact CZ2-CB 4.11Å; W135-K205 HydrophobicContact CZ2-CD 4.29Å; K205-E220 HydrophobicContact CB-CB 4.1Å; K205-E220 WeakPolarHBondContact CD-OE2 3.48Å; K205-E220 PolarHBondContact O-N 2.95Å
206	I	32.5	Very low	34	Very low	37 Å²	37	82.8 Å²	82.8	19%	0.19	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.7	177.2	-63.2	155.6	0	0	0	107.9	S195 Y217	S195-I206 WeakPolarHBondContact OG-CD1 3.2Å; I206-Y217 HydrophobicContact CG2-CD1 3.68Å; I206-Y217 HydrophobicContact CG2-CG 4.23Å
207	V	34.6	Very low	33.6	Very low	30 Å²	30	85.6 Å²	85.6	18%	0.182	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.4	171.3	-168.1	0	0	0	0	107.5	W135 L209 V218	W135-V207 HydrophobicContact CH2-CB 4.22Å; W135-V207 HydrophobicContact CH2-CG1 4.14Å; W135-V207 HydrophobicContact CH2-CG2 3.5Å; W135-V207 VanDerWaalsContact CH2-CG2 3.5Å; W135-V207 HydrophobicContact CZ2-CG2 3.74Å; W135-V207 HydrophobicContact CZ3-CG1 4.49Å; W135-V207 HydrophobicContact CZ3-CG2 4.43Å; V207-L209 HydrophobicContact CG1-CD2 3.77Å; V207-L209 HydrophobicContact CG1-CG 4.05Å; V207-L209 PolarHBondContact O-N 3.49Å; V207-V218 PolarHBondContact N-O 2.98Å; V207-V218 PolarHBondContact O-N 2.99Å
208	V	32.3	Very low	32.9	Very low	63 Å²	63	80 Å²	80	38%	0.382	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	110.1	174.3	-175	0	0	0	0	107.7	L215 Y217	V208-L215 HydrophobicContact CG1-CB 4.46Å; V208-L215 HydrophobicContact CG1-CD2 3.61Å; V208-Y217 HydrophobicContact CG1-CE1 4.49Å; V208-Y217 HydrophobicContact CG2-CD1 3.9Å; V208-Y217 HydrophobicContact CG2-CE1 3.9Å
209	L	29.9	Very low	32.8	Very low	83 Å²	83	76.7 Å²	76.7	44%	0.435	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.6	177.3	-62.5	179	0	0	0	108.8	V207 Y216 V218	V207-L209 HydrophobicContact CG1-CD2 3.77Å; V207-L209 HydrophobicContact CG1-CG 4.05Å; V207-L209 PolarHBondContact O-N 3.49Å; L209-Y216 PolarHBondContact N-O 3.22Å; L209-Y216 WeakPolarHBondContact O-CA 3.41Å; L209-Y216 PolarHBondContact O-N 3.32Å; L209-V218 HydrophobicContact CD1-CB 3.83Å; L209-V218 HydrophobicContact CD1-CG1 4.4Å; L209-V218 HydrophobicContact CD1-CG2 3.64Å; L209-V218 HydrophobicContact CG-CB 4.43Å; L209-V218 HydrophobicContact CG-CG2 4.31Å
210	L	30.6	Very low	32.6	Very low	80 Å²	80	76 Å²	76	42%	0.419	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119.7	171	-173.8	76.9	0	0	0	108.8	P66 L215	P66-L210 HydrophobicContact CG-CD2 3.96Å; L210-L215 HydrophobicContact CB-CD2 4.3Å; L210-L215 HydrophobicContact CD1-CD2 3.74Å; L210-L215 HydrophobicContact CD1-CG 4.01Å
211	A	30.7	Very low	32.5	Very low	46 Å²	46	74.6 Å²	74.6	38%	0.38	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	144	170.7	0	0	0	0	0	110	D213 K214 Y216	A211-D213 VanDerWaalsContact C-N 3.26Å; A211-D213 PolarHBondContact O-N 2.8Å; A211-D213 VanDerWaalsContact O-N 3.15Å; A211-K214 PolarHBondContact N-O 2.05Å; A211-K214 PolarHBondContact O-N 3.45Å; A211-K214 VanDerWaalsContact O-O 3.06Å; A211-Y216 HydrophobicContact CB-CD2 3.84Å; A211-Y216 HydrophobicContact CB-CE2 3.64Å; A211-Y216 WeakPolarHBondContact O-CE2 3.4Å
212	N	30	Very low	32.6	Very low	119 Å²	119	77.3 Å²	77.3	64%	0.636	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	47	-179.7	-59.9	-18.7	0	0	0	113.8	K214	N212-K214 PolarHBondContact O-N 3.28Å
213	D	30.1	Very low	32.6	Very low	108 Å²	108	76.2 Å²	76.2	58%	0.578	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	18.8	-178.1	-61.3	-23.9	0	0	0	114.8	A211 K258	A211-D213 VanDerWaalsContact C-N 3.26Å; A211-D213 PolarHBondContact O-N 2.8Å; A211-D213 VanDerWaalsContact O-N 3.15Å; D213-K258 IonicContact OD2-NZ 3.91Å; D213-K258 PolarHBondContact OD2-NZ 2.85Å
214	K	29.2	Very low	32.7	Very low	130 Å²	130	72.9 Å²	72.9	57%	0.565	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.6	177.2	-68.6	-179.1	-178.2	178.9	0	110.4	A211 N212 Y216	A211-K214 PolarHBondContact N-O 2.05Å; A211-K214 PolarHBondContact O-N 3.45Å; A211-K214 VanDerWaalsContact O-O 3.06Å; N212-K214 PolarHBondContact O-N 3.28Å; K214-Y216 HydrophobicContact CB-CD2 4.41Å; K214-Y216 HydrophobicContact CB-CE1 4.28Å; K214-Y216 HydrophobicContact CB-CE2 3.81Å; K214-Y216 VanDerWaalsContact O-CD2 3.28Å; K214-Y216 WeakPolarHBondContact O-CD2 3.46Å; K214-Y216 PolarHBondContact O-N 2.77Å
215	L	31.8	Very low	32.9	Very low	100 Å²	100	77.3 Å²	77.3	52%	0.524	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	112.7	167.7	-69.4	167.7	0	0	0	108	V208 L210	V208-L215 HydrophobicContact CG1-CB 4.46Å; V208-L215 HydrophobicContact CG1-CD2 3.61Å; L210-L215 HydrophobicContact CB-CD2 4.3Å; L210-L215 HydrophobicContact CD1-CD2 3.74Å; L210-L215 HydrophobicContact CD1-CG 4.01Å
216	Y	29.5	Very low	33	Very low	91 Å²	91	82.8 Å²	82.8	36%	0.357	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123	171.9	-61.5	-78.5	0	0	0	109.3	L209 A211 K214 V218	L209-Y216 PolarHBondContact N-O 3.22Å; L209-Y216 WeakPolarHBondContact O-CA 3.41Å; L209-Y216 PolarHBondContact O-N 3.32Å; A211-Y216 HydrophobicContact CB-CD2 3.84Å; A211-Y216 HydrophobicContact CB-CE2 3.64Å; A211-Y216 WeakPolarHBondContact O-CE2 3.4Å; K214-Y216 HydrophobicContact CB-CD2 4.41Å; K214-Y216 HydrophobicContact CB-CE1 4.28Å; K214-Y216 HydrophobicContact CB-CE2 3.81Å; K214-Y216 VanDerWaalsContact O-CD2 3.28Å; K214-Y216 WeakPolarHBondContact O-CD2 3.46Å; K214-Y216 PolarHBondContact O-N 2.77Å; Y216-V218 PolarHBondContact O-N 3.04Å
217	Y	33.6	Very low	33.1	Very low	70 Å²	70	83.2 Å²	83.2	28%	0.275	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	95.6	171.7	-59.5	-85.5	0	0	0	107.2	D191 I206 V208	D191-Y217 HydrophobicContact CB-CE2 4.3Å; I206-Y217 HydrophobicContact CG2-CD1 3.68Å; I206-Y217 HydrophobicContact CG2-CG 4.23Å; V208-Y217 HydrophobicContact CG1-CE1 4.49Å; V208-Y217 HydrophobicContact CG2-CD1 3.9Å; V208-Y217 HydrophobicContact CG2-CE1 3.9Å
218	V	30.6	Very low	33.1	Very low	39 Å²	39	84.3 Å²	84.3	24%	0.236	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.1	-178.2	-178.1	0	0	0	0	109.6	V207 L209 Y216	V207-V218 PolarHBondContact N-O 2.98Å; V207-V218 PolarHBondContact O-N 2.99Å; L209-V218 HydrophobicContact CD1-CB 3.83Å; L209-V218 HydrophobicContact CD1-CG1 4.4Å; L209-V218 HydrophobicContact CD1-CG2 3.64Å; L209-V218 HydrophobicContact CG-CB 4.43Å; L209-V218 HydrophobicContact CG-CG2 4.31Å; Y216-V218 PolarHBondContact O-N 3.04Å
219	H	36.6	Very low	33.1	Very low	17 Å²	17	84.1 Å²	84.1	8%	0.079	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	126.7	-172.9	-159.7	-108.4	0	0	0	110	E204 S221 K222	E204-H219 WeakPolarHBondContact CB-NE2 3.4Å; E204-H219 IonicContact OE1-CE1 2.83Å; E204-H219 PolarHBondContact OE1-CE1 3.32Å; E204-H219 VanDerWaalsContact OE1-CE1 3.26Å; E204-H219 IonicContact OE1-ND1 3.12Å; E204-H219 IonicContact OE2-CE1 3.24Å; E204-H219 PolarHBondContact OE2-CE1 3.03Å; E204-H219 IonicContact OE2-NE2 3.19Å; H219-S221 PolarHBondContact CE1-OG 2.97Å; H219-S221 PolarHBondContact ND1-OG 3.46Å; H219-S221 PolarHBondContact O-N 3.18Å; H219-S221 VanDerWaalsContact O-N 3.09Å; H219-K222 HydrophobicContact CB-CB 4.35Å; H219-K222 HydrophobicContact CB-CD 4.46Å; H219-K222 HydrophobicContact CB-CG 4.25Å; H219-K222 PolarHBondContact O-N 3.43Å
220	E	34.2	Very low	33.3	Very low	48 Å²	48	86.7 Å²	86.7	22%	0.224	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33	-176.1	-170.1	178.7	-143.3	0	0	112.1	K205 L224 L227	K205-E220 HydrophobicContact CB-CB 4.1Å; K205-E220 WeakPolarHBondContact CD-OE2 3.48Å; K205-E220 PolarHBondContact O-N 2.95Å; E220-L224 HydrophobicContact CG-CD1 4.17Å; E220-L224 WeakPolarHBondContact O-CA 3.35Å; E220-L224 VanDerWaalsContact O-CB 3.24Å; E220-L224 WeakPolarHBondContact O-CB 3.35Å; E220-L224 PolarHBondContact O-N 3.31Å; E220-L224 VanDerWaalsContact O-N 3.09Å; E220-L227 HydrophobicContact CG-CD1 4.13Å
221	S	34.8	Very low	33.3	Very low	58 Å²	58	87.2 Å²	87.2	41%	0.406	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-18.7	178.6	65.7	0	0	0	0	115.2	E204 H219	E204-S221 WeakPolarHBondContact OE1-CB 3.5Å; E204-S221 PolarHBondContact OE1-OG 3.3Å; H219-S221 PolarHBondContact CE1-OG 2.97Å; H219-S221 PolarHBondContact ND1-OG 3.46Å; H219-S221 PolarHBondContact O-N 3.18Å; H219-S221 VanDerWaalsContact O-N 3.09Å
222	K	35.8	Very low	33.4	Very low	165 Å²	165	89.4 Å²	89.4	72%	0.717	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-30	-178.2	-75.9	-169.6	176.4	-177.3	0	114.2	H219	H219-K222 HydrophobicContact CB-CB 4.35Å; H219-K222 HydrophobicContact CB-CD 4.46Å; H219-K222 HydrophobicContact CB-CG 4.25Å; H219-K222 PolarHBondContact O-N 3.43Å
223	D	37	Very low	33.6	Very low	60 Å²	60	90.7 Å²	90.7	32%	0.321	46%	0.457	S	S	.	.	S	Bend	trans	-119.9	28.6	174.1	-90.5	-60	0	0	0	110.4	E225 K226 L227	D223-E225 PolarHBondContact O-N 2.96Å; D223-K226 PolarHBondContact O-N 3.45Å; D223-K226 WeakPolarHBondContact OD1-CD 3.33Å; D223-K226 IonicContact OD1-NZ 2.65Å; D223-K226 PolarHBondContact OD1-NZ 2.85Å; D223-L227 PolarHBondContact O-N 3Å
224	L	37.9	Very low	33.8	Very low	83 Å²	83	90.8 Å²	90.8	44%	0.435	45%	0.454	S	S	.	.	H	α-helix	trans	-53.2	-40.3	-178.8	-172.9	65.1	0	0	0	110.4	E220 K226 L227 V228	E220-L224 HydrophobicContact CG-CD1 4.17Å; E220-L224 WeakPolarHBondContact O-CA 3.35Å; E220-L224 VanDerWaalsContact O-CB 3.24Å; E220-L224 WeakPolarHBondContact O-CB 3.35Å; E220-L224 PolarHBondContact O-N 3.31Å; E220-L224 VanDerWaalsContact O-N 3.09Å; L224-K226 PolarHBondContact O-N 3.28Å; L224-L227 PolarHBondContact O-N 2.87Å; L224-V228 HydrophobicContact CD1-CG2 3.68Å; L224-V228 HydrophobicContact CG-CG2 3.68Å; L224-V228 WeakPolarHBondContact O-CA 3.4Å; L224-V228 WeakPolarHBondContact O-CB 3.39Å; L224-V228 WeakPolarHBondContact O-CG2 3.25Å; L224-V228 PolarHBondContact O-N 3.4Å
225	E	35.4	Very low	34	Very low	172 Å²	172	95.4 Å²	95.4	80%	0.804	47%	0.468	S	S	*	.	H	α-helix	trans	-66.2	-35.1	178.3	-76.6	-173.2	160.9	0	0	113.8	D223 A229	D223-E225 PolarHBondContact O-N 2.96Å; E225-A229 WeakPolarHBondContact O-CB 3.44Å; E225-A229 PolarHBondContact O-N 2.93Å
226	K	36.4	Very low	34	Very low	139 Å²	139	99.4 Å²	99.4	60%	0.604	48%	0.483	S	S	*	.	H	α-helix	trans	-72.5	-40.8	175.5	-72.5	-173.7	-166.8	129.5	0	111.5	D223 L224 L230	D223-K226 PolarHBondContact O-N 3.45Å; D223-K226 WeakPolarHBondContact OD1-CD 3.33Å; D223-K226 IonicContact OD1-NZ 2.65Å; D223-K226 PolarHBondContact OD1-NZ 2.85Å; L224-K226 PolarHBondContact O-N 3.28Å; K226-L230 WeakPolarHBondContact O-CD1 3.08Å; K226-L230 WeakPolarHBondContact O-CG 3.19Å; K226-L230 PolarHBondContact O-N 3.34Å; K226-L230 VanDerWaalsContact O-N 3.08Å
227	L	34.5	Very low	34.1	Very low	46 Å²	46	102.3 Å²	102.3	24%	0.241	51%	0.505	C	S	.	.	H	α-helix	trans	-66.6	-47.7	175	-74	168.6	0	0	0	110.3	E220 D223 L224 A229 L230 Y231	E220-L227 HydrophobicContact CG-CD1 4.13Å; D223-L227 PolarHBondContact O-N 3Å; L224-L227 PolarHBondContact O-N 2.87Å; L227-A229 PolarHBondContact O-N 3.48Å; L227-L230 CarbonylContact O-C 3.48Å; L227-L230 WeakPolarHBondContact O-CA 3.44Å; L227-L230 VanDerWaalsContact O-CB 3.27Å; L227-L230 WeakPolarHBondContact O-CB 3.47Å; L227-L230 PolarHBondContact O-N 2.96Å; L227-Y231 HydrophobicContact CB-CD2 4.18Å; L227-Y231 HydrophobicContact CB-CE2 4.14Å; L227-Y231 HydrophobicContact CD2-CE2 4.2Å; L227-Y231 WeakPolarHBondContact O-CB 3.37Å; L227-Y231 WeakPolarHBondContact O-CD2 3.49Å; L227-Y231 PolarHBondContact O-N 2.87Å
228	V	33.6	Very low	34.1	Very low	53 Å²	53	107.9 Å²	107.9	32%	0.321	53%	0.534	S	S	.	.	H	α-helix	trans	-60.3	-44.1	175.5	169.6	0	0	0	0	109.7	L224 L230 Y231 T232	L224-V228 HydrophobicContact CD1-CG2 3.68Å; L224-V228 HydrophobicContact CG-CG2 3.68Å; L224-V228 WeakPolarHBondContact O-CA 3.4Å; L224-V228 WeakPolarHBondContact O-CB 3.39Å; L224-V228 WeakPolarHBondContact O-CG2 3.25Å; L224-V228 PolarHBondContact O-N 3.4Å; V228-L230 PolarHBondContact O-N 2.93Å; V228-Y231 CarbonylContact O-C 3.42Å; V228-Y231 WeakPolarHBondContact O-CA 3.11Å; V228-Y231 PolarHBondContact O-N 3.23Å; V228-T232 HydrophobicContact CG1-CG2 3.4Å; V228-T232 WeakPolarHBondContact O-CB 3.22Å; V228-T232 PolarHBondContact O-N 2.98Å; V228-T232 PolarHBondContact O-OG1 3.4Å
229	A	33.1	Very low	34.2	Very low	59 Å²	59	109.4 Å²	109.4	49%	0.488	55%	0.55	S	S	.	*	H	α-helix	trans	-57.9	-37	173.6	0	0	0	0	0	112.5	E225 L227	E225-A229 WeakPolarHBondContact O-CB 3.44Å; E225-A229 PolarHBondContact O-N 2.93Å; L227-A229 PolarHBondContact O-N 3.48Å
230	L	34.8	Very low	33.9	Very low	137 Å²	137	112.4 Å²	112.4	72%	0.717	57%	0.57	S	S	*	*	H	α-helix	trans	-68.3	-30.2	170.7	-73.7	159.4	0	0	0	113	K226 L227 V228	K226-L230 WeakPolarHBondContact O-CD1 3.08Å; K226-L230 WeakPolarHBondContact O-CG 3.19Å; K226-L230 PolarHBondContact O-N 3.34Å; K226-L230 VanDerWaalsContact O-N 3.08Å; L227-L230 CarbonylContact O-C 3.48Å; L227-L230 WeakPolarHBondContact O-CA 3.44Å; L227-L230 VanDerWaalsContact O-CB 3.27Å; L227-L230 WeakPolarHBondContact O-CB 3.47Å; L227-L230 PolarHBondContact O-N 2.96Å; V228-L230 PolarHBondContact O-N 2.93Å
231	Y	30.4	Very low	33.9	Very low	92 Å²	92	116.3 Å²	116.3	36%	0.361	59%	0.588	S	S	.	*	H	α-helix	trans	-97.5	-30.6	-174.9	-74.3	-66	0	0	0	115.6	I54 L227 V228	I54-Y231 HydrophobicContact CD1-CD1 3.91Å; I54-Y231 HydrophobicContact CD1-CE1 3.32Å; I54-Y231 HydrophobicContact CG1-CE1 4.24Å; L227-Y231 HydrophobicContact CB-CD2 4.18Å; L227-Y231 HydrophobicContact CB-CE2 4.14Å; L227-Y231 HydrophobicContact CD2-CE2 4.2Å; L227-Y231 WeakPolarHBondContact O-CB 3.37Å; L227-Y231 WeakPolarHBondContact O-CD2 3.49Å; L227-Y231 PolarHBondContact O-N 2.87Å; V228-Y231 CarbonylContact O-C 3.42Å; V228-Y231 WeakPolarHBondContact O-CA 3.11Å; V228-Y231 PolarHBondContact O-N 3.23Å
232	T	32.9	Very low	33.8	Very low	91 Å²	91	120.4 Å²	120.4	56%	0.558	60%	0.595	S	S	*	*	H	α-helix	trans	-87.9	-18.6	-171.1	43.3	0	0	0	0	114	V228 E234	V228-T232 HydrophobicContact CG1-CG2 3.4Å; V228-T232 WeakPolarHBondContact O-CB 3.22Å; V228-T232 PolarHBondContact O-N 2.98Å; V228-T232 PolarHBondContact O-OG1 3.4Å; T232-E234 PolarHBondContact O-N 3.25Å
233	N	33.6	Very low	33.8	Very low	147 Å²	147	113.8 Å²	113.8	79%	0.786	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-7.4	174.5	-91.5	-10.2	0	0	0	113.4
234	E	34.5	Very low	33.8	Very low	109 Å²	109	111.1 Å²	111.1	51%	0.509	55%	0.554	S	S	.	*			trans	-131	79.4	-179.3	-66.5	-178.7	-177.8	0	0	110.2	K56 T232 H236	K56-E234 IonicContact NZ-OE1 3.93Å; K56-E234 PolarHBondContact NZ-OE1 2.89Å; K56-E234 IonicContact NZ-OE2 3.26Å; T232-E234 PolarHBondContact O-N 3.25Å; E234-H236 PolarHBondContact O-N 2.96Å; E234-H236 VanDerWaalsContact O-N 3.17Å
235	R	32.4	Very low	33.8	Very low	228 Å²	228	107.3 Å²	107.3	86%	0.86	53%	0.534	S	S	*	.			trans	-54.5	111.4	145.5	-79.3	-180	-178.3	176.5	0.9	105.9
236	H	32.3	Very low	34	Very low	183 Å²	183	100 Å²	100	85%	0.847	50%	0.502	S	S	*	.			trans	-167.9	128.7	139.8	-91.3	-54.6	0	0	0	109.1	E234 E238	E234-H236 PolarHBondContact O-N 2.96Å; E234-H236 VanDerWaalsContact O-N 3.17Å; H236-E238 PolarHBondContact O-N 3.48Å
237	D	32.2	Very low	34	Very low	152 Å²	152	93.6 Å²	93.6	81%	0.813	47%	0.474	S	S	*	.			trans	-39.1	127.1	161.8	-75.7	-57.5	0	0	0	110.5
238	E	32.5	Very low	34	Very low	188 Å²	188	94.4 Å²	94.4	88%	0.879	47%	0.474	S	S	*	.			trans	179.6	146.3	143.7	-97	158	-148.2	0	0	108.5	H236 T240	H236-E238 PolarHBondContact O-N 3.48Å; E238-T240 PolarHBondContact O-N 3.11Å
239	A	32.9	Very low	34	Very low	71 Å²	71	94.7 Å²	94.7	59%	0.587	48%	0.476	S	S	*	.			trans	-45.4	123.7	-168.5	0	0	0	0	0	112.9	H241	A239-H241 PolarHBondContact O-CD2 3Å; A239-H241 VanDerWaalsContact O-CD2 3.3Å; A239-H241 PolarHBondContact O-N 3.32Å
240	T	31.8	Very low	34.1	Very low	79 Å²	79	93.2 Å²	93.2	49%	0.485	46%	0.46	S	S	.	.			trans	-66.6	96.5	172.3	-44.6	0	0	0	0	108.3	P52 E238	P52-T240 HydrophobicContact CB-CG2 3.6Å; E238-T240 PolarHBondContact O-N 3.11Å
241	H	32.5	Very low	34.1	Very low	131 Å²	131	89.6 Å²	89.6	61%	0.606	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	149	171.3	-63.9	-66.6	0	0	0	108.7	P52 A53 A239	P52-H241 CarbonylContact C-O 3.6Å; A53-H241 WeakPolarHBondContact CA-O 3.01Å; A53-H241 HydrophobicContact CB-CB 3.83Å; A53-H241 WeakPolarHBondContact CB-O 3.36Å; A53-H241 PolarHBondContact N-O 2.81Å; A239-H241 PolarHBondContact O-CD2 3Å; A239-H241 VanDerWaalsContact O-CD2 3.3Å; A239-H241 PolarHBondContact O-N 3.32Å
242	Y	33	Very low	34.3	Very low	143 Å²	143	91 Å²	91	56%	0.561	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.1	174.8	-69.5	-87.9	0	0	0	108.6	I50 M51	I50-Y242 HydrophobicContact CG2-CD1 4.02Å; I50-Y242 HydrophobicContact CG2-CG 4.29Å; M51-Y242 WeakPolarHBondContact O-CA 3.35Å
243	L	36.1	Very low	34.6	Very low	27 Å²	27	92.2 Å²	92.2	14%	0.141	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.7	178.9	-66	175	0	0	0	109.8	I50 M51 A53 L69 F245	I50-L243 CarbonylContact C-O 3.58Å; I50-L243 WeakPolarHBondContact CA-O 3.31Å; M51-L243 PolarHBondContact N-O 2.74Å; M51-L243 PolarHBondContact O-N 2.85Å; A53-L243 HydrophobicContact CB-CD1 3.58Å; A53-L243 HydrophobicContact CB-CD2 4.24Å; A53-L243 HydrophobicContact CB-CG 3.5Å; A53-L243 VanDerWaalsContact CB-CG 3.5Å; L69-L243 HydrophobicContact CD1-CB 3.56Å; L69-L243 HydrophobicContact CD1-CD1 4.08Å; L69-L243 HydrophobicContact CD1-CD2 3.7Å; L69-L243 HydrophobicContact CD1-CG 3.92Å; L243-F245 HydrophobicContact CB-CD2 4.34Å; L243-F245 HydrophobicContact CB-CE2 3.69Å; L243-F245 HydrophobicContact CB-CZ 4.31Å; L243-F245 HydrophobicContact CD1-CZ 4.49Å; L243-F245 WeakPolarHBondContact O-CD2 3.47Å
244	S	36.7	Very low	35.1	Very low	4 Å²	4	87.2 Å²	87.2	3%	0.028	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.1	175.2	-61.6	0	0	0	0	110.6	A49 L69 C70 I73	A49-S244 CarbonylContact O-C 3.51Å; A49-S244 WeakPolarHBondContact O-CA 3.41Å; L69-S244 WeakPolarHBondContact CA-O 3.39Å; C70-S244 PolarHBondContact N-O 3.36Å; C70-S244 PolarHBondContact SG-O 2.81Å; I73-S244 WeakPolarHBondContact CD1-OG 3.08Å
245	F	38.8	Very low	35.6	Very low	2 Å²	2	82.7 Å²	82.7	1%	0.009	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.3	-176.4	-76.9	-84.5	0	0	0	111	M48 A49 M51 F64 L67 K68 L69 L243	M48-F245 PolarHBondContact N-O 3.49Å; A49-F245 HydrophobicContact CB-CB 4.42Å; A49-F245 PolarHBondContact N-O 3.39Å; A49-F245 PolarHBondContact O-N 3.49Å; M51-F245 HydrophobicContact CB-CD2 4.22Å; M51-F245 HydrophobicContact CB-CE2 4Å; M51-F245 HydrophobicContact CG-CD2 4.14Å; M51-F245 HydrophobicContact CG-CE2 4.27Å; M51-F245 HydrophobicContact SD-CD2 4.1Å; M51-F245 HydrophobicContact SD-CE2 4.05Å; F64-F245 HydrophobicContact CD2-CE1 4.37Å; L67-F245 HydrophobicContact CB-CB 4.04Å; L67-F245 HydrophobicContact CB-CD1 4.13Å; L67-F245 HydrophobicContact CB-CG 4.47Å; L67-F245 HydrophobicContact CD1-CB 4.3Å; L67-F245 HydrophobicContact CD2-CB 4.49Å; K68-F245 CarbonylContact O-C 3.59Å; K68-F245 VanDerWaalsContact O-CA 3.3Å; K68-F245 WeakPolarHBondContact O-CA 3.43Å; L69-F245 HydrophobicContact CD1-CZ 4.45Å; L243-F245 HydrophobicContact CB-CD2 4.34Å; L243-F245 HydrophobicContact CB-CE2 3.69Å; L243-F245 HydrophobicContact CB-CZ 4.31Å; L243-F245 HydrophobicContact CD1-CZ 4.49Å; L243-F245 WeakPolarHBondContact O-CD2 3.47Å
246	C	38.5	Very low	36.6	Very low	20 Å²	20	74.6 Å²	74.6	14%	0.135	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.5	-175.3	-69	0	0	0	0	109.3	P47 L67 K68 C70	P47-C246 VanDerWaalsContact CA-SG 3.58Å; L67-C246 CarbonylContact C-O 3.6Å; L67-C246 VanDerWaalsContact CA-O 3.25Å; L67-C246 WeakPolarHBondContact CA-O 3.4Å; K68-C246 PolarHBondContact N-O 2.87Å; K68-C246 PolarHBondContact O-N 2.83Å; C70-C246 WeakPolarHBondContact CB-SG 3.48Å; C70-C246 WeakPolarHBondContact SG-CB 3.38Å; C70-C246 PolarHBondContact SG-N 2.86Å; C70-C246 CovalentContact SG-SG 2.05Å; C70-C246 PolarHBondContact SG-SG 3.18Å
247	S	36.9	Very low	37.5	Very low	3 Å²	3	70.1 Å²	70.1	2%	0.021	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	151	175	65.2	0	0	0	0	113.8	D45 M48 P66	D45-S247 WeakPolarHBondContact CB-O 3.31Å; D45-S247 PolarHBondContact N-O 3.12Å; M48-S247 WeakPolarHBondContact CE-OG 3.44Å; M48-S247 PolarHBondContact SD-OG 2.79Å; P66-S247 VanDerWaalsContact O-CA 3.29Å; P66-S247 WeakPolarHBondContact O-CA 3.47Å
248	Y	34.3	Very low	38.6	Very low	63 Å²	63	68 Å²	68	25%	0.247	34%	0.343	C	S	.	.			trans	-87.1	93	156.2	-62.7	-86.2	0	0	0	110	L44 P66 K68 N250 Y251	L44-Y248 HydrophobicContact CD2-CD1 3.85Å; L44-Y248 HydrophobicContact CD2-CE1 3.25Å; L44-Y248 HydrophobicContact CG-CE1 4.24Å; P66-Y248 PolarHBondContact O-N 2.96Å; P66-Y248 VanDerWaalsContact O-N 3.09Å; K68-Y248 HydrophobicContact CB-CE2 4.36Å; K68-Y248 HydrophobicContact CD-CE2 4Å; K68-Y248 HydrophobicContact CG-CE2 4.14Å; Y248-N250 PolarHBondContact O-N 2.8Å; Y248-N250 VanDerWaalsContact O-N 3.14Å; Y248-Y251 PolarHBondContact O-N 3.17Å; Y248-Y251 VanDerWaalsContact O-N 3.11Å
249	T	34.1	Very low	39.2	Very low	60 Å²	60	61.6 Å²	61.6	37%	0.368	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.4	173.8	67.8	0	0	0	0	112.2	D45	D45-T249 HydrophobicContact CB-CG2 4.21Å; D45-T249 PolarHBondContact OD1-OG1 2.77Å; D45-T249 WeakPolarHBondContact OD2-CA 3.23Å; D45-T249 WeakPolarHBondContact OD2-CB 3.48Å; D45-T249 WeakPolarHBondContact OD2-CG2 3.48Å; D45-T249 PolarHBondContact OD2-N 3.44Å; D45-T249 PolarHBondContact OD2-OG1 2.88Å
250	N	34.5	Very low	39.9	Very low	27 Å²	27	67.6 Å²	67.6	14%	0.144	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	2.3	174.4	-79.5	-41.6	0	0	0	115.2	Y248 M252 K253 F254	Y248-N250 PolarHBondContact O-N 2.8Å; Y248-N250 VanDerWaalsContact O-N 3.14Å; N250-M252 PolarHBondContact O-N 2.97Å; N250-M252 VanDerWaalsContact O-N 3.08Å; N250-K253 PolarHBondContact O-N 2.89Å; N250-K253 WeakPolarHBondContact OD1-CD 3.48Å; N250-K253 PolarHBondContact OD1-NZ 2.86Å; N250-F254 VanDerWaalsContact C-CE2 3.42Å; N250-F254 HydrophobicContact CB-CD2 4.38Å; N250-F254 HydrophobicContact CB-CE1 4.33Å; N250-F254 HydrophobicContact CB-CE2 3.48Å; N250-F254 VanDerWaalsContact CB-CE2 3.48Å; N250-F254 HydrophobicContact CB-CZ 3.46Å; N250-F254 VanDerWaalsContact CB-CZ 3.46Å; N250-F254 WeakPolarHBondContact O-CD2 3.32Å; N250-F254 WeakPolarHBondContact O-CE2 3.48Å; N250-F254 PolarHBondContact O-N 2.72Å
251	Y	34.7	Very low	40.5	Very low	62 Å²	62	69.5 Å²	69.5	24%	0.243	34%	0.342	C	S	.	.	H	α-helix	trans	-48.5	-41	173	-179.7	-103.3	0	0	0	111.5	Y248 K253 F254 Y273 C275 H286	Y248-Y251 PolarHBondContact O-N 3.17Å; Y248-Y251 VanDerWaalsContact O-N 3.11Å; Y251-K253 VanDerWaalsContact C-N 3.28Å; Y251-K253 PolarHBondContact O-N 2.79Å; Y251-F254 PolarHBondContact O-N 2.78Å; Y251-Y273 PolarHBondContact OH-O 2.85Å; Y251-C275 PolarHBondContact OH-N 2.7Å; Y251-H286 HydrophobicContact CE2-CB 3.85Å
252	M	36	Very low	40.8	Very low	122 Å²	122	66.4 Å²	66.4	60%	0.601	33%	0.333	S	S	*	.	H	α-helix	trans	-62.9	-24.2	177	-73.5	-136.1	60.2	0	0	115.3	N250	N250-M252 PolarHBondContact O-N 2.97Å; N250-M252 VanDerWaalsContact O-N 3.08Å
253	K	39.3	Very low	41	Very low	116 Å²	116	61 Å²	61	50%	0.504	32%	0.316	S	S	.	.	H	α-helix	trans	-87.8	-23.4	178	-70.4	-170.1	-172.3	161.9	0	113.5	N250 Y251 R279	N250-K253 PolarHBondContact O-N 2.89Å; N250-K253 WeakPolarHBondContact OD1-CD 3.48Å; N250-K253 PolarHBondContact OD1-NZ 2.86Å; Y251-K253 VanDerWaalsContact C-N 3.28Å; Y251-K253 PolarHBondContact O-N 2.79Å; K253-R279 WeakPolarHBondContact O-CD 3.44Å
254	F	42.2	Very low	41	Very low	41 Å²	41	69.2 Å²	69.2	18%	0.18	35%	0.345	C	S	.	.	H	α-helix	trans	-82.6	-27.7	-176.2	-54.3	-49.8	0	0	0	112.4	N250 Y251 C278 R279 F282	N250-F254 VanDerWaalsContact C-CE2 3.42Å; N250-F254 HydrophobicContact CB-CD2 4.38Å; N250-F254 HydrophobicContact CB-CE1 4.33Å; N250-F254 HydrophobicContact CB-CE2 3.48Å; N250-F254 VanDerWaalsContact CB-CE2 3.48Å; N250-F254 HydrophobicContact CB-CZ 3.46Å; N250-F254 VanDerWaalsContact CB-CZ 3.46Å; N250-F254 WeakPolarHBondContact O-CD2 3.32Å; N250-F254 WeakPolarHBondContact O-CE2 3.48Å; N250-F254 PolarHBondContact O-N 2.72Å; Y251-F254 PolarHBondContact O-N 2.78Å; F254-C278 CarbonylContact O-C 3.57Å; F254-C278 WeakPolarHBondContact O-CA 3.47Å; F254-R279 PolarHBondContact O-N 3.1Å; F254-F282 HydrophobicContact CB-CB 4.44Å; F254-F282 HydrophobicContact CD1-CB 4.31Å; F254-F282 AromaticContact CD1-CD1 3.12Å; F254-F282 HydrophobicContact CD1-CD1 3.12Å; F254-F282 HydrophobicContact CD1-CD2 4.41Å; F254-F282 AromaticContact CD1-CE1 3.35Å; F254-F282 HydrophobicContact CD1-CE1 3.35Å; F254-F282 AromaticContact CD1-CG 3.71Å; F254-F282 HydrophobicContact CD1-CG 3.71Å; F254-F282 HydrophobicContact CD1-CZ 4.1Å; F254-F282 AromaticContact CE1-CD1 3.46Å; F254-F282 HydrophobicContact CE1-CD1 3.46Å; F254-F282 VanDerWaalsContact CE1-CD1 3.46Å; F254-F282 AromaticContact CE1-CE1 3.35Å; F254-F282 HydrophobicContact CE1-CE1 3.35Å; F254-F282 HydrophobicContact CE1-CG 4.46Å; F254-F282 HydrophobicContact CE1-CZ 4.3Å; F254-F282 HydrophobicContact CG-CD1 4.21Å
255	C	45.1	Very low	40.9	Very low	14 Å²	14	74.3 Å²	74.3	10%	0.095	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	119.8	-177.7	-161.1	0	0	0	0	112.3	E257 C275	C255-E257 VanDerWaalsContact SG-C 3.58Å; C255-E257 PolarHBondContact SG-O 2.82Å; C255-C275 WeakPolarHBondContact CA-SG 2.88Å; C255-C275 HydrophobicContact CB-CB 3.9Å; C255-C275 WeakPolarHBondContact CB-SG 3.21Å; C255-C275 WeakPolarHBondContact SG-CA 3.43Å; C255-C275 WeakPolarHBondContact SG-CB 3.36Å; C255-C275 CovalentContact SG-SG 2.03Å; C255-C275 PolarHBondContact SG-SG 2.86Å
256	A	54.1	Low	40.6	Very low	59 Å²	59	82.3 Å²	82.3	49%	0.488	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-41.9	172.2	0	0	0	0	0	111.4	T277 R279	A256-T277 WeakPolarHBondContact CA-O 3.32Å; A256-T277 WeakPolarHBondContact CB-O 3.39Å; A256-T277 PolarHBondContact N-O 3.13Å; A256-R279 HydrophobicContact CB-CG 3.75Å
257	E	52.3	Low	40.3	Very low	89 Å²	89	83.8 Å²	83.8	42%	0.416	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	127.7	-177.1	-166.9	-177.1	165.7	0	0	110.4	C255 C275 K276 T277	C255-E257 VanDerWaalsContact SG-C 3.58Å; C255-E257 PolarHBondContact SG-O 2.82Å; E257-C275 CarbonylContact O-C 3.51Å; E257-K276 HydrophobicContact CB-CB 4.38Å; E257-K276 HydrophobicContact CG-CB 4.42Å; E257-K276 HydrophobicContact CG-CD 4.27Å; E257-K276 WeakPolarHBondContact O-CA 2.97Å; E257-K276 WeakPolarHBondContact O-CB 3.32Å; E257-K276 PolarHBondContact O-N 2.83Å; E257-K276 WeakPolarHBondContact OE1-CD 3.22Å; E257-K276 WeakPolarHBondContact OE1-CE 3.4Å; E257-K276 IonicContact OE1-NZ 2.65Å; E257-K276 PolarHBondContact OE1-NZ 2.85Å; E257-K276 IonicContact OE2-NZ 3.87Å; E257-T277 PolarHBondContact N-O 3.41Å; E257-T277 VanDerWaalsContact N-O 3.17Å; E257-T277 PolarHBondContact O-N 3.33Å
258	K	53.3	Low	40	Very low	106 Å²	106	92 Å²	92	46%	0.461	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	155.4	-179.7	-63.9	-174.5	177	-170.6	0	111.3	D213 G274	D213-K258 IonicContact OD2-NZ 3.91Å; D213-K258 PolarHBondContact OD2-NZ 2.85Å; K258-G274 CarbonylContact C-O 3.5Å; K258-G274 VanDerWaalsContact CA-O 3.31Å; K258-G274 WeakPolarHBondContact CA-O 3.49Å
259	L	47.1	Very low	39.9	Very low	54 Å²	54	92.1 Å²	92.1	28%	0.283	48%	0.484	S	S	.	.			trans	-75.4	134.7	166.1	-68.9	170.8	0	0	0	109.8	V261 D272 G274 K276	L259-V261 VanDerWaalsContact C-N 3.29Å; L259-V261 PolarHBondContact O-N 3.3Å; L259-D272 HydrophobicContact CD1-CB 4.09Å; L259-D272 WeakPolarHBondContact CD1-O 3.2Å; L259-G274 PolarHBondContact N-O 3.17Å; L259-K276 HydrophobicContact CD2-CB 3.89Å; L259-K276 HydrophobicContact CD2-CD 4.4Å; L259-K276 HydrophobicContact CD2-CG 4.21Å; L259-K276 HydrophobicContact CG-CB 4.24Å
260	E	47.2	Very low	39.8	Very low	197 Å²	197	93.7 Å²	93.7	92%	0.921	49%	0.49	S	S	*	.	S	Bend	trans	-67	-30.4	-178.7	-70	-174.6	162.8	0	0	112.9
261	V	44.6	Very low	39.9	Very low	120 Å²	120	99.5 Å²	99.5	73%	0.727	52%	0.516	S	S	*	.	S	Bend	trans	-129.2	109.6	177.2	-174.6	0	0	0	0	108.1	L259	L259-V261 VanDerWaalsContact C-N 3.29Å; L259-V261 PolarHBondContact O-N 3.3Å
262	P	39	Very low	39.8	Very low	65 Å²	65	100.2 Å²	100.2	42%	0.422	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-68	135.2	174.3	25.3	-29.9	0	0	0	109.6
263	P	36.1	Very low	40.2	Very low	31 Å²	31	97.5 Å²	97.5	20%	0.201	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-63.3	144.9	-178.6	24	-32	0	0	0	111.2	D272	P263-D272 WeakPolarHBondContact CD-O 3.16Å; P263-D272 WeakPolarHBondContact CG-O 3.24Å
264	R	36.3	Very low	40.6	Very low	198 Å²	198	93 Å²	93	75%	0.747	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-70.2	138.2	174.9	-67.9	-177.8	-176.1	177.3	2.5	108.2	E266 S267	R264-E266 PolarHBondContact O-N 3.41Å; R264-S267 PolarHBondContact O-N 3.16Å; R264-S267 PolarHBondContact O-OG 3.46Å; R264-S267 VanDerWaalsContact O-OG 3.1Å
265	P	34	Very low	40.7	Very low	111 Å²	111	91.3 Å²	91.3	72%	0.721	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-9.6	-179.9	21.6	-31.3	0	0	0	114.5
266	E	33.6	Very low	41	Very low	171 Å²	171	95.8 Å²	95.8	80%	0.799	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.9	-178.1	-65	178.8	175.5	0	0	114.2	R264 H268	R264-E266 PolarHBondContact O-N 3.41Å; E266-H268 PolarHBondContact O-N 3.46Å
267	S	31.1	Very low	40.9	Very low	50 Å²	50	95.9 Å²	95.9	35%	0.35	50%	0.5	S	S	.	.			trans	-84.7	93.8	178.7	47.5	0	0	0	0	110.8	R264 G269	R264-S267 PolarHBondContact O-N 3.16Å; R264-S267 PolarHBondContact O-OG 3.46Å; R264-S267 VanDerWaalsContact O-OG 3.1Å; S267-G269 PolarHBondContact O-N 3.14Å; S267-G269 VanDerWaalsContact O-N 3.13Å
268	H	30.6	Very low	40.7	Very low	175 Å²	175	92.4 Å²	92.4	81%	0.81	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	116.2	166.3	-85.2	-2.8	0	0	0	110.6	E266	E266-H268 PolarHBondContact O-N 3.46Å
269	G	33.7	Very low	40.1	Very low	66 Å²	66	93.8 Å²	93.8	68%	0.68	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.2	-13.5	167.5	0	0	0	0	0	116.1	S267 E271	S267-G269 PolarHBondContact O-N 3.14Å; S267-G269 VanDerWaalsContact O-N 3.13Å; G269-E271 PolarHBondContact O-N 2.78Å
270	D	31.4	Very low	39.7	Very low	94 Å²	94	97.2 Å²	97.2	50%	0.503	51%	0.514	S	S	.	.			trans	-90.8	88.7	178.2	-64.9	-26.6	0	0	0	109.4	D272	D270-D272 PolarHBondContact O-N 3Å
271	E	36.4	Very low	39	Very low	148 Å²	148	91.9 Å²	91.9	69%	0.692	51%	0.511	S	S	*	.			trans	-65.4	10.4	178.3	-64.1	-179.3	164.1	0	0	113.7	G269 Y273	G269-E271 PolarHBondContact O-N 2.78Å; E271-Y273 PolarHBondContact O-N 3.37Å; E271-Y273 VanDerWaalsContact O-N 3.11Å
272	D	33.5	Very low	38.4	Very low	77 Å²	77	89.2 Å²	89.2	41%	0.412	49%	0.49	S	S	.	.			trans	-90.2	70.5	-166.3	-68.1	-22.1	0	0	0	112.8	L259 P263 D270 G274 H288	L259-D272 HydrophobicContact CD1-CB 4.09Å; L259-D272 WeakPolarHBondContact CD1-O 3.2Å; P263-D272 WeakPolarHBondContact CD-O 3.16Å; P263-D272 WeakPolarHBondContact CG-O 3.24Å; D270-D272 PolarHBondContact O-N 3Å; D272-G274 PolarHBondContact O-N 3.17Å; D272-H288 IonicContact OD1-NE2 2.73Å
273	Y	43.7	Very low	38	Very low	65 Å²	65	89.7 Å²	89.7	26%	0.255	50%	0.499	S	S	.	.			trans	-86.8	107.6	-177.9	-89.6	-83.3	0	0	0	114.6	Y63 Y251 E271 C275	Y63-Y273 AromaticContact CD1-CE2 3.79Å; Y63-Y273 HydrophobicContact CD1-CE2 3.79Å; Y63-Y273 AromaticContact CD1-CZ 3.92Å; Y63-Y273 WeakPolarHBondContact CD1-OH 3.42Å; Y63-Y273 HydrophobicContact CE1-CE2 4.2Å; Y251-Y273 PolarHBondContact OH-O 2.85Å; E271-Y273 PolarHBondContact O-N 3.37Å; E271-Y273 VanDerWaalsContact O-N 3.11Å; Y273-C275 PolarHBondContact O-N 2.84Å
274	G	47	Very low	38	Very low	21 Å²	21	89.5 Å²	89.5	22%	0.216	50%	0.503	C	S	.	.	S	Bend	trans	63.4	-31.8	155.3	0	0	0	0	0	118.8	K258 L259 D272	K258-G274 CarbonylContact C-O 3.5Å; K258-G274 VanDerWaalsContact CA-O 3.31Å; K258-G274 WeakPolarHBondContact CA-O 3.49Å; L259-G274 PolarHBondContact N-O 3.17Å; D272-G274 PolarHBondContact O-N 3.17Å
275	C	44.5	Very low	37.8	Very low	7 Å²	7	89.1 Å²	89.1	5%	0.047	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	108.1	-175.2	-168.6	0	0	0	0	111.4	Y251 C255 E257 Y273 T277	Y251-C275 PolarHBondContact OH-N 2.7Å; C255-C275 WeakPolarHBondContact CA-SG 2.88Å; C255-C275 HydrophobicContact CB-CB 3.9Å; C255-C275 WeakPolarHBondContact CB-SG 3.21Å; C255-C275 WeakPolarHBondContact SG-CA 3.43Å; C255-C275 WeakPolarHBondContact SG-CB 3.36Å; C255-C275 CovalentContact SG-SG 2.03Å; C255-C275 PolarHBondContact SG-SG 2.86Å; E257-C275 CarbonylContact O-C 3.51Å; Y273-C275 PolarHBondContact O-N 2.84Å; C275-T277 PolarHBondContact SG-O 2.96Å
276	K	51.5	Low	38	Very low	107 Å²	107	86.3 Å²	86.3	47%	0.465	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-35.1	179.9	-175	175.6	165.3	-162.1	0	112.2	E257 L259	E257-K276 HydrophobicContact CB-CB 4.38Å; E257-K276 HydrophobicContact CG-CB 4.42Å; E257-K276 HydrophobicContact CG-CD 4.27Å; E257-K276 WeakPolarHBondContact O-CA 2.97Å; E257-K276 WeakPolarHBondContact O-CB 3.32Å; E257-K276 PolarHBondContact O-N 2.83Å; E257-K276 WeakPolarHBondContact OE1-CD 3.22Å; E257-K276 WeakPolarHBondContact OE1-CE 3.4Å; E257-K276 IonicContact OE1-NZ 2.65Å; E257-K276 PolarHBondContact OE1-NZ 2.85Å; E257-K276 IonicContact OE2-NZ 3.87Å; L259-K276 HydrophobicContact CD2-CB 3.89Å; L259-K276 HydrophobicContact CD2-CD 4.4Å; L259-K276 HydrophobicContact CD2-CG 4.21Å; L259-K276 HydrophobicContact CG-CB 4.24Å
277	T	51.6	Low	38.1	Very low	62 Å²	62	78.9 Å²	78.9	38%	0.38	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	134.5	-179.5	-58.2	0	0	0	0	111.3	A256 E257 C275	A256-T277 WeakPolarHBondContact CA-O 3.32Å; A256-T277 WeakPolarHBondContact CB-O 3.39Å; A256-T277 PolarHBondContact N-O 3.13Å; E257-T277 PolarHBondContact N-O 3.41Å; E257-T277 VanDerWaalsContact N-O 3.17Å; E257-T277 PolarHBondContact O-N 3.33Å; C275-T277 PolarHBondContact SG-O 2.96Å
278	C	48.7	Very low	38.2	Very low	16 Å²	16	82.7 Å²	82.7	11%	0.108	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	152.1	175.4	-37.9	0	0	0	0	111.2	F254 F282 C287	F254-C278 CarbonylContact O-C 3.57Å; F254-C278 WeakPolarHBondContact O-CA 3.47Å; C278-F282 HydrophobicContact CB-CB 4.33Å; C278-C287 WeakPolarHBondContact CA-SG 3.49Å; C278-C287 HydrophobicContact CB-CB 4.36Å; C278-C287 WeakPolarHBondContact CB-SG 3.37Å; C278-C287 PolarHBondContact N-SG 2.99Å; C278-C287 WeakPolarHBondContact SG-CB 3.39Å; C278-C287 CovalentContact SG-SG 2.01Å; C278-C287 PolarHBondContact SG-SG 2.98Å
279	R	41.1	Very low	38.1	Very low	134 Å²	134	77.3 Å²	77.3	51%	0.506	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-62.1	148.6	165.5	-67.5	-171.4	-177.2	-169.3	-4.2	109.7	K253 F254 A256 G281 F282	K253-R279 WeakPolarHBondContact O-CD 3.44Å; F254-R279 PolarHBondContact O-N 3.1Å; A256-R279 HydrophobicContact CB-CG 3.75Å; R279-G281 PolarHBondContact O-N 2.73Å; R279-F282 HydrophobicContact CB-CD2 3.81Å; R279-F282 HydrophobicContact CB-CE2 4.12Å; R279-F282 WeakPolarHBondContact O-CD2 3.32Å; R279-F282 PolarHBondContact O-N 2.69Å
280	P	38.6	Very low	37.8	Very low	127 Å²	127	77.3 Å²	77.3	83%	0.825	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	133.7	178.1	-26.9	34.5	0	0	0	112.1
281	G	31	Very low	37.5	Very low	84 Å²	84	80.9 Å²	80.9	87%	0.866	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	1.8	-178.3	0	0	0	0	0	115.7	R279	R279-G281 PolarHBondContact O-N 2.73Å
282	F	32.5	Very low	37	Very low	65 Å²	65	77.4 Å²	77.4	29%	0.285	44%	0.443	S	S	.	.			trans	-116.8	146.7	176	-57.3	-82.7	0	0	0	111.8	F254 C278 R279	F254-F282 HydrophobicContact CB-CB 4.44Å; F254-F282 HydrophobicContact CD1-CB 4.31Å; F254-F282 AromaticContact CD1-CD1 3.12Å; F254-F282 HydrophobicContact CD1-CD1 3.12Å; F254-F282 HydrophobicContact CD1-CD2 4.41Å; F254-F282 AromaticContact CD1-CE1 3.35Å; F254-F282 HydrophobicContact CD1-CE1 3.35Å; F254-F282 AromaticContact CD1-CG 3.71Å; F254-F282 HydrophobicContact CD1-CG 3.71Å; F254-F282 HydrophobicContact CD1-CZ 4.1Å; F254-F282 AromaticContact CE1-CD1 3.46Å; F254-F282 HydrophobicContact CE1-CD1 3.46Å; F254-F282 VanDerWaalsContact CE1-CD1 3.46Å; F254-F282 AromaticContact CE1-CE1 3.35Å; F254-F282 HydrophobicContact CE1-CE1 3.35Å; F254-F282 HydrophobicContact CE1-CG 4.46Å; F254-F282 HydrophobicContact CE1-CZ 4.3Å; F254-F282 HydrophobicContact CG-CD1 4.21Å; C278-F282 HydrophobicContact CB-CB 4.33Å; R279-F282 HydrophobicContact CB-CD2 3.81Å; R279-F282 HydrophobicContact CB-CE2 4.12Å; R279-F282 WeakPolarHBondContact O-CD2 3.32Å; R279-F282 PolarHBondContact O-N 2.69Å
283	A	30.6	Very low	36.7	Very low	74 Å²	74	77.8 Å²	77.8	61%	0.612	45%	0.45	S	S	*	.			trans	-157.4	140.1	-170.1	0	0	0	0	0	110.8	I289	A283-I289 HydrophobicContact CB-CD1 3.32Å; A283-I289 HydrophobicContact CB-CG1 3.57Å
284	G	35.9	Very low	36	Very low	27 Å²	27	83 Å²	83	28%	0.278	47%	0.474	S	S	.	.	B	Isolated β-bridge	trans	168.9	172.6	175.1	0	0	0	0	0	115.2	H286 C287	G284-H286 PolarHBondContact O-N 3.12Å; G284-C287 CarbonylContact O-C 3.51Å; G284-C287 PolarHBondContact O-N 3.26Å
285	Y	32.4	Very low	35.1	Very low	190 Å²	190	86.1 Å²	86.1	75%	0.745	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.9	-177.2	-109.1	-83.9	0	0	0	114.4	C287 F297	Y285-C287 VanDerWaalsContact C-N 3.3Å; Y285-C287 PolarHBondContact O-N 3.09Å; Y285-F297 HydrophobicContact CD2-CE1 4.48Å; Y285-F297 HydrophobicContact CE2-CE1 4.36Å
286	H	37.6	Very low	34.2	Very low	52 Å²	52	90.7 Å²	90.7	24%	0.241	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	14.9	-178.7	-51.5	-69.4	0	0	0	113.3	Y251 G284	Y251-H286 HydrophobicContact CE2-CB 3.85Å; G284-H286 PolarHBondContact O-N 3.12Å
287	C	35.9	Very low	33	Very low	16 Å²	16	90.2 Å²	90.2	11%	0.108	51%	0.514	C	S	.	.	B	Isolated β-bridge	trans	-159.1	113.5	-169.3	-152.7	0	0	0	0	110.7	C278 G284 Y285 I289	C278-C287 WeakPolarHBondContact CA-SG 3.49Å; C278-C287 HydrophobicContact CB-CB 4.36Å; C278-C287 WeakPolarHBondContact CB-SG 3.37Å; C278-C287 PolarHBondContact N-SG 2.99Å; C278-C287 WeakPolarHBondContact SG-CB 3.39Å; C278-C287 CovalentContact SG-SG 2.01Å; C278-C287 PolarHBondContact SG-SG 2.98Å; G284-C287 CarbonylContact O-C 3.51Å; G284-C287 PolarHBondContact O-N 3.26Å; Y285-C287 VanDerWaalsContact C-N 3.3Å; Y285-C287 PolarHBondContact O-N 3.09Å; C287-I289 PolarHBondContact O-N 3.17Å
288	H	33.3	Very low	31.7	Very low	130 Å²	130	95 Å²	95	60%	0.602	53%	0.53	S	S	*	.			trans	-58.1	107	-179.3	-105.2	-70.6	0	0	0	110.8	D272 G290	D272-H288 IonicContact OD1-NE2 2.73Å; H288-G290 PolarHBondContact O-N 3.09Å
289	I	28.4	Very low	30.4	Very low	62 Å²	62	100.4 Å²	100.4	32%	0.318	56%	0.556	S	S	.	*			trans	-75.8	109	164.3	-52.6	165.9	0	0	0	104.9	A283 C287 N291 V292 F297	A283-I289 HydrophobicContact CB-CD1 3.32Å; A283-I289 HydrophobicContact CB-CG1 3.57Å; C287-I289 PolarHBondContact O-N 3.17Å; I289-N291 PolarHBondContact O-N 3.09Å; I289-V292 HydrophobicContact CG2-CG2 3.72Å; I289-F297 HydrophobicContact CD1-CE2 4.11Å
290	G	27.4	Very low	29.5	Very low	66 Å²	66	98.4 Å²	98.4	68%	0.68	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.8	118.9	179.6	0	0	0	0	0	111.7	H288 V292	H288-G290 PolarHBondContact O-N 3.09Å; G290-V292 PolarHBondContact O-N 3.19Å; G290-V292 VanDerWaalsContact O-N 3.12Å
291	N	26.7	Very low	28.9	Very low	168 Å²	168	97.9 Å²	97.9	90%	0.898	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	38.9	50.5	168.2	-67.5	-16.6	0	0	0	117.6	I289	I289-N291 PolarHBondContact O-N 3.09Å
292	V	26.1	Very low	28.4	Very low	76 Å²	76	101 Å²	101	46%	0.461	54%	0.541	S	S	.	.			trans	-93.7	118.9	162.6	-172.7	0	0	0	0	109.3	I289 G290 K294 L296	I289-V292 HydrophobicContact CG2-CG2 3.72Å; G290-V292 PolarHBondContact O-N 3.19Å; G290-V292 VanDerWaalsContact O-N 3.12Å; V292-K294 PolarHBondContact O-N 3.06Å; V292-L296 HydrophobicContact CG1-CB 4.23Å; V292-L296 HydrophobicContact CG1-CD1 3.95Å
293	P	26.3	Very low	28.1	Very low	84 Å²	84	101.5 Å²	101.5	55%	0.545	55%	0.552	S	S	.	*			trans	-57.5	135.1	-178.6	-23.4	32.3	0	0	0	112.3	S295 L296	P293-S295 PolarHBondContact O-N 3.02Å; P293-L296 PolarHBondContact O-N 3.31Å; P293-L296 VanDerWaalsContact O-N 3.11Å
294	K	29.5	Very low	28	Very low	174 Å²	174	104.8 Å²	104.8	76%	0.757	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.1	-20.4	-178	-72.3	-174.4	174.9	-173.2	0	114.8	V292 L296 F297	V292-K294 PolarHBondContact O-N 3.06Å; K294-L296 VanDerWaalsContact C-N 3.31Å; K294-L296 PolarHBondContact O-N 2.83Å; K294-F297 PolarHBondContact O-N 3.41Å
295	S	27.7	Very low	27.7	Very low	87 Å²	87	109 Å²	109	61%	0.608	57%	0.566	S	S	*	*	H	α-helix	trans	-64.4	-29.6	178.6	56.1	0	0	0	0	114	P293	P293-S295 PolarHBondContact O-N 3.02Å
296	L	25.8	Very low	27.5	Very low	103 Å²	103	103.4 Å²	103.4	54%	0.539	55%	0.554	S	S	.	*	H	α-helix	trans	-74.9	-29.1	179.9	-92	146.8	0	0	0	113.1	V292 P293 K294 K298 L299	V292-L296 HydrophobicContact CG1-CB 4.23Å; V292-L296 HydrophobicContact CG1-CD1 3.95Å; P293-L296 PolarHBondContact O-N 3.31Å; P293-L296 VanDerWaalsContact O-N 3.11Å; K294-L296 VanDerWaalsContact C-N 3.31Å; K294-L296 PolarHBondContact O-N 2.83Å; L296-K298 PolarHBondContact O-N 3.37Å; L296-L299 PolarHBondContact O-N 3.23Å
297	F	25.6	Very low	27.1	Very low	98 Å²	98	106.8 Å²	106.8	43%	0.43	57%	0.569	S	S	.	*	H	α-helix	trans	-70.8	-32.6	-177.3	-121.8	-88.6	0	0	0	113.1	Y285 I289 K294 L299 C300	Y285-F297 HydrophobicContact CD2-CE1 4.48Å; Y285-F297 HydrophobicContact CE2-CE1 4.36Å; I289-F297 HydrophobicContact CD1-CE2 4.11Å; K294-F297 PolarHBondContact O-N 3.41Å; F297-L299 PolarHBondContact O-N 2.68Å; F297-C300 PolarHBondContact O-N 3.08Å
298	K	24.6	Very low	26.9	Very low	163 Å²	163	110 Å²	110	71%	0.709	59%	0.587	S	S	*	*	H	α-helix	trans	-63	-28.9	174.2	-88.5	-174.2	175	-179.3	0	112.5	L296	L296-K298 PolarHBondContact O-N 3.37Å
299	L	22.4	Very low	26.8	Very low	128 Å²	128	110.6 Å²	110.6	67%	0.67	59%	0.588	S	S	*	*	H	α-helix	trans	-68.9	-34.4	177.7	-106.4	100.1	0	0	0	112.8	L296 F297 S303	L296-L299 PolarHBondContact O-N 3.23Å; F297-L299 PolarHBondContact O-N 2.68Å; L299-S303 PolarHBondContact O-N 3.38Å; L299-S303 VanDerWaalsContact O-N 3.17Å
300	C	21.9	Very low	26.9	Very low	92 Å²	92	110.9 Å²	110.9	62%	0.622	60%	0.596	S	S	*	*	H	α-helix	trans	-69.8	-35.4	-178.6	-75.8	0	0	0	0	113	F297 S303 F304	F297-C300 PolarHBondContact O-N 3.08Å; C300-S303 WeakPolarHBondContact O-CB 3.1Å; C300-S303 PolarHBondContact O-N 2.93Å; C300-F304 PolarHBondContact O-N 2.85Å
301	I	25.2	Very low	27.1	Very low	116 Å²	116	110.9 Å²	110.9	60%	0.595	58%	0.584	S	S	*	*	H	α-helix	trans	-69.5	-40.6	178.3	-60.1	177.5	0	0	0	110.6	S303 F304	I301-S303 PolarHBondContact O-N 3.08Å; I301-F304 PolarHBondContact O-N 3.23Å
302	F	21.7	Very low	27.3	Very low	151 Å²	151	105.9 Å²	105.9	66%	0.662	57%	0.566	S	S	*	*	H	α-helix	trans	-64.3	-28.2	174.3	-96	-83.6	0	0	0	113.2	F304 S306	F302-F304 VanDerWaalsContact C-N 3.33Å; F302-F304 PolarHBondContact O-N 3.15Å; F302-S306 PolarHBondContact O-N 3.48Å; F302-S306 PolarHBondContact O-OG 3.16Å
303	S	25.8	Very low	27.6	Very low	74 Å²	74	108.8 Å²	108.8	52%	0.517	57%	0.573	S	S	.	*	H	α-helix	trans	-68.5	-29.6	176	-174.8	0	0	0	0	113	L299 C300 I301 S306 F307	L299-S303 PolarHBondContact O-N 3.38Å; L299-S303 VanDerWaalsContact O-N 3.17Å; C300-S303 WeakPolarHBondContact O-CB 3.1Å; C300-S303 PolarHBondContact O-N 2.93Å; I301-S303 PolarHBondContact O-N 3.08Å; S303-S306 PolarHBondContact O-N 3.2Å; S303-F307 VanDerWaalsContact O-CB 3.31Å; S303-F307 WeakPolarHBondContact O-CB 3.39Å; S303-F307 PolarHBondContact O-N 2.76Å
304	F	28.6	Very low	28	Very low	143 Å²	143	108.2 Å²	108.2	63%	0.627	57%	0.568	S	S	*	*	H	α-helix	trans	-76	-40.1	-177.4	-156.2	-93.3	0	0	0	112.2	C300 I301 F302 S306 F307 V308	C300-F304 PolarHBondContact O-N 2.85Å; I301-F304 PolarHBondContact O-N 3.23Å; F302-F304 VanDerWaalsContact C-N 3.33Å; F302-F304 PolarHBondContact O-N 3.15Å; F304-S306 VanDerWaalsContact C-N 3.29Å; F304-S306 PolarHBondContact O-N 3.39Å; F304-F307 WeakPolarHBondContact O-CB 3.41Å; F304-F307 PolarHBondContact O-N 3.47Å; F304-V308 HydrophobicContact CD1-CG2 4.22Å; F304-V308 HydrophobicContact CE1-CG2 4.12Å; F304-V308 WeakPolarHBondContact O-CG2 3.5Å; F304-V308 PolarHBondContact O-N 2.84Å
305	E	29.3	Very low	28.1	Very low	117 Å²	117	102.8 Å²	102.8	55%	0.547	56%	0.556	S	S	.	*	H	α-helix	trans	-62.3	-40	170.1	-79.4	-162.6	161.7	0	0	111.9	F307 V308 K309	E305-F307 VanDerWaalsContact C-N 3.29Å; E305-F307 PolarHBondContact O-N 2.66Å; E305-V308 PolarHBondContact O-N 3.03Å; E305-K309 WeakPolarHBondContact O-CB 3.12Å; E305-K309 WeakPolarHBondContact O-CG 3.37Å; E305-K309 PolarHBondContact O-N 3.29Å
306	S	27.7	Very low	28.4	Very low	72 Å²	72	105.5 Å²	105.5	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-64.2	-36.7	175.6	-59	0	0	0	0	111.5	F302 S303 F304 S310	F302-S306 PolarHBondContact O-N 3.48Å; F302-S306 PolarHBondContact O-OG 3.16Å; S303-S306 PolarHBondContact O-N 3.2Å; F304-S306 VanDerWaalsContact C-N 3.29Å; F304-S306 PolarHBondContact O-N 3.39Å; S306-S310 VanDerWaalsContact O-CB 3.24Å; S306-S310 WeakPolarHBondContact O-CB 3.49Å; S306-S310 PolarHBondContact O-N 2.98Å
307	F	30.1	Very low	28.5	Very low	123 Å²	123	102.9 Å²	102.9	54%	0.539	54%	0.542	S	S	.	.	H	α-helix	trans	-64.8	-47.9	175	179.4	-99.3	0	0	0	112.1	S303 F304 E305 K309 S310 C311	S303-F307 VanDerWaalsContact O-CB 3.31Å; S303-F307 WeakPolarHBondContact O-CB 3.39Å; S303-F307 PolarHBondContact O-N 2.76Å; F304-F307 WeakPolarHBondContact O-CB 3.41Å; F304-F307 PolarHBondContact O-N 3.47Å; E305-F307 VanDerWaalsContact C-N 3.29Å; E305-F307 PolarHBondContact O-N 2.66Å; F307-K309 PolarHBondContact O-N 3.41Å; F307-S310 PolarHBondContact O-N 3.08Å; F307-C311 PolarHBondContact O-N 3.47Å; F307-C311 PolarHBondContact O-SG 2.86Å; F307-C311 VanDerWaalsContact O-SG 3.39Å
308	V	31.4	Very low	29.1	Very low	82 Å²	82	102.5 Å²	102.5	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-63	-43.6	177	175.8	0	0	0	0	111.1	F304 E305 C311 A312	F304-V308 HydrophobicContact CD1-CG2 4.22Å; F304-V308 HydrophobicContact CE1-CG2 4.12Å; F304-V308 WeakPolarHBondContact O-CG2 3.5Å; F304-V308 PolarHBondContact O-N 2.84Å; E305-V308 PolarHBondContact O-N 3.03Å; V308-C311 PolarHBondContact O-N 2.85Å; V308-A312 WeakPolarHBondContact O-CB 3.04Å; V308-A312 PolarHBondContact O-N 3.05Å
309	K	31.7	Very low	29.5	Very low	143 Å²	143	97.2 Å²	97.2	62%	0.622	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-40.8	176	-74.7	173.9	179.4	166.4	0	111.9	E305 F307 A312 F313	E305-K309 WeakPolarHBondContact O-CB 3.12Å; E305-K309 WeakPolarHBondContact O-CG 3.37Å; E305-K309 PolarHBondContact O-N 3.29Å; F307-K309 PolarHBondContact O-N 3.41Å; K309-A312 PolarHBondContact O-N 3.25Å; K309-F313 WeakPolarHBondContact O-CB 3.01Å; K309-F313 PolarHBondContact O-N 2.91Å
310	S	29	Very low	29.7	Very low	69 Å²	69	95.5 Å²	95.5	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-66.4	-45.4	177.7	-166	0	0	0	0	111.4	S306 F307 A312 F313 T314	S306-S310 VanDerWaalsContact O-CB 3.24Å; S306-S310 WeakPolarHBondContact O-CB 3.49Å; S306-S310 PolarHBondContact O-N 2.98Å; F307-S310 PolarHBondContact O-N 3.08Å; S310-A312 VanDerWaalsContact C-N 3.35Å; S310-A312 PolarHBondContact O-N 2.65Å; S310-F313 PolarHBondContact O-N 3.28Å; S310-T314 PolarHBondContact O-N 2.94Å; S310-T314 PolarHBondContact O-OG1 3.19Å
311	C	31.4	Very low	30.3	Very low	65 Å²	65	99.2 Å²	99.2	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-61.4	-42.1	176.7	-72	0	0	0	0	112.2	F307 V308 T314 A315	F307-C311 PolarHBondContact O-N 3.47Å; F307-C311 PolarHBondContact O-SG 2.86Å; F307-C311 VanDerWaalsContact O-SG 3.39Å; V308-C311 PolarHBondContact O-N 2.85Å; C311-T314 PolarHBondContact O-N 2.81Å; C311-A315 WeakPolarHBondContact O-CB 3.47Å; C311-A315 PolarHBondContact O-N 3.04Å
312	A	32.5	Very low	31.2	Very low	63 Å²	63	103.7 Å²	103.7	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-63.6	-41.9	175.2	0	0	0	0	0	111.9	V308 K309 S310 Y316	V308-A312 WeakPolarHBondContact O-CB 3.04Å; V308-A312 PolarHBondContact O-N 3.05Å; K309-A312 PolarHBondContact O-N 3.25Å; S310-A312 VanDerWaalsContact C-N 3.35Å; S310-A312 PolarHBondContact O-N 2.65Å; A312-Y316 WeakPolarHBondContact O-CB 3.27Å; A312-Y316 PolarHBondContact O-N 3.2Å
313	F	31.1	Very low	32.4	Very low	138 Å²	138	107.7 Å²	107.7	61%	0.605	55%	0.547	S	S	*	.	H	α-helix	trans	-66.9	-43.4	177.5	-172.3	-99.9	0	0	0	112.1	K309 S310 A315 Y316 V317	K309-F313 WeakPolarHBondContact O-CB 3.01Å; K309-F313 PolarHBondContact O-N 2.91Å; S310-F313 PolarHBondContact O-N 3.28Å; F313-A315 PolarHBondContact O-N 3.33Å; F313-Y316 WeakPolarHBondContact O-CB 3.47Å; F313-Y316 PolarHBondContact O-N 3.46Å; F313-V317 HydrophobicContact CD1-CG2 3.98Å; F313-V317 HydrophobicContact CE1-CG2 3.62Å; F313-V317 HydrophobicContact CE2-CG2 4.42Å; F313-V317 HydrophobicContact CZ-CG2 3.86Å; F313-V317 WeakPolarHBondContact O-CG2 3.39Å; F313-V317 PolarHBondContact O-N 2.65Å
314	T	34.2	Very low	33.3	Very low	71 Å²	71	110.1 Å²	110.1	44%	0.436	58%	0.584	S	S	.	*	H	α-helix	trans	-64.4	-41.8	177.2	-43.6	0	0	0	0	111.2	S310 C311 Y316 V317 I318	S310-T314 PolarHBondContact O-N 2.94Å; S310-T314 PolarHBondContact O-OG1 3.19Å; C311-T314 PolarHBondContact O-N 2.81Å; T314-Y316 VanDerWaalsContact C-N 3.32Å; T314-Y316 PolarHBondContact O-N 3.3Å; T314-V317 PolarHBondContact O-N 2.86Å; T314-I318 HydrophobicContact CG2-CD1 4.04Å; T314-I318 WeakPolarHBondContact O-CB 2.9Å; T314-I318 VanDerWaalsContact O-CG1 3.23Å; T314-I318 WeakPolarHBondContact O-CG1 2.72Å; T314-I318 PolarHBondContact O-N 2.98Å
315	A	33.5	Very low	33.6	Very low	60 Å²	60	108.5 Å²	108.5	50%	0.496	58%	0.582	S	S	.	*	H	α-helix	trans	-61.2	-41	174.2	0	0	0	0	0	111.9	C311 F313 A319	C311-A315 WeakPolarHBondContact O-CB 3.47Å; C311-A315 PolarHBondContact O-N 3.04Å; F313-A315 PolarHBondContact O-N 3.33Å; A315-A319 WeakPolarHBondContact O-CB 3.43Å; A315-A319 PolarHBondContact O-N 3.24Å
316	Y	32.2	Very low	33.8	Very low	145 Å²	145	108.1 Å²	108.1	57%	0.569	58%	0.584	S	S	*	*	H	α-helix	trans	-65.1	-43.7	176.1	-178.9	-103.5	0	0	0	112.7	A312 F313 T314 A319 L320	A312-Y316 WeakPolarHBondContact O-CB 3.27Å; A312-Y316 PolarHBondContact O-N 3.2Å; F313-Y316 WeakPolarHBondContact O-CB 3.47Å; F313-Y316 PolarHBondContact O-N 3.46Å; T314-Y316 VanDerWaalsContact C-N 3.32Å; T314-Y316 PolarHBondContact O-N 3.3Å; Y316-A319 PolarHBondContact O-N 3.22Å; Y316-L320 HydrophobicContact CD1-CD1 3.82Å; Y316-L320 HydrophobicContact CE1-CD1 3.28Å; Y316-L320 HydrophobicContact CE1-CG 4.12Å; Y316-L320 PolarHBondContact O-N 2.77Å
317	V	29.5	Very low	34.1	Very low	47 Å²	47	110.1 Å²	110.1	29%	0.285	59%	0.588	S	S	.	*	H	α-helix	trans	-63.9	-43.5	176.7	171.9	0	0	0	0	111.1	F313 T314 A319 L320 F321	F313-V317 HydrophobicContact CD1-CG2 3.98Å; F313-V317 HydrophobicContact CE1-CG2 3.62Å; F313-V317 HydrophobicContact CE2-CG2 4.42Å; F313-V317 HydrophobicContact CZ-CG2 3.86Å; F313-V317 WeakPolarHBondContact O-CG2 3.39Å; F313-V317 PolarHBondContact O-N 2.65Å; T314-V317 PolarHBondContact O-N 2.86Å; V317-A319 VanDerWaalsContact C-N 3.29Å; V317-A319 PolarHBondContact O-N 2.92Å; V317-L320 PolarHBondContact O-N 3.01Å; V317-F321 HydrophobicContact CG1-CD2 3.8Å; V317-F321 HydrophobicContact CG1-CE2 3.89Å; V317-F321 WeakPolarHBondContact O-CD2 3.22Å; V317-F321 PolarHBondContact O-N 3.17Å
318	I	37.9	Very low	34.4	Very low	91 Å²	91	109.3 Å²	109.3	47%	0.467	59%	0.591	S	S	.	*	H	α-helix	trans	-62	-39	175.8	-67.9	166.4	0	0	0	110.9	T314 R322	T314-I318 HydrophobicContact CG2-CD1 4.04Å; T314-I318 WeakPolarHBondContact O-CB 2.9Å; T314-I318 VanDerWaalsContact O-CG1 3.23Å; T314-I318 WeakPolarHBondContact O-CG1 2.72Å; T314-I318 PolarHBondContact O-N 2.98Å; I318-R322 PolarHBondContact O-N 2.73Å
319	A	31.9	Very low	34.6	Very low	52 Å²	52	111 Å²	111	43%	0.43	60%	0.597	S	S	.	*	H	α-helix	trans	-66.6	-37	176.7	0	0	0	0	0	112.6	A315 Y316 V317 R322	A315-A319 WeakPolarHBondContact O-CB 3.43Å; A315-A319 PolarHBondContact O-N 3.24Å; Y316-A319 PolarHBondContact O-N 3.22Å; V317-A319 VanDerWaalsContact C-N 3.29Å; V317-A319 PolarHBondContact O-N 2.92Å; A319-R322 PolarHBondContact O-N 3.4Å
320	L	28.2	Very low	34.7	Very low	92 Å²	92	108.9 Å²	108.9	48%	0.482	60%	0.595	S	S	.	*	H	α-helix	trans	-67	-44.3	175.5	-79.6	171.9	0	0	0	112.3	Y316 V317 R322 R323 G324	Y316-L320 HydrophobicContact CD1-CD1 3.82Å; Y316-L320 HydrophobicContact CE1-CD1 3.28Å; Y316-L320 HydrophobicContact CE1-CG 4.12Å; Y316-L320 PolarHBondContact O-N 2.77Å; V317-L320 PolarHBondContact O-N 3.01Å; L320-R322 PolarHBondContact O-N 2.75Å; L320-R323 PolarHBondContact O-N 3.14Å; L320-R323 VanDerWaalsContact O-N 3.11Å; L320-G324 PolarHBondContact O-N 3.37Å
321	F	34	Very low	35.2	Very low	169 Å²	169	111.7 Å²	111.7	74%	0.741	60%	0.603	S	S	*	*	H	α-helix	trans	-66.8	-17.2	177.6	-88.8	-76.6	0	0	0	114	V317	V317-F321 HydrophobicContact CG1-CD2 3.8Å; V317-F321 HydrophobicContact CG1-CE2 3.89Å; V317-F321 WeakPolarHBondContact O-CD2 3.22Å; V317-F321 PolarHBondContact O-N 3.17Å
322	R	43.7	Very low	35.4	Very low	210 Å²	210	115.3 Å²	115.3	79%	0.792	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-7.3	174.4	-77.7	-174	174.6	-178.5	0.1	114.2	I318 A319 L320	I318-R322 PolarHBondContact O-N 2.73Å; A319-R322 PolarHBondContact O-N 3.4Å; L320-R322 PolarHBondContact O-N 2.75Å
323	R	47	Very low	35.7	Very low	235 Å²	235	119.7 Å²	119.7	89%	0.887	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-7.5	179.1	-77.6	-170.7	176.8	-177.8	0.6	114.3	L320	L320-R323 PolarHBondContact O-N 3.14Å; L320-R323 VanDerWaalsContact O-N 3.11Å
324	G	45.1	Very low	36.1	Very low	126 Å²	126	118 Å²	118	100%	1.299	63%	0.626	S	S	*	*			trans	-97.9	0	169.8	0	0	0	0	0	110.9	L320	L320-G324 PolarHBondContact O-N 3.37Å

Retrieved 324 of 324 residues in 156.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).