YH070_YEAST Loading...

Putative uncharacterized protein YHR070C-A

AlphaFold DB , UniProt , Accession A0A023PYH0, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 136 aa.

						>YH070_YEAST|A0A023PYH0
MTHRAVPCQPRAFSKIKVLVISFLFLMVAFLPFSSHGKLQEQIASYVSWKLETRAIHRFGGCNFAHQMQRNGIQRKIVCSDLERGNNTGMNACMQLVLSDLVARRVLLKTVHVHPWHLDGISGAFSVCCKDATEVS
					

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(Predicted Aligned Error values between residue pairs)

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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	39.2	Very low	33.4	Very low	228 Å²	228	157.9 Å²	157.9	100%	1.123	83%	0.827	S	S	*	*				0	122.5	0	-71.9	176.7	178.5	0	0	108.7	H3	M1-H3 PolarHBondContact O-N 3.26Å
2	T	31.7	Very low	34.4	Very low	147 Å²	147	152.8 Å²	152.8	90%	0.902	82%	0.824	S	S	*	*			trans	-81.3	110.1	177.8	37	0	0	0	0	109.5	R4	T2-R4 PolarHBondContact O-N 2.93Å
3	H	29.8	Very low	35.6	Very low	183 Å²	183	149 Å²	149	85%	0.847	80%	0.796	S	S	*	*			trans	-71.8	114.6	175.7	-74.9	-89.3	0	0	0	109.8	M1 A5	M1-H3 PolarHBondContact O-N 3.26Å; H3-A5 PolarHBondContact O-N 3.37Å
4	R	24.8	Very low	37.1	Very low	239 Å²	239	142.6 Å²	142.6	90%	0.902	77%	0.768	S	S	*	*			trans	-70.2	122.9	165.7	-94.1	-178.1	171.6	167.3	-1.9	108.8	T2 V6	T2-R4 PolarHBondContact O-N 2.93Å; R4-V6 PolarHBondContact O-N 2.94Å
5	A	28.9	Very low	39.1	Very low	99 Å²	99	145.5 Å²	145.5	82%	0.818	77%	0.771	S	S	*	*			trans	-62.1	115.7	165.9	0	0	0	0	0	108.9	H3 P7	H3-A5 PolarHBondContact O-N 3.37Å; A5-P7 WeakPolarHBondContact O-CD 3.34Å
6	V	31.4	Very low	41.3	Very low	128 Å²	128	143.9 Å²	143.9	78%	0.776	76%	0.761	S	S	*	*			trans	-86.9	115.8	170.4	180	0	0	0	0	107.1	R4 C8	R4-V6 PolarHBondContact O-N 2.94Å; V6-C8 PolarHBondContact O-N 2.89Å
7	P	32.4	Very low	42.8	Very low	102 Å²	102	143.1 Å²	143.1	66%	0.662	75%	0.75	S	S	*	*			trans	-65.3	129.5	173.9	25.9	-31.2	0	0	0	108.9	A5 Q9	A5-P7 WeakPolarHBondContact O-CD 3.34Å; P7-Q9 VanDerWaalsContact C-N 3.33Å; P7-Q9 PolarHBondContact O-N 2.94Å
8	C	33.3	Very low	44.1	Very low	109 Å²	109	139.4 Å²	139.4	74%	0.736	73%	0.734	S	S	*	*			trans	-61.2	99.5	166.1	-73.6	0	0	0	0	107.8	V6	V6-C8 PolarHBondContact O-N 2.89Å
9	Q	32.7	Very low	45.6	Very low	173 Å²	173	138.7 Å²	138.7	81%	0.808	73%	0.73	S	S	*	*			trans	-57	127.4	171.8	-83.9	-147.8	-21.5	0	0	108.2	P7 R11	P7-Q9 VanDerWaalsContact C-N 3.33Å; P7-Q9 PolarHBondContact O-N 2.94Å; Q9-R11 PolarHBondContact O-N 3.25Å
10	P	39.3	Very low	47	Very low	101 Å²	101	135.8 Å²	135.8	66%	0.656	72%	0.718	S	S	*	*			trans	-58	116.8	168	24.7	-30.6	0	0	0	105.8	A12	P10-A12 PolarHBondContact O-N 3.27Å
11	R	44.4	Very low	48.3	Very low	228 Å²	228	133.4 Å²	133.4	86%	0.86	71%	0.705	S	S	*	*			trans	-49.7	112.5	166.3	-85.7	-174.4	174	-174.2	-1.8	105.7	Q9 F13	Q9-R11 PolarHBondContact O-N 3.25Å; R11-F13 PolarHBondContact O-N 2.58Å
12	A	44.6	Very low	49.9	Very low	97 Å²	97	125.6 Å²	125.6	80%	0.802	67%	0.672	S	S	*	*			trans	-51.5	109.9	175.7	0	0	0	0	0	106.3	P10 S14	P10-A12 PolarHBondContact O-N 3.27Å; A12-S14 PolarHBondContact O-N 2.81Å
13	F	50.8	Low	52	Low	103 Å²	103	124.1 Å²	124.1	45%	0.452	65%	0.654	S	S	.	*			trans	-61.2	114.8	168.5	-80.7	-77.8	0	0	0	104.9	R11 K15 K17 V18	R11-F13 PolarHBondContact O-N 2.58Å; F13-K15 PolarHBondContact O-N 3Å; F13-K17 HydrophobicContact CD1-CB 4.36Å; F13-K17 HydrophobicContact CD1-CD 4.42Å; F13-V18 HydrophobicContact CB-CG2 3.95Å
14	S	55.8	Low	54.1	Low	59 Å²	59	120.2 Å²	120.2	41%	0.413	64%	0.639	S	S	.	*			trans	-47.5	131.2	168.3	171.9	0	0	0	0	107.4	A12 I16 K17	A12-S14 PolarHBondContact O-N 2.81Å; S14-I16 PolarHBondContact O-N 3.27Å; S14-K17 WeakPolarHBondContact O-CB 3.42Å; S14-K17 PolarHBondContact O-N 3.06Å
15	K	67.8	Low	56.2	Low	187 Å²	187	114.1 Å²	114.1	81%	0.813	62%	0.619	S	S	*	*	H	α-helix	trans	-48.1	-31	-179.2	-66.7	-179.6	178.4	179.4	0	111.6	F13 V18 L19	F13-K15 PolarHBondContact O-N 3Å; K15-V18 PolarHBondContact O-N 3.35Å; K15-L19 WeakPolarHBondContact O-CB 3.22Å; K15-L19 PolarHBondContact O-N 2.57Å; K15-L19 VanDerWaalsContact O-N 3.08Å
16	I	74.6	Confident	58.4	Low	119 Å²	119	114.2 Å²	114.2	61%	0.61	61%	0.605	S	S	*	*	H	α-helix	trans	-59.1	-44.5	174.3	-59.5	168.3	0	0	0	112.2	S14 V18 L19 V20	S14-I16 PolarHBondContact O-N 3.27Å; I16-V18 VanDerWaalsContact C-N 3.34Å; I16-V18 PolarHBondContact O-N 3.17Å; I16-L19 PolarHBondContact O-N 3.32Å; I16-V20 HydrophobicContact CG2-CG2 4.38Å; I16-V20 VanDerWaalsContact O-CG2 3.28Å; I16-V20 WeakPolarHBondContact O-CG2 2.96Å; I16-V20 PolarHBondContact O-N 3.46Å
17	K	65.8	Low	60.3	Low	131 Å²	131	113 Å²	113	57%	0.57	59%	0.592	S	S	*	*	H	α-helix	trans	-66.6	-35.9	-179.3	-71	-173.6	177.3	179.5	0	112.3	F13 S14 I21	F13-K17 HydrophobicContact CD1-CB 4.36Å; F13-K17 HydrophobicContact CD1-CD 4.42Å; S14-K17 WeakPolarHBondContact O-CB 3.42Å; S14-K17 PolarHBondContact O-N 3.06Å; K17-I21 WeakPolarHBondContact O-CD1 3.16Å; K17-I21 VanDerWaalsContact O-CG1 3.27Å; K17-I21 WeakPolarHBondContact O-CG1 3.35Å; K17-I21 PolarHBondContact O-N 3.43Å
18	V	66.8	Low	61.8	Low	77 Å²	77	110 Å²	110	47%	0.467	57%	0.572	S	S	.	*	H	α-helix	trans	-66.6	-44.3	174.9	-177.9	0	0	0	0	109.8	F13 K15 I16 V20 I21 S22	F13-V18 HydrophobicContact CB-CG2 3.95Å; K15-V18 PolarHBondContact O-N 3.35Å; I16-V18 VanDerWaalsContact C-N 3.34Å; I16-V18 PolarHBondContact O-N 3.17Å; V18-V20 PolarHBondContact O-N 2.74Å; V18-I21 PolarHBondContact O-N 2.08Å; V18-S22 PolarHBondContact O-N 2.81Å; V18-S22 PolarHBondContact O-OG 3.2Å; V18-S22 VanDerWaalsContact O-OG 3.13Å
19	L	71.6	Confident	63.3	Low	126 Å²	126	107.9 Å²	107.9	66%	0.66	56%	0.562	S	S	*	*	H	α-helix	trans	-64	-40.3	-179.8	-151.5	143.1	0	0	0	112.5	K15 I16 S22 F23	K15-L19 WeakPolarHBondContact O-CB 3.22Å; K15-L19 PolarHBondContact O-N 2.57Å; K15-L19 VanDerWaalsContact O-N 3.08Å; I16-L19 PolarHBondContact O-N 3.32Å; L19-S22 PolarHBondContact O-N 3.27Å; L19-F23 WeakPolarHBondContact O-CB 3.38Å; L19-F23 PolarHBondContact O-N 3.03Å
20	V	74.9	Confident	64.8	Low	79 Å²	79	107.5 Å²	107.5	48%	0.479	56%	0.558	S	S	.	*	H	α-helix	trans	-63.9	-43.6	175.1	171.6	0	0	0	0	111.7	I16 V18 F23 L24	I16-V20 HydrophobicContact CG2-CG2 4.38Å; I16-V20 VanDerWaalsContact O-CG2 3.28Å; I16-V20 WeakPolarHBondContact O-CG2 2.96Å; I16-V20 PolarHBondContact O-N 3.46Å; V18-V20 PolarHBondContact O-N 2.74Å; V20-F23 PolarHBondContact O-N 3.41Å; V20-L24 HydrophobicContact CG1-CD1 4.11Å; V20-L24 WeakPolarHBondContact O-CG 3.48Å; V20-L24 PolarHBondContact O-N 3.39Å
21	I	73.3	Confident	65.7	Low	86 Å²	86	107.4 Å²	107.4	44%	0.441	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-46.1	178	-67.8	166.7	0	0	0	110	K17 V18 F23 L24 F25	K17-I21 WeakPolarHBondContact O-CD1 3.16Å; K17-I21 VanDerWaalsContact O-CG1 3.27Å; K17-I21 WeakPolarHBondContact O-CG1 3.35Å; K17-I21 PolarHBondContact O-N 3.43Å; V18-I21 PolarHBondContact O-N 2.08Å; I21-F23 VanDerWaalsContact C-N 3.3Å; I21-F23 PolarHBondContact O-N 2.86Å; I21-L24 WeakPolarHBondContact O-CB 3.15Å; I21-L24 PolarHBondContact O-N 2.04Å; I21-F25 HydrophobicContact CG2-CD2 3.86Å; I21-F25 HydrophobicContact CG2-CE2 3.81Å; I21-F25 WeakPolarHBondContact O-CD2 3.48Å; I21-F25 PolarHBondContact O-N 2.93Å
22	S	72.6	Confident	66.2	Low	64 Å²	64	101.6 Å²	101.6	45%	0.448	54%	0.543	S	S	.	.	H	α-helix	trans	-59.6	-39.7	177	-61.3	0	0	0	0	112.7	V18 L19 F25 L26	V18-S22 PolarHBondContact O-N 2.81Å; V18-S22 PolarHBondContact O-OG 3.2Å; V18-S22 VanDerWaalsContact O-OG 3.13Å; L19-S22 PolarHBondContact O-N 3.27Å; S22-F25 PolarHBondContact O-N 3.26Å; S22-L26 PolarHBondContact O-N 3.34Å; S22-L26 VanDerWaalsContact O-N 3.09Å
23	F	76.8	Confident	66.5	Low	117 Å²	117	105 Å²	105	51%	0.513	54%	0.54	S	S	.	.	H	α-helix	trans	-66	-39.5	176.5	-169.9	-96.9	0	0	0	112.5	L19 V20 I21 F25 L26 M27	L19-F23 WeakPolarHBondContact O-CB 3.38Å; L19-F23 PolarHBondContact O-N 3.03Å; V20-F23 PolarHBondContact O-N 3.41Å; I21-F23 VanDerWaalsContact C-N 3.3Å; I21-F23 PolarHBondContact O-N 2.86Å; F23-F25 PolarHBondContact O-N 3Å; F23-L26 PolarHBondContact O-N 3.1Å; F23-M27 HydrophobicContact CD1-CG 4.08Å; F23-M27 HydrophobicContact CE1-CE 3.71Å; F23-M27 HydrophobicContact CE1-CG 3.79Å; F23-M27 HydrophobicContact CE2-CE 3.93Å; F23-M27 HydrophobicContact CZ-CE 3.27Å; F23-M27 HydrophobicContact CZ-CG 4.29Å; F23-M27 WeakPolarHBondContact O-CG 3.1Å; F23-M27 PolarHBondContact O-N 3.13Å
24	L	73.4	Confident	66.6	Low	101 Å²	101	105.1 Å²	105.1	53%	0.529	55%	0.554	S	S	.	*	H	α-helix	trans	-62.7	-40.7	174.6	-74.9	165.3	0	0	0	111.9	V20 I21 M27 V28	V20-L24 HydrophobicContact CG1-CD1 4.11Å; V20-L24 WeakPolarHBondContact O-CG 3.48Å; V20-L24 PolarHBondContact O-N 3.39Å; I21-L24 WeakPolarHBondContact O-CB 3.15Å; I21-L24 PolarHBondContact O-N 2.04Å; L24-M27 PolarHBondContact O-N 3.15Å; L24-V28 VanDerWaalsContact O-CG2 3.25Å; L24-V28 WeakPolarHBondContact O-CG2 3.2Å; L24-V28 PolarHBondContact O-N 3.45Å
25	F	69.8	Low	66.4	Low	111 Å²	111	107 Å²	107	49%	0.487	57%	0.567	S	S	.	*	H	α-helix	trans	-62.9	-41.6	174.8	-90.3	-85	0	0	0	112.4	I21 S22 F23 V28 A29 I43	I21-F25 HydrophobicContact CG2-CD2 3.86Å; I21-F25 HydrophobicContact CG2-CE2 3.81Å; I21-F25 WeakPolarHBondContact O-CD2 3.48Å; I21-F25 PolarHBondContact O-N 2.93Å; S22-F25 PolarHBondContact O-N 3.26Å; F23-F25 PolarHBondContact O-N 3Å; F25-V28 PolarHBondContact O-N 3.01Å; F25-A29 PolarHBondContact O-N 2.76Å; F25-A29 VanDerWaalsContact O-N 3.09Å; F25-I43 HydrophobicContact CE1-CG2 4.03Å; F25-I43 HydrophobicContact CZ-CG2 3.6Å
26	L	74	Confident	65.5	Low	100 Å²	100	99.5 Å²	99.5	52%	0.524	54%	0.535	S	S	.	.	H	α-helix	trans	-61.7	-47.1	175.2	-100	151.2	0	0	0	111.7	S22 F23 V28 A29 F30	S22-L26 PolarHBondContact O-N 3.34Å; S22-L26 VanDerWaalsContact O-N 3.09Å; F23-L26 PolarHBondContact O-N 3.1Å; L26-V28 VanDerWaalsContact C-N 3.33Å; L26-V28 PolarHBondContact O-N 2.93Å; L26-A29 WeakPolarHBondContact O-CB 3.25Å; L26-A29 PolarHBondContact O-N 2.81Å; L26-A29 VanDerWaalsContact O-N 3.13Å; L26-F30 HydrophobicContact CD2-CE2 3.8Å; L26-F30 WeakPolarHBondContact O-CD2 3.15Å; L26-F30 PolarHBondContact O-N 2.92Å
27	M	71.7	Confident	64.1	Low	102 Å²	102	96.5 Å²	96.5	50%	0.502	53%	0.534	S	S	.	.	H	α-helix	trans	-62.9	-38.7	178.8	-75.3	-67.3	161.6	0	0	112.8	F23 L24 A29 F30	F23-M27 HydrophobicContact CD1-CG 4.08Å; F23-M27 HydrophobicContact CE1-CE 3.71Å; F23-M27 HydrophobicContact CE1-CG 3.79Å; F23-M27 HydrophobicContact CE2-CE 3.93Å; F23-M27 HydrophobicContact CZ-CE 3.27Å; F23-M27 HydrophobicContact CZ-CG 4.29Å; F23-M27 WeakPolarHBondContact O-CG 3.1Å; F23-M27 PolarHBondContact O-N 3.13Å; L24-M27 PolarHBondContact O-N 3.15Å; M27-A29 VanDerWaalsContact C-N 3.3Å; M27-A29 PolarHBondContact O-N 2.87Å; M27-F30 PolarHBondContact O-N 3.18Å
28	V	64.4	Low	63.3	Low	41 Å²	41	98.5 Å²	98.5	25%	0.248	54%	0.543	C	S	.	.	H	α-helix	trans	-66.8	-32.7	176.1	173.6	0	0	0	0	111.1	L24 F25 L26 F30 L31 H36	L24-V28 VanDerWaalsContact O-CG2 3.25Å; L24-V28 WeakPolarHBondContact O-CG2 3.2Å; L24-V28 PolarHBondContact O-N 3.45Å; F25-V28 PolarHBondContact O-N 3.01Å; L26-V28 VanDerWaalsContact C-N 3.33Å; L26-V28 PolarHBondContact O-N 2.93Å; V28-F30 VanDerWaalsContact C-N 3.27Å; V28-F30 PolarHBondContact O-N 3.23Å; V28-L31 PolarHBondContact O-N 3.26Å; V28-H36 PolarHBondContact O-CE1 3.4Å
29	A	63.6	Low	62.2	Low	64 Å²	64	99.1 Å²	99.1	53%	0.529	54%	0.543	S	S	.	.	H	α-helix	trans	-68.9	-19.6	178.5	0	0	0	0	0	114.5	F25 L26 M27	F25-A29 PolarHBondContact O-N 2.76Å; F25-A29 VanDerWaalsContact O-N 3.09Å; L26-A29 WeakPolarHBondContact O-CB 3.25Å; L26-A29 PolarHBondContact O-N 2.81Å; L26-A29 VanDerWaalsContact O-N 3.13Å; M27-A29 VanDerWaalsContact C-N 3.3Å; M27-A29 PolarHBondContact O-N 2.87Å
30	F	65.1	Low	60.9	Low	164 Å²	164	99.2 Å²	99.2	72%	0.719	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	0.4	179.2	-70.7	-73.3	0	0	0	114.4	L26 M27 V28	L26-F30 HydrophobicContact CD2-CE2 3.8Å; L26-F30 WeakPolarHBondContact O-CD2 3.15Å; L26-F30 PolarHBondContact O-N 2.92Å; M27-F30 PolarHBondContact O-N 3.18Å; V28-F30 VanDerWaalsContact C-N 3.27Å; V28-F30 PolarHBondContact O-N 3.23Å
31	L	57.8	Low	59.4	Low	99 Å²	99	101 Å²	101	52%	0.518	54%	0.543	S	S	.	.	S	Bend	trans	-78.4	134.2	175.5	-73.8	166.3	0	0	0	110.6	V28 F33	V28-L31 PolarHBondContact O-N 3.26Å; L31-F33 PolarHBondContact O-N 3.47Å
32	P	54.1	Low	57.9	Low	106 Å²	106	103 Å²	103	69%	0.688	55%	0.55	S	S	*	*			trans	-61.3	126.1	-176.3	21	-30.2	0	0	0	112.5	S34	P32-S34 PolarHBondContact O-N 3.4Å
33	F	52.1	Low	56.6	Low	168 Å²	168	102.6 Å²	102.6	74%	0.737	54%	0.543	S	S	*	.	S	Bend	trans	-62.7	74.3	-170.3	-83.9	-101.6	0	0	0	115.3	L31 H36	L31-F33 PolarHBondContact O-N 3.47Å; F33-H36 HydrophobicContact CD1-CB 4.32Å
34	S	51.9	Low	54.8	Low	107 Å²	107	99.9 Å²	99.9	75%	0.748	54%	0.542	S	S	*	.	S	Bend	trans	-127.3	1.7	171.1	52.2	0	0	0	0	115	P32	P32-S34 PolarHBondContact O-N 3.4Å
35	S	51.4	Low	53.1	Low	98 Å²	98	97.3 Å²	97.3	69%	0.685	53%	0.532	S	S	*	.	S	Bend	trans	-146.3	11.8	178.9	-42.2	0	0	0	0	115.1	G37	S35-G37 PolarHBondContact O-N 3.02Å
36	H	50.1	Low	51.5	Low	29 Å²	29	97.4 Å²	97.4	13%	0.134	53%	0.53	C	S	.	.	H	α-helix	trans	-73.1	-25.8	-163.8	-93.4	-95.7	0	0	0	116.6	V28 F33 K38 L39 Q40	V28-H36 PolarHBondContact O-CE1 3.4Å; F33-H36 HydrophobicContact CD1-CB 4.32Å; H36-K38 PolarHBondContact O-N 2.92Å; H36-L39 PolarHBondContact O-N 2.77Å; H36-Q40 PolarHBondContact O-N 2.82Å; H36-Q40 VanDerWaalsContact O-N 3.11Å
37	G	45.1	Very low	49.6	Very low	57 Å²	57	95.6 Å²	95.6	59%	0.588	52%	0.523	S	S	*	.	H	α-helix	trans	-59.2	-45.5	-174.6	0	0	0	0	0	113.4	S35 E41	S35-G37 PolarHBondContact O-N 3.02Å; G37-E41 VanDerWaalsContact O-CB 3.31Å; G37-E41 WeakPolarHBondContact O-CB 3.37Å; G37-E41 PolarHBondContact O-N 2.73Å
38	K	48.8	Very low	47.9	Very low	173 Å²	173	94.4 Å²	94.4	75%	0.752	53%	0.525	S	S	*	.	H	α-helix	trans	-76.2	-33	-176.5	-67.6	-177.2	178.5	177.1	0	113.2	H36 Q42	H36-K38 PolarHBondContact O-N 2.92Å; K38-Q42 WeakPolarHBondContact O-CB 3.08Å; K38-Q42 WeakPolarHBondContact O-CG 3.34Å; K38-Q42 PolarHBondContact O-N 3.05Å; K38-Q42 VanDerWaalsContact O-N 3.1Å
39	L	44.4	Very low	46.4	Very low	89 Å²	89	97.8 Å²	97.8	47%	0.466	53%	0.533	S	S	.	.	H	α-helix	trans	-78	-40.6	-176.5	-152.7	87	0	0	0	111.6	H36 E41 Q42 I43	H36-L39 PolarHBondContact O-N 2.77Å; L39-E41 VanDerWaalsContact C-N 3.33Å; L39-Q42 PolarHBondContact O-N 3.11Å; L39-I43 HydrophobicContact CD2-CD1 4.37Å; L39-I43 HydrophobicContact CG-CD1 4.39Å; L39-I43 VanDerWaalsContact O-CG1 3.3Å; L39-I43 WeakPolarHBondContact O-CG1 3.17Å; L39-I43 PolarHBondContact O-N 2.69Å
40	Q	44.1	Very low	45.2	Very low	128 Å²	128	99.6 Å²	99.6	60%	0.598	53%	0.529	S	S	*	.	H	α-helix	trans	-64.3	-39.8	174.3	-113.4	-175	-14.8	0	0	111.6	H36 Q42 I43 A44	H36-Q40 PolarHBondContact O-N 2.82Å; H36-Q40 VanDerWaalsContact O-N 3.11Å; Q40-Q42 VanDerWaalsContact C-N 3.34Å; Q40-I43 PolarHBondContact O-N 2.78Å; Q40-A44 VanDerWaalsContact O-CB 3.3Å; Q40-A44 WeakPolarHBondContact O-CB 3.44Å; Q40-A44 PolarHBondContact O-N 3.41Å
41	E	43.8	Very low	43.7	Very low	116 Å²	116	97.2 Å²	97.2	54%	0.542	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-37.7	177	-159.7	174.3	-157.9	0	0	111.7	G37 L39 S45	G37-E41 VanDerWaalsContact O-CB 3.31Å; G37-E41 WeakPolarHBondContact O-CB 3.37Å; G37-E41 PolarHBondContact O-N 2.73Å; L39-E41 VanDerWaalsContact C-N 3.33Å; E41-S45 WeakPolarHBondContact O-CB 3.42Å; E41-S45 PolarHBondContact O-N 2.97Å
42	Q	41.7	Very low	42.6	Very low	129 Å²	129	98.4 Å²	98.4	60%	0.603	53%	0.526	S	S	*	.	H	α-helix	trans	-65.7	-44	172.5	-80.3	-173.2	-12.2	0	0	112.8	K38 L39 Q40 S45 Y46	K38-Q42 WeakPolarHBondContact O-CB 3.08Å; K38-Q42 WeakPolarHBondContact O-CG 3.34Å; K38-Q42 PolarHBondContact O-N 3.05Å; K38-Q42 VanDerWaalsContact O-N 3.1Å; L39-Q42 PolarHBondContact O-N 3.11Å; Q40-Q42 VanDerWaalsContact C-N 3.34Å; Q42-S45 PolarHBondContact O-N 2.84Å; Q42-S45 PolarHBondContact O-OG 3.19Å; Q42-Y46 WeakPolarHBondContact O-CB 3.33Å; Q42-Y46 PolarHBondContact O-N 2.62Å
43	I	43.6	Very low	41.8	Very low	55 Å²	55	95.7 Å²	95.7	28%	0.282	51%	0.508	S	S	.	.	H	α-helix	trans	-68.6	-42.2	179.5	-66.1	166.5	0	0	0	110.9	F25 L39 Q40 S45 Y46 V47	F25-I43 HydrophobicContact CE1-CG2 4.03Å; F25-I43 HydrophobicContact CZ-CG2 3.6Å; L39-I43 HydrophobicContact CD2-CD1 4.37Å; L39-I43 HydrophobicContact CG-CD1 4.39Å; L39-I43 VanDerWaalsContact O-CG1 3.3Å; L39-I43 WeakPolarHBondContact O-CG1 3.17Å; L39-I43 PolarHBondContact O-N 2.69Å; Q40-I43 PolarHBondContact O-N 2.78Å; I43-S45 VanDerWaalsContact C-N 3.35Å; I43-S45 PolarHBondContact O-N 2.91Å; I43-Y46 WeakPolarHBondContact O-CB 3.08Å; I43-Y46 PolarHBondContact O-N 3.28Å; I43-Y46 VanDerWaalsContact O-N 3.11Å; I43-V47 HydrophobicContact CG2-CG2 4.26Å; I43-V47 WeakPolarHBondContact O-CG2 3.32Å; I43-V47 PolarHBondContact O-N 3.11Å
44	A	39.2	Very low	40.9	Very low	60 Å²	60	94.3 Å²	94.3	50%	0.496	50%	0.498	S	S	.	.	H	α-helix	trans	-62.2	-42.4	174.8	0	0	0	0	0	111.3	Q40 Y46 V47 S48	Q40-A44 VanDerWaalsContact O-CB 3.3Å; Q40-A44 WeakPolarHBondContact O-CB 3.44Å; Q40-A44 PolarHBondContact O-N 3.41Å; A44-Y46 VanDerWaalsContact C-N 3.27Å; A44-Y46 PolarHBondContact O-N 2.87Å; A44-V47 PolarHBondContact O-N 2.96Å; A44-S48 PolarHBondContact O-N 3.33Å
45	S	39.4	Very low	40.1	Very low	47 Å²	47	92.5 Å²	92.5	33%	0.329	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-38.2	173	90	0	0	0	0	111.6	E41 Q42 I43 W49	E41-S45 WeakPolarHBondContact O-CB 3.42Å; E41-S45 PolarHBondContact O-N 2.97Å; Q42-S45 PolarHBondContact O-N 2.84Å; Q42-S45 PolarHBondContact O-OG 3.19Å; I43-S45 VanDerWaalsContact C-N 3.35Å; I43-S45 PolarHBondContact O-N 2.91Å; S45-W49 WeakPolarHBondContact O-CB 3.48Å; S45-W49 PolarHBondContact O-N 3.16Å; S45-W49 VanDerWaalsContact O-N 3.09Å
46	Y	35.5	Very low	39.7	Very low	114 Å²	114	91.2 Å²	91.2	45%	0.447	47%	0.474	S	S	.	.	H	α-helix	trans	-71.4	-36.9	-179.5	-173.2	-95.6	0	0	0	112.7	Q42 I43 A44 W49 K50	Q42-Y46 WeakPolarHBondContact O-CB 3.33Å; Q42-Y46 PolarHBondContact O-N 2.62Å; I43-Y46 WeakPolarHBondContact O-CB 3.08Å; I43-Y46 PolarHBondContact O-N 3.28Å; I43-Y46 VanDerWaalsContact O-N 3.11Å; A44-Y46 VanDerWaalsContact C-N 3.27Å; A44-Y46 PolarHBondContact O-N 2.87Å; Y46-W49 HydrophobicContact CD2-CE3 4.03Å; Y46-W49 HydrophobicContact CD2-CZ3 4.2Å; Y46-W49 HydrophobicContact CE2-CE3 4.15Å; Y46-W49 AromaticContact CE2-CZ3 3.92Å; Y46-W49 HydrophobicContact CE2-CZ3 3.92Å; Y46-K50 HydrophobicContact CE1-CD 3.84Å; Y46-K50 PolarHBondContact O-N 3.2Å; Y46-K50 VanDerWaalsContact O-N 3.09Å; Y46-K50 PolarHBondContact OH-NZ 2.86Å
47	V	34.4	Very low	39.3	Very low	61 Å²	61	96 Å²	96	37%	0.37	50%	0.496	S	S	.	.	H	α-helix	trans	-76.9	-44.4	-179.7	175.7	0	0	0	0	111.7	I43 A44 W49 K50 L51	I43-V47 HydrophobicContact CG2-CG2 4.26Å; I43-V47 WeakPolarHBondContact O-CG2 3.32Å; I43-V47 PolarHBondContact O-N 3.11Å; A44-V47 PolarHBondContact O-N 2.96Å; V47-W49 VanDerWaalsContact C-N 3.26Å; V47-W49 PolarHBondContact O-N 3.3Å; V47-K50 PolarHBondContact O-N 3.36Å; V47-L51 HydrophobicContact CG1-CD1 4.01Å; V47-L51 PolarHBondContact O-N 3.4Å
48	S	36.3	Very low	39.4	Very low	77 Å²	77	101.7 Å²	101.7	54%	0.538	50%	0.5	S	S	.	.	H	α-helix	trans	-58.1	-42.6	170.9	-80.1	0	0	0	0	111.1	A44 K50 L51 E52	A44-S48 PolarHBondContact O-N 3.33Å; S48-K50 PolarHBondContact O-N 3.09Å; S48-L51 PolarHBondContact O-N 3.21Å; S48-E52 PolarHBondContact O-N 3.06Å
49	W	32.7	Very low	39.3	Very low	113 Å²	113	99.8 Å²	99.8	43%	0.428	49%	0.491	S	S	.	.	H	α-helix	trans	-62	-37.7	178.2	-177.2	62.9	0	0	0	113.8	S45 Y46 V47 L51 T53	S45-W49 WeakPolarHBondContact O-CB 3.48Å; S45-W49 PolarHBondContact O-N 3.16Å; S45-W49 VanDerWaalsContact O-N 3.09Å; Y46-W49 HydrophobicContact CD2-CE3 4.03Å; Y46-W49 HydrophobicContact CD2-CZ3 4.2Å; Y46-W49 HydrophobicContact CE2-CE3 4.15Å; Y46-W49 AromaticContact CE2-CZ3 3.92Å; Y46-W49 HydrophobicContact CE2-CZ3 3.92Å; V47-W49 VanDerWaalsContact C-N 3.26Å; V47-W49 PolarHBondContact O-N 3.3Å; W49-L51 VanDerWaalsContact C-N 3.34Å; W49-T53 WeakPolarHBondContact O-CB 3.26Å; W49-T53 WeakPolarHBondContact O-CG2 3.24Å; W49-T53 PolarHBondContact O-N 3.26Å; W49-T53 PolarHBondContact O-OG1 3.15Å
50	K	37.8	Very low	39.3	Very low	101 Å²	101	99.3 Å²	99.3	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-75.6	-20.6	177.2	-117.3	177.1	178.5	165.8	0	114	Y46 V47 S48 T53	Y46-K50 HydrophobicContact CE1-CD 3.84Å; Y46-K50 PolarHBondContact O-N 3.2Å; Y46-K50 VanDerWaalsContact O-N 3.09Å; Y46-K50 PolarHBondContact OH-NZ 2.86Å; V47-K50 PolarHBondContact O-N 3.36Å; S48-K50 PolarHBondContact O-N 3.09Å; K50-T53 PolarHBondContact O-OG1 3.09Å
51	L	33.2	Very low	39.6	Very low	115 Å²	115	96.4 Å²	96.4	60%	0.602	51%	0.512	S	S	*	.	H	α-helix	trans	-86.3	-41.5	177.5	-79.1	160.3	0	0	0	111.1	V47 S48 W49 R54	V47-L51 HydrophobicContact CG1-CD1 4.01Å; V47-L51 PolarHBondContact O-N 3.4Å; S48-L51 PolarHBondContact O-N 3.21Å; W49-L51 VanDerWaalsContact C-N 3.34Å; L51-R54 PolarHBondContact O-N 3.4Å
52	E	34	Very low	39.9	Very low	124 Å²	124	92.2 Å²	92.2	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-70.6	-34.9	177.9	-106.1	177.1	150	0	0	114	S48 R54 A55	S48-E52 PolarHBondContact O-N 3.06Å; E52-R54 PolarHBondContact O-N 3Å; E52-A55 PolarHBondContact O-N 2.86Å
53	T	37.8	Very low	40.5	Very low	49 Å²	49	89.3 Å²	89.3	30%	0.301	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-3.5	175.7	42.8	0	0	0	0	114.2	W49 K50 I56 I77	W49-T53 WeakPolarHBondContact O-CB 3.26Å; W49-T53 WeakPolarHBondContact O-CG2 3.24Å; W49-T53 PolarHBondContact O-N 3.26Å; W49-T53 PolarHBondContact O-OG1 3.15Å; K50-T53 PolarHBondContact O-OG1 3.09Å; T53-I56 WeakPolarHBondContact O-CD1 3.15Å; T53-I77 HydrophobicContact CG2-CG2 4.3Å
54	R	33.3	Very low	41	Very low	139 Å²	139	89.1 Å²	89.1	53%	0.525	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-9.6	177.5	-69.3	-178.9	173.9	-152	-12.4	114.4	L51 E52	L51-R54 PolarHBondContact O-N 3.4Å; E52-R54 PolarHBondContact O-N 3Å
55	A	34.4	Very low	41.8	Very low	68 Å²	68	87 Å²	87	56%	0.562	46%	0.464	S	S	*	.			trans	-98	17.5	-177.9	0	0	0	0	0	114.2	E52 H57	E52-A55 PolarHBondContact O-N 2.86Å; A55-H57 PolarHBondContact O-CD2 3.38Å; A55-H57 PolarHBondContact O-N 3.17Å; A55-H57 VanDerWaalsContact O-N 3.09Å
56	I	44.4	Very low	42.4	Very low	71 Å²	71	86 Å²	86	36%	0.364	45%	0.454	S	S	.	.			trans	-75.5	104.9	-178.2	-54.8	148.9	0	0	0	109.6	T53 F64 C79	T53-I56 WeakPolarHBondContact O-CD1 3.15Å; I56-F64 HydrophobicContact CG2-CB 4.5Å; I56-C79 HydrophobicContact CD1-CB 3.81Å; I56-C79 WeakPolarHBondContact CD1-SG 3.46Å; I56-C79 HydrophobicContact CG1-CB 4.4Å; I56-C79 HydrophobicContact CG2-CB 3.94Å
57	H	42.4	Very low	43.4	Very low	130 Å²	130	84 Å²	84	60%	0.602	45%	0.449	S	S	*	.			trans	-75.8	128.3	174.6	-70.8	-91.3	0	0	0	110.6	A55 F59 F64	A55-H57 PolarHBondContact O-CD2 3.38Å; A55-H57 PolarHBondContact O-N 3.17Å; A55-H57 VanDerWaalsContact O-N 3.09Å; H57-F59 HydrophobicContact CB-CD2 4.04Å; H57-F59 HydrophobicContact CB-CE2 3.54Å; H57-F59 HydrophobicContact CB-CZ 4.39Å; H57-F64 VanDerWaalsContact O-CE2 3.31Å; H57-F64 WeakPolarHBondContact O-CE2 3.48Å
58	R	45.9	Very low	44.2	Very low	177 Å²	177	83 Å²	83	67%	0.668	44%	0.44	S	S	*	.			trans	-82	119.8	169	-66.3	-178.2	-175.2	-175.1	-4.9	109	D81	R58-D81 IonicContact CZ-OD1 3.23Å; R58-D81 VanDerWaalsContact CZ-OD1 3.23Å; R58-D81 IonicContact CZ-OD2 2.78Å; R58-D81 IonicContact NE-OD2 3.19Å; R58-D81 PolarHBondContact NE-OD2 2.97Å; R58-D81 IonicContact NH1-OD1 3.54Å; R58-D81 IonicContact NH1-OD2 2.84Å; R58-D81 PolarHBondContact NH1-OD2 3.49Å; R58-D81 IonicContact NH2-OD1 2.62Å; R58-D81 PolarHBondContact NH2-OD1 2.95Å; R58-D81 IonicContact NH2-OD2 3.11Å; R58-D81 PolarHBondContact NH2-OD2 3Å; R58-D81 VanDerWaalsContact NH2-OD2 3.11Å
59	F	46.8	Very low	45	Very low	132 Å²	132	82.6 Å²	82.6	58%	0.579	43%	0.43	S	S	*	.			trans	-109.6	134.7	167.8	-71.4	-91.6	0	0	0	108.8	H57 G61 C62 F64	H57-F59 HydrophobicContact CB-CD2 4.04Å; H57-F59 HydrophobicContact CB-CE2 3.54Å; H57-F59 HydrophobicContact CB-CZ 4.39Å; F59-G61 PolarHBondContact O-N 3.49Å; F59-G61 VanDerWaalsContact O-N 3.15Å; F59-C62 PolarHBondContact O-N 2.73Å; F59-F64 HydrophobicContact CB-CE2 4.34Å; F59-F64 HydrophobicContact CB-CZ 4.03Å; F59-F64 HydrophobicContact CD2-CE1 4.45Å; F59-F64 HydrophobicContact CD2-CE2 4.35Å; F59-F64 AromaticContact CD2-CZ 3.66Å; F59-F64 HydrophobicContact CD2-CZ 3.66Å; F59-F64 HydrophobicContact CG-CZ 4.29Å
60	G	45.5	Very low	46.1	Very low	80 Å²	80	82.9 Å²	82.9	83%	0.825	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.7	108.7	-163.3	0	0	0	0	0	116.6	C62	G60-C62 PolarHBondContact O-N 3.29Å
61	G	50.2	Low	47.2	Very low	66 Å²	66	84.3 Å²	84.3	68%	0.68	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	3.8	173.3	0	0	0	0	0	115.8	F59	F59-G61 PolarHBondContact O-N 3.49Å; F59-G61 VanDerWaalsContact O-N 3.15Å
62	C	49.8	Very low	48.1	Very low	28 Å²	28	81.7 Å²	81.7	19%	0.189	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.1	-178.3	-55.4	0	0	0	0	111.9	F59 G60 F64 V127 C128 C129	F59-C62 PolarHBondContact O-N 2.73Å; G60-C62 PolarHBondContact O-N 3.29Å; C62-F64 HydrophobicContact CB-CE2 4.4Å; C62-V127 HydrophobicContact CB-CG1 3.88Å; C62-C128 WeakPolarHBondContact CA-O 3.48Å; C62-C129 HydrophobicContact CB-CB 4.07Å; C62-C129 WeakPolarHBondContact CB-SG 3.43Å; C62-C129 WeakPolarHBondContact SG-CB 3.46Å; C62-C129 CovalentContact SG-SG 2.04Å; C62-C129 PolarHBondContact SG-SG 3.45Å
63	N	54.6	Low	48.9	Very low	68 Å²	68	80.7 Å²	80.7	36%	0.364	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	138.6	174.4	-66.8	-54.3	0	0	0	110.2	V127 C128	N63-V127 WeakPolarHBondContact O-CA 3.36Å; N63-C128 HydrophobicContact CB-CB 4.42Å; N63-C128 PolarHBondContact N-O 3.09Å; N63-C128 PolarHBondContact O-N 3.13Å
64	F	53.9	Low	49.5	Very low	52 Å²	52	83.9 Å²	83.9	23%	0.228	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.3	178.1	-67.4	-95.3	0	0	0	109.9	I56 H57 F59 C62 C79 V127	I56-F64 HydrophobicContact CG2-CB 4.5Å; H57-F64 VanDerWaalsContact O-CE2 3.31Å; H57-F64 WeakPolarHBondContact O-CE2 3.48Å; F59-F64 HydrophobicContact CB-CE2 4.34Å; F59-F64 HydrophobicContact CB-CZ 4.03Å; F59-F64 HydrophobicContact CD2-CE1 4.45Å; F59-F64 HydrophobicContact CD2-CE2 4.35Å; F59-F64 AromaticContact CD2-CZ 3.66Å; F59-F64 HydrophobicContact CD2-CZ 3.66Å; F59-F64 HydrophobicContact CG-CZ 4.29Å; C62-F64 HydrophobicContact CB-CE2 4.4Å; F64-C79 PolarHBondContact O-N 3.42Å; F64-V127 HydrophobicContact CD1-CG1 4.5Å; F64-V127 HydrophobicContact CD1-CG2 3.74Å; F64-V127 HydrophobicContact CE1-CB 4.46Å; F64-V127 HydrophobicContact CE1-CG1 4.07Å; F64-V127 HydrophobicContact CE1-CG2 3.58Å; F64-V127 HydrophobicContact CZ-CG1 4.17Å; F64-V127 HydrophobicContact CZ-CG2 4.47Å
65	A	54.4	Low	50.3	Low	14 Å²	14	85 Å²	85	12%	0.116	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.5	170.3	0	0	0	0	0	109.4	S126	A65-S126 VanDerWaalsContact CB-OG 3.3Å; A65-S126 WeakPolarHBondContact CB-OG 3.31Å; A65-S126 PolarHBondContact N-O 3.49Å; A65-S126 PolarHBondContact O-N 3.35Å; A65-S126 PolarHBondContact O-OG 3.46Å
66	H	52.5	Low	51	Low	28 Å²	28	85.2 Å²	85.2	13%	0.13	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.8	-179.2	179.3	-156.9	0	0	0	108.7	I77 W116 F125	H66-I77 HydrophobicContact CB-CB 4.38Å; H66-I77 PolarHBondContact N-O 2.87Å; H66-I77 CarbonylContact O-C 3.58Å; H66-I77 WeakPolarHBondContact O-CA 3.25Å; H66-I77 PolarHBondContact O-N 3.33Å; H66-W116 AromaticContact CD2-NE1 3.88Å; H66-W116 AromaticContact CE1-CZ2 3.88Å; H66-W116 AromaticContact NE2-CE2 3.55Å; H66-W116 AromaticContact NE2-CZ2 3.31Å; H66-W116 VanDerWaalsContact NE2-CZ2 3.31Å; H66-W116 WeakPolarHBondContact NE2-CZ2 3.46Å; H66-W116 AromaticContact NE2-NE1 3.28Å; H66-W116 PolarHBondContact NE2-NE1 3.02Å; H66-F125 HydrophobicContact CB-CD1 3.95Å; H66-F125 HydrophobicContact CB-CE1 4Å; H66-F125 AromaticContact CD2-CD1 3.51Å; H66-F125 AromaticContact CD2-CE1 3.22Å; H66-F125 WeakPolarHBondContact CD2-CE1 3.37Å; H66-F125 AromaticContact CD2-CZ 3.59Å; H66-F125 AromaticContact CE1-CE1 3.64Å; H66-F125 AromaticContact CE1-CZ 3.68Å; H66-F125 AromaticContact CG-CD1 3.76Å; H66-F125 AromaticContact CG-CE1 3.41Å; H66-F125 VanDerWaalsContact CG-CE1 3.41Å; H66-F125 AromaticContact ND1-CE1 3.69Å; H66-F125 AromaticContact NE2-CE1 3.37Å; H66-F125 WeakPolarHBondContact NE2-CE1 3.28Å; H66-F125 AromaticContact NE2-CE2 3.93Å; H66-F125 AromaticContact NE2-CZ 3.27Å; H66-F125 VanDerWaalsContact NE2-CZ 3.27Å; H66-F125 WeakPolarHBondContact NE2-CZ 3.25Å
67	Q	57	Low	51.2	Low	71 Å²	71	83 Å²	83	33%	0.332	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.3	170.4	-173.6	173.3	-4.8	0	0	108.2	G123 A124	Q67-G123 CarbonylContact O-C 3.56Å; Q67-G123 WeakPolarHBondContact O-CA 3.3Å; Q67-A124 PolarHBondContact N-O 3.3Å; Q67-A124 PolarHBondContact O-N 3.17Å
68	M	51.1	Low	51.1	Low	40 Å²	40	79.3 Å²	79.3	20%	0.197	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.7	178.5	-173.7	-175.7	177.2	0	0	108.3	R75 W116 I121 S122	M68-R75 PolarHBondContact N-O 2.97Å; M68-R75 PolarHBondContact O-N 3.34Å; M68-R75 VanDerWaalsContact O-O 3.08Å; M68-W116 HydrophobicContact CB-CZ2 4.39Å; M68-W116 HydrophobicContact CE-CH2 4.07Å; M68-W116 HydrophobicContact CG-CH2 3.99Å; M68-W116 HydrophobicContact CG-CZ2 3.87Å; M68-W116 HydrophobicContact SD-CH2 4.29Å; M68-W116 HydrophobicContact SD-CZ2 4.4Å; M68-I121 HydrophobicContact CE-CB 4.35Å; M68-I121 HydrophobicContact CE-CD1 3.54Å; M68-I121 HydrophobicContact CE-CG1 4.32Å; M68-I121 HydrophobicContact CE-CG2 3.37Å; M68-I121 HydrophobicContact CG-CG2 3.39Å; M68-I121 HydrophobicContact SD-CG2 4.16Å; M68-S122 CarbonylContact C-O 3.38Å
69	Q	53.1	Low	50.9	Low	69 Å²	69	72.4 Å²	72.4	32%	0.322	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122	178.7	-172.9	173.1	-0.6	0	0	108.6	I73 Q74 I121 S122	Q69-I73 WeakPolarHBondContact CA-O 3.43Å; Q69-Q74 HydrophobicContact CB-CG 4.05Å; Q69-Q74 VanDerWaalsContact CD-CG 3.49Å; Q69-Q74 HydrophobicContact CG-CG 3.72Å; Q69-I121 WeakPolarHBondContact O-CA 3.31Å; Q69-I121 WeakPolarHBondContact O-CG2 3.43Å; Q69-S122 WeakPolarHBondContact CA-O 3.31Å; Q69-S122 PolarHBondContact N-O 3.25Å; Q69-S122 PolarHBondContact O-N 3.44Å
70	R	56.1	Low	50.4	Low	118 Å²	118	68.7 Å²	68.7	45%	0.445	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.1	171.4	-170.7	174.9	-170.6	-167.6	-0.8	108	G72 I73 I121	R70-G72 VanDerWaalsContact C-N 3.34Å; R70-G72 PolarHBondContact O-N 3.09Å; R70-I73 PolarHBondContact N-O 3.1Å; R70-I73 PolarHBondContact O-N 2.98Å; R70-I121 HydrophobicContact CB-CG1 4.24Å; R70-I121 HydrophobicContact CB-CG2 4.48Å; R70-I121 HydrophobicContact CG-CG1 3.92Å
71	N	60.3	Low	50.1	Low	132 Å²	132	69.9 Å²	69.9	71%	0.706	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	43.8	177	-57.3	-11.4	0	0	0	114.1	I73	N71-I73 PolarHBondContact O-N 2.98Å; N71-I73 VanDerWaalsContact O-N 3.16Å
72	G	52.5	Low	49.3	Very low	59 Å²	59	70.4 Å²	70.4	61%	0.608	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	-14.8	-179.5	0	0	0	0	0	115.1	R70 Q74	R70-G72 VanDerWaalsContact C-N 3.34Å; R70-G72 PolarHBondContact O-N 3.09Å; G72-Q74 PolarHBondContact O-N 3.41Å
73	I	51.8	Low	48.5	Very low	103 Å²	103	77.7 Å²	77.7	53%	0.528	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	109.4	177.5	-55.5	175.7	0	0	0	109	Q69 R70 N71 R75	Q69-I73 WeakPolarHBondContact CA-O 3.43Å; R70-I73 PolarHBondContact N-O 3.1Å; R70-I73 PolarHBondContact O-N 2.98Å; N71-I73 PolarHBondContact O-N 2.98Å; N71-I73 VanDerWaalsContact O-N 3.16Å; I73-R75 HydrophobicContact CG2-CG 4.18Å
74	Q	49.6	Very low	47.6	Very low	117 Å²	117	86.5 Å²	86.5	55%	0.547	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.3	170.6	-68	-172.9	-3.7	0	0	110.2	Q69 G72	Q69-Q74 HydrophobicContact CB-CG 4.05Å; Q69-Q74 VanDerWaalsContact CD-CG 3.49Å; Q69-Q74 HydrophobicContact CG-CG 3.72Å; G72-Q74 PolarHBondContact O-N 3.41Å
75	R	50.1	Low	46.6	Very low	161 Å²	161	87.6 Å²	87.6	61%	0.608	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.1	122	170.4	-69	-168.1	173.7	-179.5	-0.3	109.7	M68 I73	M68-R75 PolarHBondContact N-O 2.97Å; M68-R75 PolarHBondContact O-N 3.34Å; M68-R75 VanDerWaalsContact O-O 3.08Å; I73-R75 HydrophobicContact CG2-CG 4.18Å
76	K	49.2	Very low	45.8	Very low	73 Å²	73	91.7 Å²	91.7	32%	0.317	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	115.7	176.5	-173.7	-173.5	177.2	-174.4	0	108.4	V78 M90 M94	K76-V78 HydrophobicContact CD-CG2 4.1Å; K76-V78 HydrophobicContact CG-CG2 3.93Å; K76-M90 PolarHBondContact NZ-O 3.11Å; K76-M94 HydrophobicContact CD-SD 3.58Å; K76-M94 VanDerWaalsContact CD-SD 3.58Å; K76-M94 WeakPolarHBondContact CE-SD 3.37Å; K76-M94 PolarHBondContact NZ-SD 3.5Å
77	I	47.6	Very low	45.2	Very low	24 Å²	24	96.3 Å²	96.3	12%	0.123	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115.1	172	-57	167.6	0	0	0	107	T53 H66	T53-I77 HydrophobicContact CG2-CG2 4.3Å; H66-I77 HydrophobicContact CB-CB 4.38Å; H66-I77 PolarHBondContact N-O 2.87Å; H66-I77 CarbonylContact O-C 3.58Å; H66-I77 WeakPolarHBondContact O-CA 3.25Å; H66-I77 PolarHBondContact O-N 3.33Å
78	V	42	Very low	44.2	Very low	54 Å²	54	97.4 Å²	97.4	33%	0.327	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.1	176.8	-177.9	0	0	0	0	108.2	K76 M90	K76-V78 HydrophobicContact CD-CG2 4.1Å; K76-V78 HydrophobicContact CG-CG2 3.93Å; V78-M90 HydrophobicContact CB-CG 4.33Å; V78-M90 HydrophobicContact CG1-CG 4.31Å; V78-M90 HydrophobicContact CG2-CG 3.7Å; V78-M90 HydrophobicContact CG2-SD 4Å
79	C	40.2	Very low	43.4	Very low	32 Å²	32	97.2 Å²	97.2	22%	0.216	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	79.9	176.7	-57	0	0	0	0	107.2	I56 F64	I56-C79 HydrophobicContact CD1-CB 3.81Å; I56-C79 WeakPolarHBondContact CD1-SG 3.46Å; I56-C79 HydrophobicContact CG1-CB 4.4Å; I56-C79 HydrophobicContact CG2-CB 3.94Å; F64-C79 PolarHBondContact O-N 3.42Å
80	S	37.8	Very low	42.6	Very low	54 Å²	54	97.5 Å²	97.5	38%	0.378	52%	0.517	S	S	.	.			trans	-103.8	138.5	173.2	73	0	0	0	0	110.8	L82	S80-L82 PolarHBondContact O-N 3.37Å; S80-L82 VanDerWaalsContact O-N 3.1Å; S80-L82 WeakPolarHBondContact OG-CB 3.36Å; S80-L82 PolarHBondContact OG-N 3.38Å
81	D	38.7	Very low	41.8	Very low	104 Å²	104	96.3 Å²	96.3	56%	0.556	52%	0.519	S	S	*	.			trans	-71	24.2	157.5	-110.1	-20.4	0	0	0	112.5	R58 E83	R58-D81 IonicContact CZ-OD1 3.23Å; R58-D81 VanDerWaalsContact CZ-OD1 3.23Å; R58-D81 IonicContact CZ-OD2 2.78Å; R58-D81 IonicContact NE-OD2 3.19Å; R58-D81 PolarHBondContact NE-OD2 2.97Å; R58-D81 IonicContact NH1-OD1 3.54Å; R58-D81 IonicContact NH1-OD2 2.84Å; R58-D81 PolarHBondContact NH1-OD2 3.49Å; R58-D81 IonicContact NH2-OD1 2.62Å; R58-D81 PolarHBondContact NH2-OD1 2.95Å; R58-D81 IonicContact NH2-OD2 3.11Å; R58-D81 PolarHBondContact NH2-OD2 3Å; R58-D81 VanDerWaalsContact NH2-OD2 3.11Å; D81-E83 PolarHBondContact O-N 2.94Å; D81-E83 VanDerWaalsContact O-N 3.13Å
82	L	33.9	Very low	40.8	Very low	78 Å²	78	92.2 Å²	92.2	41%	0.408	50%	0.504	S	S	.	.			trans	-74	107.2	164.2	-95.3	85.8	0	0	0	107.9	S80 R84 N86	S80-L82 PolarHBondContact O-N 3.37Å; S80-L82 VanDerWaalsContact O-N 3.1Å; S80-L82 WeakPolarHBondContact OG-CB 3.36Å; S80-L82 PolarHBondContact OG-N 3.38Å; L82-R84 PolarHBondContact O-N 2.84Å; L82-N86 HydrophobicContact CD2-CB 4.01Å
83	E	32.7	Very low	40.1	Very low	180 Å²	180	90.8 Å²	90.8	84%	0.841	49%	0.485	S	S	*	.			trans	-31.8	113.4	153	-64.9	-174	142.8	0	0	110.2	D81 G85	D81-E83 PolarHBondContact O-N 2.94Å; D81-E83 VanDerWaalsContact O-N 3.13Å; E83-G85 PolarHBondContact O-N 2.87Å
84	R	34.7	Very low	39.5	Very low	254 Å²	254	90 Å²	90	96%	0.958	48%	0.48	S	S	*	.	S	Bend	trans	35.7	86.4	148.2	-141.7	173.6	-170.2	174	-0.4	114.9	L82	L82-R84 PolarHBondContact O-N 2.84Å
85	G	34.2	Very low	38.9	Very low	75 Å²	75	90.4 Å²	90.4	77%	0.773	48%	0.482	S	S	*	.			trans	104.1	12.6	144.9	0	0	0	0	0	118.6	E83	E83-G85 PolarHBondContact O-N 2.87Å
86	N	36.6	Very low	38.1	Very low	100 Å²	100	84.8 Å²	84.8	54%	0.535	46%	0.463	S	S	.	.			trans	-104.1	88.7	176.9	-148.3	-5.1	0	0	0	112.2	L82 T88	L82-N86 HydrophobicContact CD2-CB 4.01Å; N86-T88 PolarHBondContact O-N 2.83Å; N86-T88 WeakPolarHBondContact OD1-CB 3.01Å; N86-T88 PolarHBondContact OD1-OG1 3.44Å
87	N	39.6	Very low	37.5	Very low	124 Å²	124	84.1 Å²	84.1	66%	0.663	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-10	173.5	-69.8	-22.8	0	0	0	113.5	M90	N87-M90 WeakPolarHBondContact O-CB 3.46Å; N87-M90 PolarHBondContact O-N 3.11Å
88	T	37.3	Very low	36.8	Very low	95 Å²	95	89.7 Å²	89.7	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-69.8	-34.9	-175.5	-39.1	0	0	0	0	113.2	N86 M90 A92	N86-T88 PolarHBondContact O-N 2.83Å; N86-T88 WeakPolarHBondContact OD1-CB 3.01Å; N86-T88 PolarHBondContact OD1-OG1 3.44Å; T88-M90 PolarHBondContact O-N 2.86Å; T88-A92 PolarHBondContact O-N 3.36Å
89	G	33.9	Very low	36.4	Very low	36 Å²	36	90 Å²	90	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-67.4	-24.8	174.5	0	0	0	0	0	113.2	A92 C93	G89-A92 PolarHBondContact O-N 2.99Å; G89-C93 PolarHBondContact O-N 3.13Å
90	M	36.2	Very low	36.1	Very low	75 Å²	75	91.3 Å²	91.3	37%	0.369	50%	0.504	S	S	.	.	H	α-helix	trans	-73.5	-30.8	-175.8	-144.4	-174.8	79	0	0	113.3	K76 V78 N87 T88	K76-M90 PolarHBondContact NZ-O 3.11Å; V78-M90 HydrophobicContact CB-CG 4.33Å; V78-M90 HydrophobicContact CG1-CG 4.31Å; V78-M90 HydrophobicContact CG2-CG 3.7Å; V78-M90 HydrophobicContact CG2-SD 4Å; N87-M90 WeakPolarHBondContact O-CB 3.46Å; N87-M90 PolarHBondContact O-N 3.11Å; T88-M90 PolarHBondContact O-N 2.86Å
91	N	38.9	Very low	35.9	Very low	92 Å²	92	96.1 Å²	96.1	49%	0.492	52%	0.524	S	S	.	.	H	α-helix	trans	-82.1	-34.3	173.7	-75.9	-9.8	0	0	0	111.1	M94 Q95	N91-M94 PolarHBondContact O-N 3.41Å; N91-Q95 WeakPolarHBondContact O-CA 3.22Å; N91-Q95 WeakPolarHBondContact O-CB 3.44Å; N91-Q95 WeakPolarHBondContact O-CG 3.37Å; N91-Q95 PolarHBondContact O-N 3.36Å
92	A	38.5	Very low	35.8	Very low	46 Å²	46	97.6 Å²	97.6	38%	0.38	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-55	179.8	0	0	0	0	0	112.7	T88 G89 M94 L96	T88-A92 PolarHBondContact O-N 3.36Å; G89-A92 PolarHBondContact O-N 2.99Å; A92-M94 VanDerWaalsContact C-N 3.26Å; A92-M94 PolarHBondContact O-N 3.22Å; A92-L96 VanDerWaalsContact O-CB 3.25Å; A92-L96 WeakPolarHBondContact O-CB 3.14Å; A92-L96 WeakPolarHBondContact O-CD1 3.27Å; A92-L96 WeakPolarHBondContact O-CG 3.36Å; A92-L96 PolarHBondContact O-N 3.34Å
93	C	38.3	Very low	35.7	Very low	30 Å²	30	97 Å²	97	20%	0.203	54%	0.543	C	S	.	.	H	α-helix	trans	-68	-23.3	-178.9	167.9	0	0	0	0	112.5	G89 V97 C128	G89-C93 PolarHBondContact O-N 3.13Å; C93-V97 WeakPolarHBondContact O-CG2 3.31Å; C93-C128 HydrophobicContact CB-CB 4.23Å; C93-C128 WeakPolarHBondContact CB-SG 3.12Å; C93-C128 WeakPolarHBondContact SG-CB 3.27Å; C93-C128 CovalentContact SG-SG 2.08Å; C93-C128 PolarHBondContact SG-SG 3.41Å
94	M	39.5	Very low	35.6	Very low	86 Å²	86	99.3 Å²	99.3	42%	0.424	54%	0.544	S	S	.	.	H	α-helix	trans	-93.9	-32.1	178.8	-152.5	177.5	98.4	0	0	114.2	K76 N91 A92 L96	K76-M94 HydrophobicContact CD-SD 3.58Å; K76-M94 VanDerWaalsContact CD-SD 3.58Å; K76-M94 WeakPolarHBondContact CE-SD 3.37Å; K76-M94 PolarHBondContact NZ-SD 3.5Å; N91-M94 PolarHBondContact O-N 3.41Å; A92-M94 VanDerWaalsContact C-N 3.26Å; A92-M94 PolarHBondContact O-N 3.22Å; M94-L96 VanDerWaalsContact C-N 3.34Å
95	Q	36.2	Very low	35.5	Very low	126 Å²	126	98.2 Å²	98.2	59%	0.589	54%	0.54	S	S	*	.	H	α-helix	trans	-67.5	-38.3	169.2	-79.2	-178.7	-50.8	0	0	110	N91 V97 L98 S99	N91-Q95 WeakPolarHBondContact O-CA 3.22Å; N91-Q95 WeakPolarHBondContact O-CB 3.44Å; N91-Q95 WeakPolarHBondContact O-CG 3.37Å; N91-Q95 PolarHBondContact O-N 3.36Å; Q95-V97 VanDerWaalsContact C-N 3.29Å; Q95-V97 PolarHBondContact O-N 3.05Å; Q95-L98 CarbonylContact O-C 3.56Å; Q95-L98 PolarHBondContact O-N 3.4Å; Q95-S99 VanDerWaalsContact C-OG 3.32Å; Q95-S99 WeakPolarHBondContact O-CB 3.5Å; Q95-S99 PolarHBondContact O-N 3.44Å; Q95-S99 PolarHBondContact O-OG 2.96Å
96	L	34.4	Very low	35.6	Very low	43 Å²	43	98.9 Å²	98.9	23%	0.225	53%	0.529	C	S	.	.	H	α-helix	trans	-63.3	-33.7	177.9	-72	161.3	0	0	0	112	A92 M94 L98 D100 V106 L108	A92-L96 VanDerWaalsContact O-CB 3.25Å; A92-L96 WeakPolarHBondContact O-CB 3.14Å; A92-L96 WeakPolarHBondContact O-CD1 3.27Å; A92-L96 WeakPolarHBondContact O-CG 3.36Å; A92-L96 PolarHBondContact O-N 3.34Å; M94-L96 VanDerWaalsContact C-N 3.34Å; L96-L98 VanDerWaalsContact C-N 3.26Å; L96-L98 PolarHBondContact O-N 3.02Å; L96-D100 HydrophobicContact CB-CB 4.48Å; L96-D100 HydrophobicContact CD2-CB 4.31Å; L96-D100 WeakPolarHBondContact O-CA 3.12Å; L96-D100 WeakPolarHBondContact O-CB 3.43Å; L96-D100 PolarHBondContact O-N 3.36Å; L96-V106 HydrophobicContact CD2-CB 4.37Å; L96-L108 HydrophobicContact CD1-CD1 3.55Å
97	V	35.6	Very low	35.6	Very low	58 Å²	58	99.8 Å²	99.8	35%	0.352	53%	0.533	S	S	.	.	H	α-helix	trans	-65.8	-26.7	174.3	175.6	0	0	0	0	113.3	C93 Q95 V111	C93-V97 WeakPolarHBondContact O-CG2 3.31Å; Q95-V97 VanDerWaalsContact C-N 3.29Å; Q95-V97 PolarHBondContact O-N 3.05Å; V97-V111 HydrophobicContact CG2-CG1 3.89Å; V97-V111 HydrophobicContact CG2-CG2 4.12Å
98	L	34	Very low	35.9	Very low	142 Å²	142	96.1 Å²	96.1	74%	0.743	51%	0.513	S	S	*	.	H	α-helix	trans	-103	-16.1	-178.8	-79.9	154.6	0	0	0	114.1	Q95 L96	Q95-L98 CarbonylContact O-C 3.56Å; Q95-L98 PolarHBondContact O-N 3.4Å; L96-L98 VanDerWaalsContact C-N 3.26Å; L96-L98 PolarHBondContact O-N 3.02Å
99	S	32.8	Very low	36.4	Very low	60 Å²	60	99.4 Å²	99.4	42%	0.42	52%	0.519	S	S	.	.	H	α-helix	trans	-117.2	-14.5	-177.3	54.5	0	0	0	0	114.7	Q95 V102 A103	Q95-S99 VanDerWaalsContact C-OG 3.32Å; Q95-S99 WeakPolarHBondContact O-CB 3.5Å; Q95-S99 PolarHBondContact O-N 3.44Å; Q95-S99 PolarHBondContact O-OG 2.96Å; S99-V102 PolarHBondContact O-N 3.19Å; S99-A103 PolarHBondContact O-N 3.29Å
100	D	34.3	Very low	37	Very low	59 Å²	59	100.8 Å²	100.8	32%	0.316	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.9	-179.2	-143.4	-0.6	0	0	0	113.3	L96	L96-D100 HydrophobicContact CB-CB 4.48Å; L96-D100 HydrophobicContact CD2-CB 4.31Å; L96-D100 WeakPolarHBondContact O-CA 3.12Å; L96-D100 WeakPolarHBondContact O-CB 3.43Å; L96-D100 PolarHBondContact O-N 3.36Å
101	L	34.1	Very low	37.6	Very low	155 Å²	155	100 Å²	100	81%	0.812	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-11.6	160.6	-91.9	156	0	0	0	112.4
102	V	36.5	Very low	38.2	Very low	136 Å²	136	100.5 Å²	100.5	82%	0.824	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-19.7	-172.6	-177	0	0	0	0	113.4	S99	S99-V102 PolarHBondContact O-N 3.19Å
103	A	31.7	Very low	38.7	Very low	64 Å²	64	102.1 Å²	102.1	53%	0.529	52%	0.524	S	S	.	.	S	Bend	trans	-135.3	84.9	-170.5	0	0	0	0	0	115	S99	S99-A103 PolarHBondContact O-N 3.29Å
104	R	29.8	Very low	39.2	Very low	230 Å²	230	106.1 Å²	106.1	87%	0.868	54%	0.54	S	S	*	.			trans	0.4	119.9	150.2	-79.1	176.9	167.2	177	-3	116.6
105	R	32.1	Very low	39.8	Very low	230 Å²	230	107.2 Å²	107.2	87%	0.868	55%	0.553	S	S	*	*			trans	101.4	49	147.4	-59.3	174.2	179.4	-177.4	0.2	119.7
106	V	36.6	Very low	40.8	Very low	89 Å²	89	104 Å²	104	54%	0.539	54%	0.536	S	S	.	.			trans	-130.6	120.2	149.8	-176.7	0	0	0	0	109.8	L96 L108	L96-V106 HydrophobicContact CD2-CB 4.37Å; V106-L108 PolarHBondContact O-N 3.18Å
107	L	36.9	Very low	41.6	Very low	120 Å²	120	108.1 Å²	108.1	63%	0.628	55%	0.553	S	S	*	*			trans	-72.1	85.7	-174.7	-72.3	151.6	0	0	0	112.3	D131	L107-D131 HydrophobicContact CB-CB 4.25Å; L107-D131 WeakPolarHBondContact CB-OD2 3.42Å; L107-D131 WeakPolarHBondContact CD1-OD2 3.49Å; L107-D131 WeakPolarHBondContact CD2-OD2 3.17Å; L107-D131 WeakPolarHBondContact CG-OD2 3.43Å
108	L	45.6	Very low	42.2	Very low	46 Å²	46	110.5 Å²	110.5	24%	0.241	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	95.6	159	-75.7	169	0	0	0	107	L96 V106 T110 C128 C129	L96-L108 HydrophobicContact CD1-CD1 3.55Å; V106-L108 PolarHBondContact O-N 3.18Å; L108-T110 VanDerWaalsContact C-N 3.27Å; L108-T110 PolarHBondContact O-N 3.39Å; L108-T110 VanDerWaalsContact O-N 3.17Å; L108-C128 HydrophobicContact CD2-CB 4.42Å; L108-C129 WeakPolarHBondContact CD2-O 2.99Å
109	K	47.9	Very low	43.4	Very low	164 Å²	164	110.5 Å²	110.5	71%	0.713	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.8	-6.5	-159.2	-148.6	170.7	-176.6	173.9	0	115.8
110	T	47	Very low	44.4	Very low	65 Å²	65	109.7 Å²	109.7	40%	0.399	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-162.4	120.4	177.2	2.8	0	0	0	0	110.6	L108 H112	L108-T110 VanDerWaalsContact C-N 3.27Å; L108-T110 PolarHBondContact O-N 3.39Å; L108-T110 VanDerWaalsContact O-N 3.17Å; T110-H112 WeakPolarHBondContact CG2-NE2 3.34Å
111	V	49.9	Very low	45.2	Very low	58 Å²	58	107.9 Å²	107.9	35%	0.352	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	103.4	162.3	-178.1	0	0	0	0	106.8	V97 V113 V127	V97-V111 HydrophobicContact CG2-CG1 3.89Å; V97-V111 HydrophobicContact CG2-CG2 4.12Å; V111-V113 HydrophobicContact CG1-CG2 3.87Å; V111-V127 WeakPolarHBondContact CA-O 3.49Å
112	H	49.6	Very low	46.1	Very low	103 Å²	103	103 Å²	103	48%	0.477	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	115.8	167.8	-71.9	-74.3	0	0	0	108.6	T110 S126	T110-H112 WeakPolarHBondContact CG2-NE2 3.34Å; H112-S126 WeakPolarHBondContact O-CA 3.49Å
113	V	50.9	Low	47.1	Very low	80 Å²	80	97 Å²	97	49%	0.485	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	108.5	170.5	-174.3	0	0	0	0	108.2	V111 P115 A124 F125	V111-V113 HydrophobicContact CG1-CG2 3.87Å; V113-P115 VanDerWaalsContact O-CD 3.26Å; V113-P115 WeakPolarHBondContact O-CD 3.38Å; V113-A124 HydrophobicContact CG1-CB 3.88Å; V113-F125 VanDerWaalsContact CA-O 3.24Å; V113-F125 WeakPolarHBondContact CA-O 3.49Å
114	H	48.4	Very low	48.1	Very low	115 Å²	115	95.1 Å²	95.1	53%	0.532	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	100.8	173.7	-72.5	-74.3	0	0	0	109.6	A124 F125	H114-A124 WeakPolarHBondContact O-CA 3.49Å; H114-F125 PolarHBondContact N-O 3.32Å; H114-F125 PolarHBondContact O-N 3.42Å
115	P	51.9	Low	49.4	Very low	109 Å²	109	88.5 Å²	88.5	71%	0.708	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	138	170.2	29.4	-32.9	0	0	0	108.9	V113 G123	V113-P115 VanDerWaalsContact O-CD 3.26Å; V113-P115 WeakPolarHBondContact O-CD 3.38Å; P115-G123 CarbonylContact C-O 3.56Å; P115-G123 VanDerWaalsContact CA-O 3.25Å; P115-G123 WeakPolarHBondContact CA-O 3.27Å
116	W	56.5	Low	50.5	Low	58 Å²	58	78.8 Å²	78.8	22%	0.22	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.5	172.2	61.4	-85.2	0	0	0	109.4	H66 M68 L118 I121 S122 G123 F125	H66-W116 AromaticContact CD2-NE1 3.88Å; H66-W116 AromaticContact CE1-CZ2 3.88Å; H66-W116 AromaticContact NE2-CE2 3.55Å; H66-W116 AromaticContact NE2-CZ2 3.31Å; H66-W116 VanDerWaalsContact NE2-CZ2 3.31Å; H66-W116 WeakPolarHBondContact NE2-CZ2 3.46Å; H66-W116 AromaticContact NE2-NE1 3.28Å; H66-W116 PolarHBondContact NE2-NE1 3.02Å; M68-W116 HydrophobicContact CB-CZ2 4.39Å; M68-W116 HydrophobicContact CE-CH2 4.07Å; M68-W116 HydrophobicContact CG-CH2 3.99Å; M68-W116 HydrophobicContact CG-CZ2 3.87Å; M68-W116 HydrophobicContact SD-CH2 4.29Å; M68-W116 HydrophobicContact SD-CZ2 4.4Å; W116-L118 HydrophobicContact CE3-CB 4.01Å; W116-L118 HydrophobicContact CZ3-CB 3.9Å; W116-I121 HydrophobicContact CH2-CB 4.19Å; W116-I121 HydrophobicContact CH2-CG2 3.52Å; W116-I121 HydrophobicContact CZ2-CG2 4.34Å; W116-I121 HydrophobicContact CZ3-CB 4.05Å; W116-I121 HydrophobicContact CZ3-CG2 3.87Å; W116-S122 CarbonylContact O-C 3.57Å; W116-S122 WeakPolarHBondContact O-CA 3.45Å; W116-G123 VanDerWaalsContact CD1-C 3.42Å; W116-G123 PolarHBondContact N-O 2.88Å; W116-G123 VanDerWaalsContact NE1-C 3.35Å; W116-G123 VanDerWaalsContact NE1-CA 3.34Å; W116-G123 PolarHBondContact O-N 2.92Å; W116-F125 AromaticContact CD1-CD2 3.51Å; W116-F125 AromaticContact CD1-CE2 3.21Å; W116-F125 HydrophobicContact CD2-CE2 4.49Å; W116-F125 HydrophobicContact CG-CE2 4.02Å; W116-F125 AromaticContact NE1-CD2 3.71Å; W116-F125 AromaticContact NE1-CE2 3.18Å; W116-F125 AromaticContact NE1-CZ 3.75Å
117	H	52.1	Low	51.3	Low	129 Å²	129	76.1 Å²	76.1	60%	0.597	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	121.3	174.6	-162.5	71.6	0	0	0	109.2	I121 S122	H117-I121 VanDerWaalsContact CA-O 3.27Å; H117-I121 WeakPolarHBondContact CA-O 3.34Å; H117-I121 PolarHBondContact ND1-O 3.08Å; H117-S122 PolarHBondContact CE1-OG 2.76Å; H117-S122 PolarHBondContact ND1-OG 3.37Å
118	L	48	Very low	52.1	Low	109 Å²	109	70.5 Å²	70.5	57%	0.571	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	127.8	177	-157.4	93.5	0	0	0	108.5	W116 G120 I121	W116-L118 HydrophobicContact CE3-CB 4.01Å; W116-L118 HydrophobicContact CZ3-CB 3.9Å; L118-G120 VanDerWaalsContact C-N 3.32Å; L118-G120 PolarHBondContact O-N 3.46Å; L118-G120 VanDerWaalsContact O-N 3.15Å; L118-I121 PolarHBondContact N-O 3.13Å; L118-I121 WeakPolarHBondContact O-CA 3.35Å; L118-I121 WeakPolarHBondContact O-CB 3.3Å; L118-I121 WeakPolarHBondContact O-CG1 3.3Å; L118-I121 PolarHBondContact O-N 2.93Å
119	D	58.2	Low	52.4	Low	141 Å²	141	69.8 Å²	69.8	75%	0.754	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	44.1	172.5	-59.6	-29.9	0	0	0	115.5	I121	D119-I121 VanDerWaalsContact C-N 3.26Å; D119-I121 PolarHBondContact O-N 3.25Å
120	G	54.7	Low	52.5	Low	44 Å²	44	70 Å²	70	45%	0.454	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	13.6	-179.6	0	0	0	0	0	114.3	L118	L118-G120 VanDerWaalsContact C-N 3.32Å; L118-G120 PolarHBondContact O-N 3.46Å; L118-G120 VanDerWaalsContact O-N 3.15Å
121	I	50.3	Low	52.6	Low	21 Å²	21	68.7 Å²	68.7	11%	0.108	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121	176.8	-49.8	175.7	0	0	0	107.9	M68 Q69 R70 W116 H117 L118 D119	M68-I121 HydrophobicContact CE-CB 4.35Å; M68-I121 HydrophobicContact CE-CD1 3.54Å; M68-I121 HydrophobicContact CE-CG1 4.32Å; M68-I121 HydrophobicContact CE-CG2 3.37Å; M68-I121 HydrophobicContact CG-CG2 3.39Å; M68-I121 HydrophobicContact SD-CG2 4.16Å; Q69-I121 WeakPolarHBondContact O-CA 3.31Å; Q69-I121 WeakPolarHBondContact O-CG2 3.43Å; R70-I121 HydrophobicContact CB-CG1 4.24Å; R70-I121 HydrophobicContact CB-CG2 4.48Å; R70-I121 HydrophobicContact CG-CG1 3.92Å; W116-I121 HydrophobicContact CH2-CB 4.19Å; W116-I121 HydrophobicContact CH2-CG2 3.52Å; W116-I121 HydrophobicContact CZ2-CG2 4.34Å; W116-I121 HydrophobicContact CZ3-CB 4.05Å; W116-I121 HydrophobicContact CZ3-CG2 3.87Å; H117-I121 VanDerWaalsContact CA-O 3.27Å; H117-I121 WeakPolarHBondContact CA-O 3.34Å; H117-I121 PolarHBondContact ND1-O 3.08Å; L118-I121 PolarHBondContact N-O 3.13Å; L118-I121 WeakPolarHBondContact O-CA 3.35Å; L118-I121 WeakPolarHBondContact O-CB 3.3Å; L118-I121 WeakPolarHBondContact O-CG1 3.3Å; L118-I121 PolarHBondContact O-N 2.93Å; D119-I121 VanDerWaalsContact C-N 3.26Å; D119-I121 PolarHBondContact O-N 3.25Å
122	S	53.6	Low	51.9	Low	53 Å²	53	70.5 Å²	70.5	37%	0.371	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.8	170.1	-61.3	0	0	0	0	109	M68 Q69 W116 H117	M68-S122 CarbonylContact C-O 3.38Å; Q69-S122 WeakPolarHBondContact CA-O 3.31Å; Q69-S122 PolarHBondContact N-O 3.25Å; Q69-S122 PolarHBondContact O-N 3.44Å; W116-S122 CarbonylContact O-C 3.57Å; W116-S122 WeakPolarHBondContact O-CA 3.45Å; H117-S122 PolarHBondContact CE1-OG 2.76Å; H117-S122 PolarHBondContact ND1-OG 3.37Å
123	G	57.3	Low	51.3	Low	10 Å²	10	71.3 Å²	71.3	10%	0.103	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	171.8	172.8	0	0	0	0	0	112.7	Q67 P115 W116	Q67-G123 CarbonylContact O-C 3.56Å; Q67-G123 WeakPolarHBondContact O-CA 3.3Å; P115-G123 CarbonylContact C-O 3.56Å; P115-G123 VanDerWaalsContact CA-O 3.25Å; P115-G123 WeakPolarHBondContact CA-O 3.27Å; W116-G123 VanDerWaalsContact CD1-C 3.42Å; W116-G123 PolarHBondContact N-O 2.88Å; W116-G123 VanDerWaalsContact NE1-C 3.35Å; W116-G123 VanDerWaalsContact NE1-CA 3.34Å; W116-G123 PolarHBondContact O-N 2.92Å
124	A	53.8	Low	50.4	Low	23 Å²	23	75.5 Å²	75.5	19%	0.19	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.1	177	0	0	0	0	0	108.4	Q67 V113 H114	Q67-A124 PolarHBondContact N-O 3.3Å; Q67-A124 PolarHBondContact O-N 3.17Å; V113-A124 HydrophobicContact CG1-CB 3.88Å; H114-A124 WeakPolarHBondContact O-CA 3.49Å
125	F	56.6	Low	49.4	Very low	91 Å²	91	77 Å²	77	40%	0.399	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	138.5	165.3	-64.6	-82.7	0	0	0	108.7	H66 V113 H114 W116	H66-F125 HydrophobicContact CB-CD1 3.95Å; H66-F125 HydrophobicContact CB-CE1 4Å; H66-F125 AromaticContact CD2-CD1 3.51Å; H66-F125 AromaticContact CD2-CE1 3.22Å; H66-F125 WeakPolarHBondContact CD2-CE1 3.37Å; H66-F125 AromaticContact CD2-CZ 3.59Å; H66-F125 AromaticContact CE1-CE1 3.64Å; H66-F125 AromaticContact CE1-CZ 3.68Å; H66-F125 AromaticContact CG-CD1 3.76Å; H66-F125 AromaticContact CG-CE1 3.41Å; H66-F125 VanDerWaalsContact CG-CE1 3.41Å; H66-F125 AromaticContact ND1-CE1 3.69Å; H66-F125 AromaticContact NE2-CE1 3.37Å; H66-F125 WeakPolarHBondContact NE2-CE1 3.28Å; H66-F125 AromaticContact NE2-CE2 3.93Å; H66-F125 AromaticContact NE2-CZ 3.27Å; H66-F125 VanDerWaalsContact NE2-CZ 3.27Å; H66-F125 WeakPolarHBondContact NE2-CZ 3.25Å; V113-F125 VanDerWaalsContact CA-O 3.24Å; V113-F125 WeakPolarHBondContact CA-O 3.49Å; H114-F125 PolarHBondContact N-O 3.32Å; H114-F125 PolarHBondContact O-N 3.42Å; W116-F125 AromaticContact CD1-CD2 3.51Å; W116-F125 AromaticContact CD1-CE2 3.21Å; W116-F125 HydrophobicContact CD2-CE2 4.49Å; W116-F125 HydrophobicContact CG-CE2 4.02Å; W116-F125 AromaticContact NE1-CD2 3.71Å; W116-F125 AromaticContact NE1-CE2 3.18Å; W116-F125 AromaticContact NE1-CZ 3.75Å
126	S	53.8	Low	48.4	Very low	27 Å²	27	80.1 Å²	80.1	19%	0.189	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.3	172.7	56.1	0	0	0	0	108.9	A65 H112	A65-S126 VanDerWaalsContact CB-OG 3.3Å; A65-S126 WeakPolarHBondContact CB-OG 3.31Å; A65-S126 PolarHBondContact N-O 3.49Å; A65-S126 PolarHBondContact O-N 3.35Å; A65-S126 PolarHBondContact O-OG 3.46Å; H112-S126 WeakPolarHBondContact O-CA 3.49Å
127	V	54.7	Low	48	Very low	32 Å²	32	81.2 Å²	81.2	19%	0.194	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	122.9	175.6	-174.4	0	0	0	0	106.7	C62 N63 F64 V111	C62-V127 HydrophobicContact CB-CG1 3.88Å; N63-V127 WeakPolarHBondContact O-CA 3.36Å; F64-V127 HydrophobicContact CD1-CG1 4.5Å; F64-V127 HydrophobicContact CD1-CG2 3.74Å; F64-V127 HydrophobicContact CE1-CB 4.46Å; F64-V127 HydrophobicContact CE1-CG1 4.07Å; F64-V127 HydrophobicContact CE1-CG2 3.58Å; F64-V127 HydrophobicContact CZ-CG1 4.17Å; F64-V127 HydrophobicContact CZ-CG2 4.47Å; V111-V127 WeakPolarHBondContact CA-O 3.49Å
128	C	52.7	Low	47.8	Very low	2 Å²	2	78.7 Å²	78.7	1%	0.014	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	106.3	176	-81.4	0	0	0	0	107.6	C62 N63 C93 L108	C62-C128 WeakPolarHBondContact CA-O 3.48Å; N63-C128 HydrophobicContact CB-CB 4.42Å; N63-C128 PolarHBondContact N-O 3.09Å; N63-C128 PolarHBondContact O-N 3.13Å; C93-C128 HydrophobicContact CB-CB 4.23Å; C93-C128 WeakPolarHBondContact CB-SG 3.12Å; C93-C128 WeakPolarHBondContact SG-CB 3.27Å; C93-C128 CovalentContact SG-SG 2.08Å; C93-C128 PolarHBondContact SG-SG 3.41Å; L108-C128 HydrophobicContact CD2-CB 4.42Å
129	C	51.6	Low	47.8	Very low	31 Å²	31	77 Å²	77	21%	0.209	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.5	173.1	-59.6	0	0	0	0	110	C62 L108	C62-C129 HydrophobicContact CB-CB 4.07Å; C62-C129 WeakPolarHBondContact CB-SG 3.43Å; C62-C129 WeakPolarHBondContact SG-CB 3.46Å; C62-C129 CovalentContact SG-SG 2.04Å; C62-C129 PolarHBondContact SG-SG 3.45Å; L108-C129 WeakPolarHBondContact CD2-O 2.99Å
130	K	49.9	Very low	47.2	Very low	169 Å²	169	73.2 Å²	73.2	74%	0.735	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	135.6	165.6	-167	176.7	-178.5	-177.1	0	107.4	A132	K130-A132 PolarHBondContact O-N 2.96Å
131	D	48.9	Very low	46.7	Very low	37 Å²	37	75.1 Å²	75.1	20%	0.198	45%	0.446	C	S	.	.			trans	-40.7	124.5	-179.1	-108.6	3.5	0	0	0	112.3	L107 T133	L107-D131 HydrophobicContact CB-CB 4.25Å; L107-D131 WeakPolarHBondContact CB-OD2 3.42Å; L107-D131 WeakPolarHBondContact CD1-OD2 3.49Å; L107-D131 WeakPolarHBondContact CD2-OD2 3.17Å; L107-D131 WeakPolarHBondContact CG-OD2 3.43Å; D131-T133 PolarHBondContact O-N 3.09Å
132	A	36.4	Very low	46.5	Very low	97 Å²	97	78.7 Å²	78.7	80%	0.802	47%	0.468	S	S	*	.			trans	-69	77.3	157.9	0	0	0	0	0	106.9	K130 E134	K130-A132 PolarHBondContact O-N 2.96Å; A132-E134 PolarHBondContact O-N 3.3Å
133	T	37.3	Very low	46	Very low	119 Å²	119	80.5 Å²	80.5	73%	0.73	48%	0.475	S	S	*	.			trans	-59	104.3	167.1	21.9	0	0	0	0	108.2	D131	D131-T133 PolarHBondContact O-N 3.09Å
134	E	30.7	Very low	45.1	Very low	169 Å²	169	85.9 Å²	85.9	79%	0.79	50%	0.504	S	S	*	.			trans	46.1	94.3	159.7	-66.7	177.9	166.5	0	0	117.3	A132 S136	A132-E134 PolarHBondContact O-N 3.3Å; E134-S136 PolarHBondContact O-N 2.97Å
135	V	28.2	Very low	44.4	Very low	147 Å²	147	91.2 Å²	91.2	89%	0.891	53%	0.53	S	S	*	.			trans	-75.4	97.2	148.9	-164.9	0	0	0	0	106.3
136	S	31.5	Very low	43.3	Very low	173 Å²	173	91.2 Å²	91.2	100%	1.21	54%	0.542	S	S	*	.			trans	-97.1	0	156.9	-62.9	0	0	0	0	109.3	E134	E134-S136 PolarHBondContact O-N 2.97Å

Retrieved 136 of 136 residues in 21.4 ms (Link to these results)

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