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ATP synthase F(1) complex subunit delta, mitochondrial

Subunit delta, of the mitochondrial membrane ATP synthase complex (F(1)F(0) ATP synthase or Complex V) that produces ATP from ADP in the presence of a proton gradient across the membrane which is generated by electron transport complexes of the respiratory chain. ATP synthase complex consist of a soluble F(1) head domain - the catalytic core - and a membrane F(1) domain - the membrane proton channel. These two domains are linked by a central stalk rotating inside the F(1) region and a stationary peripheral stalk. During catalysis, ATP synthesis in the catalytic domain of F(1) is coupled via a rotary mechanism of the central stalk subunits to proton translocation. In vivo, can only synthesize ATP although its ATP hydrolase activity can be activated artificially in vitro. With the central stalk subunit gamma, is essential for the biogenesis of F(1) catalytic part of the ATP synthase complex namely in the formation of F1 assembly intermediate.

AlphaFold DB (A0A4W5QSW0), UniProt , Accession A0A060Y3Z9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene atp5f1d, Length 160 aa.

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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	42.7	Very low	54.7	Low	251 Å²	251	180.6 Å²	180.6	100%	1.236	89%	0.889	S	S	*	*				0	88	0	-161.1	170.5	179.5	0	0	108
2	M	41.3	Very low	54.6	Low	198 Å²	198	174.5 Å²	174.5	98%	0.975	87%	0.873	S	S	*	*			trans	-131.6	110.2	178.7	-106.5	-178.7	117.9	0	0	108.3
3	A	50.9	Low	54.9	Low	100 Å²	100	171.6 Å²	171.6	83%	0.826	87%	0.87	S	S	*	*			trans	-87.5	115.8	-178.8	0	0	0	0	0	110.1	R5	A3-R5 PolarHBondContact O-N 3.04Å
4	A	53.8	Low	55.2	Low	85 Å²	85	171.1 Å²	171.1	70%	0.702	87%	0.869	S	S	*	*			trans	-78.3	115.7	172.5	0	0	0	0	0	109.9	F6	A4-F6 PolarHBondContact O-N 3.35Å
5	R	58.9	Low	55.4	Low	238 Å²	238	175.3 Å²	175.3	90%	0.898	87%	0.87	S	S	*	*			trans	-82	108.4	173.5	-70.3	-177.4	-178.9	-153.6	0.2	109.3	A3 L7	A3-R5 PolarHBondContact O-N 3.04Å; R5-L7 PolarHBondContact O-N 3.41Å
6	F	56.3	Low	55.6	Low	196 Å²	196	175.6 Å²	175.6	86%	0.86	87%	0.868	S	S	*	*			trans	-75.8	111.4	169.3	-82.8	-89.6	0	0	0	110.1	A4 R8	A4-F6 PolarHBondContact O-N 3.35Å; F6-R8 PolarHBondContact O-N 2.75Å
7	L	61.5	Low	55.9	Low	170 Å²	170	169.9 Å²	169.9	89%	0.89	86%	0.856	S	S	*	*			trans	-74.5	107	166.5	-88.4	124.8	0	0	0	109.2	R5 R9	R5-L7 PolarHBondContact O-N 3.41Å; L7-R9 PolarHBondContact O-N 3.26Å
8	R	60	Low	55.8	Low	246 Å²	246	173.6 Å²	173.6	93%	0.928	86%	0.858	S	S	*	*			trans	-71.1	109.2	165.8	-82.4	-175.1	172.8	-150.1	-1.1	108.7	F6 S10	F6-R8 PolarHBondContact O-N 2.75Å; R8-S10 PolarHBondContact O-N 3.01Å
9	R	57.7	Low	56.3	Low	239 Å²	239	169.3 Å²	169.3	90%	0.902	85%	0.845	S	S	*	*			trans	-74.4	111.2	172.1	-151.6	174.5	-177.2	-174.9	0	107.8	L7 I11	L7-R9 PolarHBondContact O-N 3.26Å; R9-I11 PolarHBondContact O-N 3.44Å
10	S	59.7	Low	56.8	Low	111 Å²	111	173.2 Å²	173.2	78%	0.776	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-67.1	119.1	172.8	38	0	0	0	0	109.2	R8	R8-S10 PolarHBondContact O-N 3.01Å
11	I	59	Low	57.3	Low	153 Å²	153	169.7 Å²	169.7	79%	0.785	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-78.8	123.8	170.1	-58.6	171.8	0	0	0	106.4	R9 V13	R9-I11 PolarHBondContact O-N 3.44Å; I11-V13 PolarHBondContact O-N 3.4Å
12	P	53.4	Low	58.2	Low	107 Å²	107	163.3 Å²	163.3	70%	0.695	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-67.4	125.4	175.3	27.4	-30.9	0	0	0	108.8	L14	P12-L14 PolarHBondContact O-N 3.37Å
13	V	59.1	Low	59	Low	137 Å²	137	157.8 Å²	157.8	83%	0.83	81%	0.806	S	S	*	*			trans	-67.4	105	167.2	176.9	0	0	0	0	106.5	I11 R15	I11-V13 PolarHBondContact O-N 3.4Å; V13-R15 VanDerWaalsContact C-N 3.33Å; V13-R15 PolarHBondContact O-N 3.06Å
14	L	59	Low	59.3	Low	164 Å²	164	158.2 Å²	158.2	86%	0.859	80%	0.801	S	S	*	*			trans	-62.7	97.3	171.1	-104.3	148.4	0	0	0	107.9	P12 Q16	P12-L14 PolarHBondContact O-N 3.37Å; L14-Q16 PolarHBondContact O-N 3.5Å; L14-Q16 VanDerWaalsContact O-N 3.1Å
15	R	57.8	Low	59.4	Low	234 Å²	234	160 Å²	160	88%	0.883	81%	0.808	S	S	*	*			trans	-72.3	102.1	171.7	-150.6	-179.7	-170	-153.9	2.6	106.3	V13 A17	V13-R15 VanDerWaalsContact C-N 3.33Å; V13-R15 PolarHBondContact O-N 3.06Å; R15-A17 VanDerWaalsContact C-N 3.28Å; R15-A17 PolarHBondContact O-N 2.87Å
16	Q	59.4	Low	59.2	Low	180 Å²	180	151.1 Å²	151.1	84%	0.841	79%	0.791	S	S	*	*			trans	-66.5	88.1	179.4	-134.1	174.9	-1.5	0	0	108.8	L14	L14-Q16 PolarHBondContact O-N 3.5Å; L14-Q16 VanDerWaalsContact O-N 3.1Å
17	A	59.4	Low	59.3	Low	80 Å²	80	145.8 Å²	145.8	66%	0.661	78%	0.778	S	S	*	*			trans	-85.1	108.5	172.6	0	0	0	0	0	107.6	R15 C19	R15-A17 VanDerWaalsContact C-N 3.28Å; R15-A17 PolarHBondContact O-N 2.87Å; A17-C19 PolarHBondContact O-N 3.05Å
18	R	55.1	Low	59.6	Low	236 Å²	236	142.3 Å²	142.3	89%	0.891	77%	0.768	S	S	*	*			trans	-69	128.7	172.8	-61.2	-169.5	-168.8	-173.9	3.5	108.8
19	C	65.7	Low	60.2	Low	92 Å²	92	134.5 Å²	134.5	62%	0.622	74%	0.742	S	S	*	*			trans	-93.3	159.7	171	-69.8	0	0	0	0	110.6	A17 A21 D22	A17-C19 PolarHBondContact O-N 3.05Å; C19-A21 PolarHBondContact O-N 3.42Å; C19-D22 PolarHBondContact O-N 3.44Å
20	Y	65.6	Low	61.8	Low	247 Å²	247	123.3 Å²	123.3	97%	0.969	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-12.6	-172.7	-165.8	-95.5	0	0	0	114.9
21	A	68	Low	63.5	Low	99 Å²	99	120.3 Å²	120.3	82%	0.818	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	13	-175.6	0	0	0	0	0	113.9	C19 A23	C19-A21 PolarHBondContact O-N 3.42Å; A21-A23 PolarHBondContact O-N 3.45Å
22	D	61.3	Low	65.3	Low	118 Å²	118	113 Å²	113	63%	0.631	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-76.1	121.7	172.9	-112.1	-30	0	0	0	109.4	C19	C19-D22 PolarHBondContact O-N 3.44Å
23	A	57.7	Low	67.4	Low	81 Å²	81	109.5 Å²	109.5	67%	0.669	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-59.9	134.4	167.5	0	0	0	0	0	108.1	A21 S25	A21-A23 PolarHBondContact O-N 3.45Å; A23-S25 PolarHBondContact O-N 3.11Å; A23-S25 VanDerWaalsContact O-N 3.09Å
24	P	57.2	Low	69.2	Low	109 Å²	109	103 Å²	103	71%	0.708	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-57.4	124	177.7	22.8	-30.6	0	0	0	108.4	G26	P24-G26 PolarHBondContact O-N 3.46Å
25	S	55.6	Low	71.1	Confident	123 Å²	123	95.9 Å²	95.9	86%	0.86	54%	0.543	S	S	*	.			trans	-69	15.1	174.2	61.4	0	0	0	0	113.2	A23	A23-S25 PolarHBondContact O-N 3.11Å; A23-S25 VanDerWaalsContact O-N 3.09Å
26	G	56	Low	73	Confident	52 Å²	52	85.5 Å²	85.5	54%	0.536	51%	0.507	S	S	.	.	S	Bend	trans	-74.6	152.7	170.7	0	0	0	0	0	109.5	P24 S28	P24-G26 PolarHBondContact O-N 3.46Å; G26-S28 PolarHBondContact O-N 2.99Å
27	S	57.9	Low	74.7	Confident	83 Å²	83	82.3 Å²	82.3	58%	0.58	50%	0.502	S	S	*	.			trans	-49	131.9	171.5	47.6	0	0	0	0	109.2	Q29	S27-Q29 PolarHBondContact O-N 3.16Å; S27-Q29 PolarHBondContact OG-O 3.48Å
28	S	66.7	Low	76.4	Confident	97 Å²	97	85 Å²	85	68%	0.678	51%	0.51	S	S	*	.	S	Bend	trans	-67	19.6	173.3	-171.5	0	0	0	0	112.6	G26 P63	G26-S28 PolarHBondContact O-N 2.99Å; S28-P63 VanDerWaalsContact C-CG 3.49Å
29	Q	73	Confident	78.3	Confident	82 Å²	82	78.4 Å²	78.4	38%	0.383	49%	0.489	S	S	.	.			trans	-147.4	142.3	-160.6	-76.7	177.5	-4.2	0	0	108.5	S27 S46 D82	S27-Q29 PolarHBondContact O-N 3.16Å; S27-Q29 PolarHBondContact OG-O 3.48Å; Q29-S46 VanDerWaalsContact CB-OG 3.22Å; Q29-S46 WeakPolarHBondContact CB-OG 3.41Å; Q29-S46 WeakPolarHBondContact CG-OG 3.42Å; Q29-S46 PolarHBondContact OE1-OG 3.41Å; Q29-D82 PolarHBondContact NE2-OD2 2.9Å
30	M	91.6	Very high	79.8	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.02	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.5	173.2	62.2	-177.7	-167.8	0	0	109.6	F32 V47 V50 I61 P63 S102 V104	M30-F32 PolarHBondContact O-N 2.98Å; M30-V47 HydrophobicContact CE-CG2 3.54Å; M30-V47 HydrophobicContact CG-CG2 3.72Å; M30-V47 WeakPolarHBondContact CG-O 3.43Å; M30-V47 PolarHBondContact N-O 3Å; M30-V47 PolarHBondContact O-N 3.22Å; M30-V50 HydrophobicContact CE-CB 3.81Å; M30-V50 HydrophobicContact CE-CG2 3.41Å; M30-V50 VanDerWaalsContact CE-CG2 3.41Å; M30-I61 HydrophobicContact CE-CB 4.29Å; M30-I61 HydrophobicContact CE-CG2 4.17Å; M30-I61 WeakPolarHBondContact CE-O 3.37Å; M30-I61 HydrophobicContact SD-CG2 3.82Å; M30-P63 HydrophobicContact CB-CG 4.49Å; M30-S102 VanDerWaalsContact CB-O 3.27Å; M30-S102 WeakPolarHBondContact CB-O 3.28Å; M30-V104 HydrophobicContact CE-CG2 4.45Å; M30-V104 HydrophobicContact SD-CG2 3.74Å
31	S	94.6	Very high	81.3	Confident	48 Å²	48	68.3 Å²	68.3	34%	0.336	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.8	173.9	176.9	0	0	0	0	108.7	E44 S102 S103 V104	S31-E44 WeakPolarHBondContact OG-CA 3.45Å; S31-S102 PolarHBondContact N-O 3.35Å; S31-S103 CarbonylContact O-C 3.49Å; S31-S103 WeakPolarHBondContact O-CA 3.44Å; S31-V104 PolarHBondContact O-N 3.06Å
32	F	96.7	Very high	82.7	Confident	0 Å²	0	65 Å²	65	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.1	-176.3	-179.6	-118.7	0	0	0	111.8	M30 F34 F42 E44 A45 V47 V50 V79 V104 L106	M30-F32 PolarHBondContact O-N 2.98Å; F32-F34 HydrophobicContact CD1-CB 4.39Å; F32-F34 HydrophobicContact CE1-CB 3.56Å; F32-F34 HydrophobicContact CE1-CG 4.41Å; F32-F34 HydrophobicContact CE2-CB 4.42Å; F32-F34 HydrophobicContact CZ-CB 3.6Å; F32-F34 HydrophobicContact CZ-CG 4.29Å; F32-F42 HydrophobicContact CD1-CB 3.91Å; F32-F42 HydrophobicContact CD1-CD1 4.39Å; F32-F42 HydrophobicContact CD1-CD2 4.32Å; F32-F42 AromaticContact CD1-CG 3.97Å; F32-F42 HydrophobicContact CD1-CG 3.97Å; F32-F42 HydrophobicContact CE1-CB 4.26Å; F32-F42 AromaticContact CE1-CD2 4Å; F32-F42 HydrophobicContact CE1-CD2 4Å; F32-F42 HydrophobicContact CE1-CG 4.11Å; F32-E44 PolarHBondContact O-N 3.46Å; F32-A45 PolarHBondContact N-O 2.91Å; F32-A45 PolarHBondContact O-N 2.91Å; F32-V47 HydrophobicContact CB-CB 4.34Å; F32-V47 HydrophobicContact CB-CG1 4.05Å; F32-V47 HydrophobicContact CB-CG2 3.33Å; F32-V47 HydrophobicContact CD1-CG1 4.11Å; F32-V47 HydrophobicContact CD1-CG2 4.28Å; F32-V47 HydrophobicContact CG-CG1 4.48Å; F32-V47 HydrophobicContact CG-CG2 3.93Å; F32-V50 HydrophobicContact CD1-CG2 4.09Å; F32-V50 HydrophobicContact CD2-CG2 3.94Å; F32-V50 HydrophobicContact CE1-CG2 4.03Å; F32-V50 HydrophobicContact CE2-CB 4.4Å; F32-V50 HydrophobicContact CE2-CG1 3.95Å; F32-V50 HydrophobicContact CE2-CG2 3.88Å; F32-V50 HydrophobicContact CG-CG2 4.03Å; F32-V50 HydrophobicContact CZ-CG1 3.82Å; F32-V50 HydrophobicContact CZ-CG2 3.91Å; F32-V79 HydrophobicContact CD1-CG1 4.32Å; F32-V79 HydrophobicContact CE1-CG1 4.2Å; F32-V79 HydrophobicContact CE1-CG2 3.67Å; F32-V79 HydrophobicContact CZ-CG2 4.17Å; F32-V104 WeakPolarHBondContact CA-O 3.48Å; F32-V104 HydrophobicContact CD2-CB 3.95Å; F32-V104 HydrophobicContact CD2-CG1 3.76Å; F32-V104 HydrophobicContact CE2-CG1 4.03Å; F32-L106 HydrophobicContact CE2-CB 3.82Å; F32-L106 HydrophobicContact CE2-CD1 4.49Å; F32-L106 HydrophobicContact CZ-CB 4.04Å; F32-L106 HydrophobicContact CZ-CD1 4.36Å
33	T	97.7	Very high	84.3	Confident	33 Å²	33	67.3 Å²	67.3	20%	0.202	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.4	171.6	-65.7	0	0	0	0	108.5	F42 E44 V104 Q105 L106	T33-F42 CarbonylContact C-O 3.48Å; T33-F42 WeakPolarHBondContact CA-O 3.45Å; T33-E44 PolarHBondContact OG1-N 3.39Å; T33-E44 VanDerWaalsContact OG1-N 3.07Å; T33-V104 PolarHBondContact N-O 2.95Å; T33-Q105 CarbonylContact O-C 3.53Å; T33-Q105 WeakPolarHBondContact O-CA 3.43Å; T33-L106 PolarHBondContact O-N 3.32Å
34	F	98.1	Very high	86.1	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	119.6	174.6	172.9	-151	0	0	0	109.8	F32 Y41 F42 F89 V91 L106 A108 A111	F32-F34 HydrophobicContact CD1-CB 4.39Å; F32-F34 HydrophobicContact CE1-CB 3.56Å; F32-F34 HydrophobicContact CE1-CG 4.41Å; F32-F34 HydrophobicContact CE2-CB 4.42Å; F32-F34 HydrophobicContact CZ-CB 3.6Å; F32-F34 HydrophobicContact CZ-CG 4.29Å; F34-Y41 AromaticContact CD1-CD2 3.97Å; F34-Y41 HydrophobicContact CD1-CD2 3.97Å; F34-Y41 HydrophobicContact CD1-CG 4.01Å; F34-Y41 HydrophobicContact CD2-CD2 4.4Å; F34-Y41 AromaticContact CE1-CD2 3.72Å; F34-Y41 HydrophobicContact CE1-CD2 3.72Å; F34-Y41 HydrophobicContact CE1-CE2 4.44Å; F34-Y41 AromaticContact CE1-CG 3.95Å; F34-Y41 HydrophobicContact CE1-CG 3.95Å; F34-Y41 HydrophobicContact CE2-CD2 4.17Å; F34-Y41 HydrophobicContact CG-CD2 4.31Å; F34-Y41 AromaticContact CZ-CD2 3.86Å; F34-Y41 HydrophobicContact CZ-CD2 3.86Å; F34-Y41 HydrophobicContact CZ-CE2 4.27Å; F34-Y41 PolarHBondContact O-N 3.35Å; F34-F42 HydrophobicContact CB-CB 4.18Å; F34-F42 HydrophobicContact CB-CD2 4.03Å; F34-F42 AromaticContact CD1-CD2 3.97Å; F34-F42 HydrophobicContact CD1-CD2 3.97Å; F34-F42 HydrophobicContact CD1-CE2 4.34Å; F34-F42 PolarHBondContact N-O 3.48Å; F34-F42 PolarHBondContact O-N 3.22Å; F34-F89 HydrophobicContact CD1-CD2 4.46Å; F34-F89 HydrophobicContact CE1-CB 3.88Å; F34-F89 HydrophobicContact CE1-CD1 4.05Å; F34-F89 AromaticContact CE1-CD2 3.86Å; F34-F89 HydrophobicContact CE1-CD2 3.86Å; F34-F89 HydrophobicContact CE1-CE2 4.42Å; F34-F89 AromaticContact CE1-CG 3.65Å; F34-F89 HydrophobicContact CE1-CG 3.65Å; F34-F89 HydrophobicContact CZ-CB 4.21Å; F34-F89 HydrophobicContact CZ-CG 4.42Å; F34-V91 HydrophobicContact CE2-CG2 4.3Å; F34-V91 HydrophobicContact CZ-CG2 3.92Å; F34-L106 VanDerWaalsContact CA-O 3.29Å; F34-L106 WeakPolarHBondContact CA-O 3.46Å; F34-L106 HydrophobicContact CB-CB 4.41Å; F34-L106 HydrophobicContact CD2-CB 4.13Å; F34-L106 HydrophobicContact CD2-CD2 3.34Å; F34-L106 HydrophobicContact CD2-CG 4.27Å; F34-L106 WeakPolarHBondContact CD2-O 3.39Å; F34-L106 HydrophobicContact CE2-CD2 3.34Å; F34-L106 HydrophobicContact CG-CD2 4.27Å; F34-L106 HydrophobicContact CZ-CD2 4.24Å; F34-A108 HydrophobicContact CE2-CB 3.85Å; F34-A111 HydrophobicContact CE2-CB 3.94Å; F34-A111 HydrophobicContact CZ-CB 3.51Å
35	A	97.9	Very high	87.9	Confident	15 Å²	15	66.6 Å²	66.6	12%	0.124	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	154.6	-178.7	0	0	0	0	0	112.3	Q39 V40 L106 L107 A108	A35-Q39 WeakPolarHBondContact CA-O 3.41Å; A35-V40 HydrophobicContact CB-CB 4.38Å; A35-V40 HydrophobicContact CB-CG1 4.34Å; A35-V40 HydrophobicContact CB-CG2 4.01Å; A35-L106 PolarHBondContact N-O 3.37Å; A35-L106 VanDerWaalsContact N-O 3.1Å; A35-L107 HydrophobicContact CB-CD2 4.18Å; A35-L107 WeakPolarHBondContact O-CA 3.42Å; A35-A108 PolarHBondContact O-N 2.94Å
36	S	96.9	Very high	89.7	Confident	16 Å²	16	63.1 Å²	63.1	11%	0.112	37%	0.372	C	S	.	.			trans	-114.4	168.3	159.4	71.5	0	0	0	0	109.6	T38 Q39 A108	S36-T38 PolarHBondContact O-N 3.14Å; S36-T38 VanDerWaalsContact O-N 3.1Å; S36-T38 PolarHBondContact OG-N 3.15Å; S36-Q39 PolarHBondContact N-O 3.39Å; S36-Q39 PolarHBondContact O-N 3.25Å; S36-Q39 PolarHBondContact OG-N 3.3Å; S36-Q39 PolarHBondContact OG-O 2.94Å; S36-A108 VanDerWaalsContact CA-O 3.31Å; S36-A108 WeakPolarHBondContact CA-O 3.46Å
37	P	96.8	Very high	91.4	Very high	114 Å²	114	60.6 Å²	60.6	74%	0.74	35%	0.346	S	S	*	.	S	Bend	trans	-55.2	-27	174.2	-26.4	36.1	0	0	0	113.6	A108 E109	P37-A108 WeakPolarHBondContact CD-O 3.43Å; P37-E109 WeakPolarHBondContact CD-O 3.44Å
38	T	94.5	Very high	93.1	Very high	135 Å²	135	62.1 Å²	62.1	83%	0.828	34%	0.342	S	S	*	.	S	Bend	trans	-92.3	-33.7	-176.7	-45.4	0	0	0	0	112.9	S36	S36-T38 PolarHBondContact O-N 3.14Å; S36-T38 VanDerWaalsContact O-N 3.1Å; S36-T38 PolarHBondContact OG-N 3.15Å
39	Q	95.4	Very high	94.5	Very high	98 Å²	98	60 Å²	60	46%	0.458	32%	0.322	S	S	.	.			trans	-148.8	144.2	-171.6	-177.2	171.1	-3.2	0	0	112.8	A35 S36 Y41	A35-Q39 WeakPolarHBondContact CA-O 3.41Å; S36-Q39 PolarHBondContact N-O 3.39Å; S36-Q39 PolarHBondContact O-N 3.25Å; S36-Q39 PolarHBondContact OG-N 3.3Å; S36-Q39 PolarHBondContact OG-O 2.94Å; Q39-Y41 HydrophobicContact CB-CE2 4.48Å; Q39-Y41 HydrophobicContact CG-CE1 4.31Å
40	V	97.5	Very high	95.6	Very high	86 Å²	86	56.1 Å²	56.1	52%	0.521	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.6	168.2	-176.3	0	0	0	0	108.8	A35 F42 K43	A35-V40 HydrophobicContact CB-CB 4.38Å; A35-V40 HydrophobicContact CB-CG1 4.34Å; A35-V40 HydrophobicContact CB-CG2 4.01Å; V40-F42 WeakPolarHBondContact CG1-O 3.47Å; V40-K43 HydrophobicContact CG1-CB 4Å
41	Y	96.3	Very high	95.9	Very high	42 Å²	42	58.3 Å²	58.3	17%	0.165	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-44	179.8	-67.9	-75.5	0	0	0	111.8	F34 Q39 F89 A111	F34-Y41 AromaticContact CD1-CD2 3.97Å; F34-Y41 HydrophobicContact CD1-CD2 3.97Å; F34-Y41 HydrophobicContact CD1-CG 4.01Å; F34-Y41 HydrophobicContact CD2-CD2 4.4Å; F34-Y41 AromaticContact CE1-CD2 3.72Å; F34-Y41 HydrophobicContact CE1-CD2 3.72Å; F34-Y41 HydrophobicContact CE1-CE2 4.44Å; F34-Y41 AromaticContact CE1-CG 3.95Å; F34-Y41 HydrophobicContact CE1-CG 3.95Å; F34-Y41 HydrophobicContact CE2-CD2 4.17Å; F34-Y41 HydrophobicContact CG-CD2 4.31Å; F34-Y41 AromaticContact CZ-CD2 3.86Å; F34-Y41 HydrophobicContact CZ-CD2 3.86Å; F34-Y41 HydrophobicContact CZ-CE2 4.27Å; F34-Y41 PolarHBondContact O-N 3.35Å; Q39-Y41 HydrophobicContact CB-CE2 4.48Å; Q39-Y41 HydrophobicContact CG-CE1 4.31Å; Y41-F89 HydrophobicContact CD1-CD1 4.09Å; Y41-F89 AromaticContact CD1-CE1 3.53Å; Y41-F89 HydrophobicContact CD1-CE1 3.53Å; Y41-F89 HydrophobicContact CD1-CZ 4.28Å; Y41-F89 HydrophobicContact CE1-CD1 4.17Å; Y41-F89 AromaticContact CE1-CE1 3.9Å; Y41-F89 HydrophobicContact CE1-CE1 3.9Å; Y41-F89 HydrophobicContact CG-CE1 4.16Å; Y41-A111 HydrophobicContact CE2-CB 3.87Å; Y41-A111 PolarHBondContact OH-O 2.95Å
42	F	96.6	Very high	96	Very high	29 Å²	29	56.1 Å²	56.1	13%	0.127	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.3	175.6	-64.8	-98.9	0	0	0	108.8	F32 T33 F34 V40 A45 V79 A87 F89	F32-F42 HydrophobicContact CD1-CB 3.91Å; F32-F42 HydrophobicContact CD1-CD1 4.39Å; F32-F42 HydrophobicContact CD1-CD2 4.32Å; F32-F42 AromaticContact CD1-CG 3.97Å; F32-F42 HydrophobicContact CD1-CG 3.97Å; F32-F42 HydrophobicContact CE1-CB 4.26Å; F32-F42 AromaticContact CE1-CD2 4Å; F32-F42 HydrophobicContact CE1-CD2 4Å; F32-F42 HydrophobicContact CE1-CG 4.11Å; T33-F42 CarbonylContact C-O 3.48Å; T33-F42 WeakPolarHBondContact CA-O 3.45Å; F34-F42 HydrophobicContact CB-CB 4.18Å; F34-F42 HydrophobicContact CB-CD2 4.03Å; F34-F42 AromaticContact CD1-CD2 3.97Å; F34-F42 HydrophobicContact CD1-CD2 3.97Å; F34-F42 HydrophobicContact CD1-CE2 4.34Å; F34-F42 PolarHBondContact N-O 3.48Å; F34-F42 PolarHBondContact O-N 3.22Å; V40-F42 WeakPolarHBondContact CG1-O 3.47Å; F42-A45 HydrophobicContact CB-CB 4.11Å; F42-A45 HydrophobicContact CD1-CB 3.8Å; F42-A45 HydrophobicContact CG-CB 4.45Å; F42-V79 HydrophobicContact CE1-CG1 3.97Å; F42-V79 HydrophobicContact CE2-CB 4.36Å; F42-V79 HydrophobicContact CE2-CG1 4.29Å; F42-V79 HydrophobicContact CE2-CG2 4.07Å; F42-V79 HydrophobicContact CZ-CB 4.1Å; F42-V79 HydrophobicContact CZ-CG1 3.78Å; F42-V79 HydrophobicContact CZ-CG2 4.32Å; F42-A87 HydrophobicContact CZ-CB 4.43Å; F42-F89 AromaticContact CE2-CE2 3.67Å; F42-F89 HydrophobicContact CE2-CE2 3.67Å; F42-F89 AromaticContact CE2-CZ 3.88Å; F42-F89 HydrophobicContact CE2-CZ 3.88Å; F42-F89 HydrophobicContact CZ-CE2 4.25Å; F42-F89 HydrophobicContact CZ-CZ 4.49Å
43	K	96.7	Very high	96	Very high	166 Å²	166	57 Å²	57	72%	0.722	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127	104.3	179	-176.7	-179.7	178.6	179.5	0	109.1	V40 A45	V40-K43 HydrophobicContact CG1-CB 4Å; K43-A45 PolarHBondContact O-N 2.95Å
44	E	94.6	Very high	95.9	Very high	146 Å²	146	55.7 Å²	55.7	68%	0.682	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.2	35.7	-178	-59.3	178.5	171.8	0	0	112.4	S31 F32 T33	S31-E44 WeakPolarHBondContact OG-CA 3.45Å; F32-E44 PolarHBondContact O-N 3.46Å; T33-E44 PolarHBondContact OG1-N 3.39Å; T33-E44 VanDerWaalsContact OG1-N 3.07Å
45	A	93.8	Very high	95.6	Very high	29 Å²	29	61.1 Å²	61.1	24%	0.24	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	143.2	-175.6	0	0	0	0	0	109.9	F32 F42 K43 V47	F32-A45 PolarHBondContact N-O 2.91Å; F32-A45 PolarHBondContact O-N 2.91Å; F42-A45 HydrophobicContact CB-CB 4.11Å; F42-A45 HydrophobicContact CD1-CB 3.8Å; F42-A45 HydrophobicContact CG-CB 4.45Å; K43-A45 PolarHBondContact O-N 2.95Å; A45-V47 HydrophobicContact CB-CG1 4.48Å; A45-V47 PolarHBondContact O-N 3.27Å
46	S	93.4	Very high	95.2	Very high	50 Å²	50	66.7 Å²	66.7	35%	0.35	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118	172.6	-157.7	0	0	0	0	109.6	Q29	Q29-S46 VanDerWaalsContact CB-OG 3.22Å; Q29-S46 WeakPolarHBondContact CB-OG 3.41Å; Q29-S46 WeakPolarHBondContact CG-OG 3.42Å; Q29-S46 PolarHBondContact OE1-OG 3.41Å
47	V	93.6	Very high	95.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.5	178.9	-58.5	0	0	0	0	110.9	M30 F32 A45 V50 V79	M30-V47 HydrophobicContact CE-CG2 3.54Å; M30-V47 HydrophobicContact CG-CG2 3.72Å; M30-V47 WeakPolarHBondContact CG-O 3.43Å; M30-V47 PolarHBondContact N-O 3Å; M30-V47 PolarHBondContact O-N 3.22Å; F32-V47 HydrophobicContact CB-CB 4.34Å; F32-V47 HydrophobicContact CB-CG1 4.05Å; F32-V47 HydrophobicContact CB-CG2 3.33Å; F32-V47 HydrophobicContact CD1-CG1 4.11Å; F32-V47 HydrophobicContact CD1-CG2 4.28Å; F32-V47 HydrophobicContact CG-CG1 4.48Å; F32-V47 HydrophobicContact CG-CG2 3.93Å; A45-V47 HydrophobicContact CB-CG1 4.48Å; A45-V47 PolarHBondContact O-N 3.27Å; V47-V50 HydrophobicContact CG2-CG2 3.85Å; V47-V79 HydrophobicContact CB-CG1 4.36Å; V47-V79 HydrophobicContact CG1-CG1 3.82Å
48	K	93.4	Very high	94.9	Very high	114 Å²	114	66.5 Å²	66.5	50%	0.496	37%	0.372	S	S	.	.	S	Bend	trans	-88.5	-39.6	-177.1	-176.4	179.8	178.3	-177.8	0	112.4	P63 F80	K48-P63 VanDerWaalsContact O-CD 3.29Å; K48-P63 WeakPolarHBondContact O-CD 3.23Å; K48-F80 PolarHBondContact N-O 3.12Å
49	Q	94.6	Very high	95	Very high	54 Å²	54	62.4 Å²	62.4	25%	0.252	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	144.9	-178.1	175.6	177.7	-26.1	0	0	110.1	D51 I61 L62 F80	Q49-D51 PolarHBondContact NE2-OD1 3.24Å; Q49-D51 PolarHBondContact NE2-OD2 3.46Å; Q49-I61 VanDerWaalsContact CA-O 3.3Å; Q49-I61 WeakPolarHBondContact CA-O 3.44Å; Q49-L62 HydrophobicContact CB-CD1 4.34Å; Q49-L62 HydrophobicContact CB-CG 4.29Å; Q49-L62 HydrophobicContact CG-CD1 3.77Å; Q49-L62 HydrophobicContact CG-CG 4.27Å; Q49-F80 HydrophobicContact CB-CB 4.12Å; Q49-F80 HydrophobicContact CB-CD2 3.94Å; Q49-F80 HydrophobicContact CB-CG 4.39Å; Q49-F80 HydrophobicContact CG-CD2 3.88Å; Q49-F80 HydrophobicContact CG-CE2 4.41Å; Q49-F80 PolarHBondContact N-O 2.71Å; Q49-F80 PolarHBondContact O-N 3.41Å
50	V	96.7	Very high	95	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	122.8	171.2	-179.5	0	0	0	0	109	M30 F32 V47 V52 I61 V77 T78 V79	M30-V50 HydrophobicContact CE-CB 3.81Å; M30-V50 HydrophobicContact CE-CG2 3.41Å; M30-V50 VanDerWaalsContact CE-CG2 3.41Å; F32-V50 HydrophobicContact CD1-CG2 4.09Å; F32-V50 HydrophobicContact CD2-CG2 3.94Å; F32-V50 HydrophobicContact CE1-CG2 4.03Å; F32-V50 HydrophobicContact CE2-CB 4.4Å; F32-V50 HydrophobicContact CE2-CG1 3.95Å; F32-V50 HydrophobicContact CE2-CG2 3.88Å; F32-V50 HydrophobicContact CG-CG2 4.03Å; F32-V50 HydrophobicContact CZ-CG1 3.82Å; F32-V50 HydrophobicContact CZ-CG2 3.91Å; V47-V50 HydrophobicContact CG2-CG2 3.85Å; V50-V52 HydrophobicContact CG1-CG1 3.79Å; V50-I61 PolarHBondContact N-O 2.99Å; V50-I61 PolarHBondContact O-N 3.09Å; V50-V77 HydrophobicContact CG1-CG1 4.05Å; V50-T78 CarbonylContact C-O 3.52Å; V50-T78 WeakPolarHBondContact CA-O 3.28Å; V50-V79 HydrophobicContact CG1-CG2 4.37Å; V50-V79 HydrophobicContact CG2-CG1 4.23Å; V50-V79 HydrophobicContact CG2-CG2 4.41Å
51	D	97.1	Very high	94.9	Very high	49 Å²	49	55 Å²	55	26%	0.262	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.4	175.2	-65.7	-11.5	0	0	0	109.4	Q49 G60 V77 T78 F80	Q49-D51 PolarHBondContact NE2-OD1 3.24Å; Q49-D51 PolarHBondContact NE2-OD2 3.46Å; D51-G60 WeakPolarHBondContact OD1-CA 3.04Å; D51-V77 WeakPolarHBondContact O-CA 3.46Å; D51-T78 PolarHBondContact N-O 2.97Å; D51-T78 PolarHBondContact O-N 3.29Å; D51-F80 WeakPolarHBondContact OD2-CE2 3.49Å
52	V	97.1	Very high	94.8	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.012	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.5	-173.6	-63	0	0	0	0	112.2	V50 T54 A58 F59 I61 L72 V77 L106	V50-V52 HydrophobicContact CG1-CG1 3.79Å; V52-T54 HydrophobicContact CG2-CG2 4.08Å; V52-A58 WeakPolarHBondContact O-CA 3.48Å; V52-F59 HydrophobicContact CG2-CD1 4.08Å; V52-F59 HydrophobicContact CG2-CE1 3.74Å; V52-F59 HydrophobicContact CG2-CE2 4.3Å; V52-F59 HydrophobicContact CG2-CG 4.49Å; V52-F59 HydrophobicContact CG2-CZ 3.86Å; V52-F59 PolarHBondContact N-O 3.31Å; V52-F59 PolarHBondContact O-N 3.41Å; V52-F59 VanDerWaalsContact O-N 3.14Å; V52-I61 HydrophobicContact CG1-CD1 4.34Å; V52-I61 HydrophobicContact CG2-CD1 4.05Å; V52-L72 HydrophobicContact CB-CD2 4.38Å; V52-V77 HydrophobicContact CG1-CG1 4.46Å; V52-L106 HydrophobicContact CG1-CD1 3.52Å
53	P	96.8	Very high	94.6	Very high	19 Å²	19	57.4 Å²	57.4	12%	0.123	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	123.7	168.4	32.8	-29.3	0	0	0	110.2	L72 R73 V77	P53-L72 WeakPolarHBondContact O-CA 3.35Å; P53-L72 WeakPolarHBondContact O-CD2 3.32Å; P53-R73 PolarHBondContact O-N 3.18Å; P53-R73 VanDerWaalsContact O-N 3.15Å; P53-V77 HydrophobicContact CG-CG2 4.41Å
54	T	95.5	Very high	94.2	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	170.1	174.9	74.2	0	0	0	0	111.7	V52 T56 G57 F59 Q70 V71 L72 I96	V52-T54 HydrophobicContact CG2-CG2 4.08Å; T54-T56 PolarHBondContact O-N 3.27Å; T54-G57 CarbonylContact C-O 3.6Å; T54-G57 WeakPolarHBondContact CA-O 3.13Å; T54-G57 PolarHBondContact N-O 3.1Å; T54-G57 PolarHBondContact O-N 2.92Å; T54-G57 VanDerWaalsContact O-O 3.07Å; T54-G57 PolarHBondContact OG1-O 3.15Å; T54-F59 HydrophobicContact CG2-CD1 4.21Å; T54-F59 HydrophobicContact CG2-CE1 3.56Å; T54-Q70 HydrophobicContact CG2-CB 4.04Å; T54-Q70 VanDerWaalsContact CG2-OE1 3.28Å; T54-Q70 PolarHBondContact OG1-OE1 3.06Å; T54-V71 WeakPolarHBondContact CA-O 3.36Å; T54-V71 WeakPolarHBondContact CB-O 3.46Å; T54-L72 HydrophobicContact CG2-CD2 4.2Å; T54-I96 HydrophobicContact CG2-CG2 4.36Å
55	L	91.6	Very high	94.1	Very high	115 Å²	115	48.9 Å²	48.9	60%	0.602	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-29.1	178.6	-70.6	176.9	0	0	0	113.2	V71 R73	L55-V71 HydrophobicContact CD1-CB 4.07Å; L55-V71 HydrophobicContact CD1-CG2 3.73Å; L55-V71 PolarHBondContact N-O 3.4Å; L55-R73 HydrophobicContact CD2-CB 4.22Å; L55-R73 HydrophobicContact CD2-CG 4.46Å
56	T	91	Very high	94.1	Very high	132 Å²	132	52.6 Å²	52.6	81%	0.81	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-10.1	-178.7	-48.6	0	0	0	0	112.8	T54	T54-T56 PolarHBondContact O-N 3.27Å
57	G	93.6	Very high	94.2	Very high	39 Å²	39	53.8 Å²	53.8	40%	0.402	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-173.2	-178.6	0	0	0	0	0	111.5	T54	T54-G57 CarbonylContact C-O 3.6Å; T54-G57 WeakPolarHBondContact CA-O 3.13Å; T54-G57 PolarHBondContact N-O 3.1Å; T54-G57 PolarHBondContact O-N 2.92Å; T54-G57 VanDerWaalsContact O-O 3.07Å; T54-G57 PolarHBondContact OG1-O 3.15Å
58	A	94	Very high	94.3	Very high	87 Å²	87	55.3 Å²	55.3	72%	0.719	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.4	140	170.3	0	0	0	0	0	109.7	V52	V52-A58 WeakPolarHBondContact O-CA 3.48Å
59	F	95.6	Very high	94.5	Very high	48 Å²	48	56.2 Å²	56.2	21%	0.211	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.6	174.8	70.2	-80.8	0	0	0	111.9	V52 T54 I61 Q70	V52-F59 HydrophobicContact CG2-CD1 4.08Å; V52-F59 HydrophobicContact CG2-CE1 3.74Å; V52-F59 HydrophobicContact CG2-CE2 4.3Å; V52-F59 HydrophobicContact CG2-CG 4.49Å; V52-F59 HydrophobicContact CG2-CZ 3.86Å; V52-F59 PolarHBondContact N-O 3.31Å; V52-F59 PolarHBondContact O-N 3.41Å; V52-F59 VanDerWaalsContact O-N 3.14Å; T54-F59 HydrophobicContact CG2-CD1 4.21Å; T54-F59 HydrophobicContact CG2-CE1 3.56Å; F59-I61 HydrophobicContact CD2-CG1 3.96Å; F59-I61 HydrophobicContact CE2-CD1 3.97Å; F59-I61 HydrophobicContact CE2-CG1 3.5Å; F59-I61 HydrophobicContact CZ-CD1 4.36Å; F59-I61 HydrophobicContact CZ-CG1 4.35Å; F59-Q70 VanDerWaalsContact CE1-OE1 3.31Å
60	G	95.5	Very high	94.5	Very high	29 Å²	29	56.3 Å²	56.3	30%	0.299	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.1	176	0	0	0	0	0	111.6	D51	D51-G60 WeakPolarHBondContact OD1-CA 3.04Å
61	I	95.6	Very high	94.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.7	177.2	-55	164.5	0	0	0	107.6	M30 Q49 V50 V52 F59 H65 I96 V98 V104	M30-I61 HydrophobicContact CE-CB 4.29Å; M30-I61 HydrophobicContact CE-CG2 4.17Å; M30-I61 WeakPolarHBondContact CE-O 3.37Å; M30-I61 HydrophobicContact SD-CG2 3.82Å; Q49-I61 VanDerWaalsContact CA-O 3.3Å; Q49-I61 WeakPolarHBondContact CA-O 3.44Å; V50-I61 PolarHBondContact N-O 2.99Å; V50-I61 PolarHBondContact O-N 3.09Å; V52-I61 HydrophobicContact CG1-CD1 4.34Å; V52-I61 HydrophobicContact CG2-CD1 4.05Å; F59-I61 HydrophobicContact CD2-CG1 3.96Å; F59-I61 HydrophobicContact CE2-CD1 3.97Å; F59-I61 HydrophobicContact CE2-CG1 3.5Å; F59-I61 HydrophobicContact CZ-CD1 4.36Å; F59-I61 HydrophobicContact CZ-CG1 4.35Å; I61-H65 HydrophobicContact CG2-CB 3.94Å; I61-I96 HydrophobicContact CD1-CD1 4.19Å; I61-I96 HydrophobicContact CD1-CG1 3.93Å; I61-V98 HydrophobicContact CD1-CG2 3.85Å; I61-V98 HydrophobicContact CG1-CG2 4.41Å; I61-V98 HydrophobicContact CG2-CG2 4.14Å; I61-V104 HydrophobicContact CD1-CG1 4.19Å; I61-V104 HydrophobicContact CG2-CG2 3.98Å
62	L	94.3	Very high	94.5	Very high	86 Å²	86	58.5 Å²	58.5	45%	0.45	36%	0.364	S	S	.	.			trans	-114.5	167.8	174.3	-81.8	81.9	0	0	0	109.4	Q49 H65	Q49-L62 HydrophobicContact CB-CD1 4.34Å; Q49-L62 HydrophobicContact CB-CG 4.29Å; Q49-L62 HydrophobicContact CG-CD1 3.77Å; Q49-L62 HydrophobicContact CG-CG 4.27Å; L62-H65 WeakPolarHBondContact O-CB 3.43Å; L62-H65 PolarHBondContact O-N 3.45Å
63	P	91.3	Very high	94.5	Very high	36 Å²	36	64.1 Å²	64.1	23%	0.234	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	142.5	173.6	-26.1	33	0	0	0	112.3	S28 M30 K48 H65	S28-P63 VanDerWaalsContact C-CG 3.49Å; M30-P63 HydrophobicContact CB-CG 4.49Å; K48-P63 VanDerWaalsContact O-CD 3.29Å; K48-P63 WeakPolarHBondContact O-CD 3.23Å; P63-H65 VanDerWaalsContact C-N 3.3Å; P63-H65 PolarHBondContact O-N 3.05Å
64	A	89.9	Confident	94.5	Very high	77 Å²	77	64.7 Å²	64.7	64%	0.636	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	30.2	-175.3	0	0	0	0	0	115.4	S102	A64-S102 PolarHBondContact N-OG 3.29Å
65	H	92.5	Very high	94.5	Very high	56 Å²	56	65 Å²	65	26%	0.259	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-65.1	154.4	168.5	-167.3	-82.2	0	0	0	111.9	I61 L62 P63 V98	I61-H65 HydrophobicContact CG2-CB 3.94Å; L62-H65 WeakPolarHBondContact O-CB 3.43Å; L62-H65 PolarHBondContact O-N 3.45Å; P63-H65 VanDerWaalsContact C-N 3.3Å; P63-H65 PolarHBondContact O-N 3.05Å; H65-V98 HydrophobicContact CB-CG1 4.27Å
66	V	93.6	Very high	94.8	Very high	107 Å²	107	61.6 Å²	61.6	65%	0.648	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-64.5	135.2	177.1	-175.8	0	0	0	0	110	T68	V66-T68 PolarHBondContact O-N 3.07Å; V66-T68 PolarHBondContact O-OG1 2.79Å
67	P	95.8	Very high	95.1	Very high	75 Å²	75	55.3 Å²	55.3	49%	0.487	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-55.2	129.3	176.8	-27.1	35.8	0	0	0	111.8	V98 A100	P67-V98 CarbonylContact C-O 3.59Å; P67-V98 WeakPolarHBondContact CA-O 3.18Å; P67-A100 HydrophobicContact CG-CB 3.92Å
68	T	95.3	Very high	95.3	Very high	32 Å²	32	54.5 Å²	54.5	20%	0.196	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	141.5	-167.5	-61	0	0	0	0	110.2	V66 Q70 V98	V66-T68 PolarHBondContact O-N 3.07Å; V66-T68 PolarHBondContact O-OG1 2.79Å; T68-Q70 HydrophobicContact CG2-CG 3.81Å; T68-V98 PolarHBondContact N-O 2.84Å; T68-V98 PolarHBondContact O-N 2.8Å
69	L	96.3	Very high	95.4	Very high	133 Å²	133	50.3 Å²	50.3	70%	0.696	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	125.2	169.9	-67	176.1	0	0	0	108.5	I96 T97	L69-I96 WeakPolarHBondContact CA-O 3.23Å; L69-T97 HydrophobicContact CD2-CG2 3.46Å; L69-T97 VanDerWaalsContact CD2-CG2 3.46Å; L69-T97 WeakPolarHBondContact CD2-OG1 3.49Å
70	Q	96.7	Very high	95.4	Very high	56 Å²	56	50.9 Å²	50.9	26%	0.262	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	161.1	175.5	-68.7	-171.8	29.6	0	0	112	T54 F59 T68 S95 I96	T54-Q70 HydrophobicContact CG2-CB 4.04Å; T54-Q70 VanDerWaalsContact CG2-OE1 3.28Å; T54-Q70 PolarHBondContact OG1-OE1 3.06Å; F59-Q70 VanDerWaalsContact CE1-OE1 3.31Å; T68-Q70 HydrophobicContact CG2-CG 3.81Å; Q70-S95 WeakPolarHBondContact O-CA 3.47Å; Q70-I96 HydrophobicContact CB-CG2 3.71Å; Q70-I96 PolarHBondContact N-O 3.34Å; Q70-I96 WeakPolarHBondContact O-CG2 3.46Å; Q70-I96 PolarHBondContact O-N 3.43Å
71	V	96.8	Very high	95.2	Very high	85 Å²	85	51.5 Å²	51.5	52%	0.515	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	138.5	173.1	-109.9	0	0	0	0	109.3	T54 L55 G94	T54-V71 WeakPolarHBondContact CA-O 3.36Å; T54-V71 WeakPolarHBondContact CB-O 3.46Å; L55-V71 HydrophobicContact CD1-CB 4.07Å; L55-V71 HydrophobicContact CD1-CG2 3.73Å; L55-V71 PolarHBondContact N-O 3.4Å; V71-G94 WeakPolarHBondContact CA-O 3.29Å; V71-G94 WeakPolarHBondContact CG1-O 3.44Å
72	L	96.3	Very high	94.8	Very high	9 Å²	9	55.1 Å²	55.1	5%	0.047	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	149.5	-177.7	-57.4	177.8	0	0	0	111	V52 P53 T54 V91 G94 I96 L106	V52-L72 HydrophobicContact CB-CD2 4.38Å; P53-L72 WeakPolarHBondContact O-CA 3.35Å; P53-L72 WeakPolarHBondContact O-CD2 3.32Å; T54-L72 HydrophobicContact CG2-CD2 4.2Å; L72-V91 HydrophobicContact CD1-CG1 3.83Å; L72-G94 PolarHBondContact N-O 2.97Å; L72-I96 HydrophobicContact CD2-CB 4.14Å; L72-I96 HydrophobicContact CD2-CG2 4.05Å; L72-L106 HydrophobicContact CD1-CD1 4.45Å; L72-L106 HydrophobicContact CD1-CD2 3.67Å; L72-L106 HydrophobicContact CD1-CG 3.95Å
73	R	95.8	Very high	94.4	Very high	121 Å²	121	57 Å²	57	46%	0.457	32%	0.32	S	S	.	.			trans	-105.3	151.3	169.5	-176.5	-179.3	177.4	166.5	4.1	108.8	P53 L55 G75 D150	P53-R73 PolarHBondContact O-N 3.18Å; P53-R73 VanDerWaalsContact O-N 3.15Å; L55-R73 HydrophobicContact CD2-CB 4.22Å; L55-R73 HydrophobicContact CD2-CG 4.46Å; R73-G75 PolarHBondContact O-N 3.23Å; R73-D150 IonicContact NH2-OD2 3.97Å
74	P	97	Very high	94.1	Very high	31 Å²	31	58 Å²	58	20%	0.201	34%	0.335	C	S	.	.	S	Bend	trans	-48.7	124.3	169.9	-27	30.7	0	0	0	111.9	F90 V91 S92 A151 A154	P74-F90 HydrophobicContact CB-CZ 4.21Å; P74-V91 WeakPolarHBondContact CA-O 3.19Å; P74-S92 WeakPolarHBondContact CA-O 3.3Å; P74-S92 WeakPolarHBondContact CD-O 3.34Å; P74-S92 WeakPolarHBondContact CG-O 3.39Å; P74-S92 VanDerWaalsContact N-O 3.09Å; P74-A151 HydrophobicContact CB-CB 4.29Å; P74-A151 HydrophobicContact CG-CB 4.11Å; P74-A154 HydrophobicContact CB-CB 3.93Å
75	G	96.9	Very high	94.2	Very high	10 Å²	10	56.6 Å²	56.6	10%	0.103	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.9	-172.1	-176.4	0	0	0	0	0	114.5	R73 F90 V91	R73-G75 PolarHBondContact O-N 3.23Å; G75-F90 WeakPolarHBondContact O-CA 3.18Å; G75-V91 PolarHBondContact N-O 3.45Å; G75-V91 PolarHBondContact O-N 3.08Å
76	V	97.3	Very high	94.3	Very high	45 Å²	45	56.5 Å²	56.5	27%	0.273	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.3	-176.2	-175.7	0	0	0	0	110.9	K88 F89 F90 L114 A158	V76-K88 HydrophobicContact CG1-CB 4.05Å; V76-K88 HydrophobicContact CG1-CD 4.47Å; V76-K88 HydrophobicContact CG1-CG 4.37Å; V76-F89 CarbonylContact C-O 3.55Å; V76-F89 WeakPolarHBondContact CA-O 3.33Å; V76-F90 HydrophobicContact CG2-CD2 4.46Å; V76-L114 HydrophobicContact CG2-CD2 4.26Å; V76-A158 HydrophobicContact CG2-CB 3.38Å
77	V	97.6	Very high	94.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.6	164.9	174.4	0	0	0	0	108.7	V50 D51 V52 P53 V79 K88 F89 V91 L106	V50-V77 HydrophobicContact CG1-CG1 4.05Å; D51-V77 WeakPolarHBondContact O-CA 3.46Å; V52-V77 HydrophobicContact CG1-CG1 4.46Å; P53-V77 HydrophobicContact CG-CG2 4.41Å; V77-V79 HydrophobicContact CG1-CG2 4.23Å; V77-K88 WeakPolarHBondContact O-CA 3.32Å; V77-F89 PolarHBondContact N-O 3.02Å; V77-F89 PolarHBondContact O-N 3.42Å; V77-V91 HydrophobicContact CB-CG2 4.25Å; V77-V91 HydrophobicContact CG2-CB 4.28Å; V77-V91 HydrophobicContact CG2-CG2 3.6Å; V77-L106 HydrophobicContact CG1-CD1 3.95Å; V77-L106 HydrophobicContact CG2-CD1 3.95Å
78	T	97.3	Very high	94.4	Very high	21 Å²	21	54.6 Å²	54.6	13%	0.129	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.5	175	-53.6	0	0	0	0	109.8	V50 D51 F80 A86 A87 K88	V50-T78 CarbonylContact C-O 3.52Å; V50-T78 WeakPolarHBondContact CA-O 3.28Å; D51-T78 PolarHBondContact N-O 2.97Å; D51-T78 PolarHBondContact O-N 3.29Å; T78-F80 HydrophobicContact CG2-CD2 4.25Å; T78-F80 HydrophobicContact CG2-CE1 4.16Å; T78-F80 HydrophobicContact CG2-CE2 3.65Å; T78-F80 HydrophobicContact CG2-CZ 3.6Å; T78-A86 HydrophobicContact CG2-CB 4.09Å; T78-A87 WeakPolarHBondContact CA-O 3.47Å; T78-K88 HydrophobicContact CG2-CG 4.19Å
79	V	96.8	Very high	94.5	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.9	177.8	-177.6	0	0	0	0	108.4	F32 F42 V47 V50 V77 A86 A87 F89	F32-V79 HydrophobicContact CD1-CG1 4.32Å; F32-V79 HydrophobicContact CE1-CG1 4.2Å; F32-V79 HydrophobicContact CE1-CG2 3.67Å; F32-V79 HydrophobicContact CZ-CG2 4.17Å; F42-V79 HydrophobicContact CE1-CG1 3.97Å; F42-V79 HydrophobicContact CE2-CB 4.36Å; F42-V79 HydrophobicContact CE2-CG1 4.29Å; F42-V79 HydrophobicContact CE2-CG2 4.07Å; F42-V79 HydrophobicContact CZ-CB 4.1Å; F42-V79 HydrophobicContact CZ-CG1 3.78Å; F42-V79 HydrophobicContact CZ-CG2 4.32Å; V47-V79 HydrophobicContact CB-CG1 4.36Å; V47-V79 HydrophobicContact CG1-CG1 3.82Å; V50-V79 HydrophobicContact CG1-CG2 4.37Å; V50-V79 HydrophobicContact CG2-CG1 4.23Å; V50-V79 HydrophobicContact CG2-CG2 4.41Å; V77-V79 HydrophobicContact CG1-CG2 4.23Å; V79-A86 CarbonylContact O-C 3.57Å; V79-A86 WeakPolarHBondContact O-CA 3.4Å; V79-A87 PolarHBondContact N-O 2.87Å; V79-A87 PolarHBondContact O-N 3.3Å; V79-F89 HydrophobicContact CG2-CE2 4.49Å
80	F	95.4	Very high	94.6	Very high	60 Å²	60	48.1 Å²	48.1	26%	0.263	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	114.5	174.7	-61.9	-87.1	0	0	0	109.9	K48 Q49 D51 T78 S85 A86	K48-F80 PolarHBondContact N-O 3.12Å; Q49-F80 HydrophobicContact CB-CB 4.12Å; Q49-F80 HydrophobicContact CB-CD2 3.94Å; Q49-F80 HydrophobicContact CB-CG 4.39Å; Q49-F80 HydrophobicContact CG-CD2 3.88Å; Q49-F80 HydrophobicContact CG-CE2 4.41Å; Q49-F80 PolarHBondContact N-O 2.71Å; Q49-F80 PolarHBondContact O-N 3.41Å; D51-F80 WeakPolarHBondContact OD2-CE2 3.49Å; T78-F80 HydrophobicContact CG2-CD2 4.25Å; T78-F80 HydrophobicContact CG2-CE1 4.16Å; T78-F80 HydrophobicContact CG2-CE2 3.65Å; T78-F80 HydrophobicContact CG2-CZ 3.6Å; F80-S85 WeakPolarHBondContact CA-O 3.35Å; F80-A86 HydrophobicContact CD1-CB 3.85Å; F80-A86 HydrophobicContact CE1-CB 3.79Å
81	N	90.9	Very high	94.6	Very high	41 Å²	41	45.5 Å²	45.5	22%	0.219	26%	0.262	C	S	.	.			trans	-77.7	167.1	176	-63.2	-43	0	0	0	110.9	D83 G84 S85	N81-D83 VanDerWaalsContact CB-OD1 3.24Å; N81-D83 WeakPolarHBondContact CB-OD1 3.39Å; N81-D83 PolarHBondContact O-N 2.91Å; N81-G84 PolarHBondContact O-N 3.21Å; N81-S85 WeakPolarHBondContact CB-OG 3.45Å; N81-S85 PolarHBondContact N-O 3.39Å; N81-S85 PolarHBondContact ND2-OG 3.5Å
82	D	86.5	Confident	94.6	Very high	77 Å²	77	42.7 Å²	42.7	41%	0.412	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.4	-178.7	-74.9	-18.9	0	0	0	113.8	Q29 G84	Q29-D82 PolarHBondContact NE2-OD2 2.9Å; D82-G84 PolarHBondContact O-N 3.22Å
83	D	86.5	Confident	94.5	Very high	126 Å²	126	44 Å²	44	67%	0.674	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-2.9	176.1	66.6	-6.5	0	0	0	113.3	N81 S85	N81-D83 VanDerWaalsContact CB-OD1 3.24Å; N81-D83 WeakPolarHBondContact CB-OD1 3.39Å; N81-D83 PolarHBondContact O-N 2.91Å; D83-S85 VanDerWaalsContact C-N 3.3Å; D83-S85 VanDerWaalsContact OD1-CB 3.23Å; D83-S85 WeakPolarHBondContact OD1-CB 3.27Å; D83-S85 PolarHBondContact OD1-N 3.02Å; D83-S85 PolarHBondContact OD1-OG 2.83Å; D83-S85 PolarHBondContact OD2-OG 2.97Å
84	G	84.2	Confident	94.6	Very high	55 Å²	55	39.1 Å²	39.1	57%	0.567	24%	0.243	S	C	*	.	S	Bend	trans	83.5	1	-176.8	0	0	0	0	0	114.1	N81 D82	N81-G84 PolarHBondContact O-N 3.21Å; D82-G84 PolarHBondContact O-N 3.22Å
85	S	92.6	Very high	94.6	Very high	48 Å²	48	40 Å²	40	34%	0.336	25%	0.25	S	C	.	.			trans	-68.1	145.1	171.7	67.5	0	0	0	0	110.9	F80 N81 D83	F80-S85 WeakPolarHBondContact CA-O 3.35Å; N81-S85 WeakPolarHBondContact CB-OG 3.45Å; N81-S85 PolarHBondContact N-O 3.39Å; N81-S85 PolarHBondContact ND2-OG 3.5Å; D83-S85 VanDerWaalsContact C-N 3.3Å; D83-S85 VanDerWaalsContact OD1-CB 3.23Å; D83-S85 WeakPolarHBondContact OD1-CB 3.27Å; D83-S85 PolarHBondContact OD1-N 3.02Å; D83-S85 PolarHBondContact OD1-OG 2.83Å; D83-S85 PolarHBondContact OD2-OG 2.97Å
86	A	94.9	Very high	94.6	Very high	55 Å²	55	39.5 Å²	39.5	46%	0.455	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.9	178.9	0	0	0	0	0	109.9	T78 V79 F80	T78-A86 HydrophobicContact CG2-CB 4.09Å; V79-A86 CarbonylContact O-C 3.57Å; V79-A86 WeakPolarHBondContact O-CA 3.4Å; F80-A86 HydrophobicContact CD1-CB 3.85Å; F80-A86 HydrophobicContact CE1-CB 3.79Å
87	A	95.6	Very high	94.6	Very high	26 Å²	26	38.9 Å²	38.9	22%	0.215	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.8	172.1	0	0	0	0	0	109.4	F42 T78 V79 F89	F42-A87 HydrophobicContact CZ-CB 4.43Å; T78-A87 WeakPolarHBondContact CA-O 3.47Å; V79-A87 PolarHBondContact N-O 2.87Å; V79-A87 PolarHBondContact O-N 3.3Å; A87-F89 HydrophobicContact CB-CE2 3.6Å; A87-F89 HydrophobicContact CB-CZ 4.11Å
88	K	96.9	Very high	94.6	Very high	115 Å²	115	39.1 Å²	39.1	50%	0.5	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.1	-178	-65.5	-176.4	179.8	-177.3	0	110.6	V76 V77 T78 L114	V76-K88 HydrophobicContact CG1-CB 4.05Å; V76-K88 HydrophobicContact CG1-CD 4.47Å; V76-K88 HydrophobicContact CG1-CG 4.37Å; V77-K88 WeakPolarHBondContact O-CA 3.32Å; T78-K88 HydrophobicContact CG2-CG 4.19Å; K88-L114 HydrophobicContact CB-CD1 3.61Å; K88-L114 HydrophobicContact CB-CG 4.03Å; K88-L114 HydrophobicContact CD-CD1 3.85Å; K88-L114 HydrophobicContact CG-CD1 4.41Å
89	F	97.4	Very high	94.5	Very high	20 Å²	20	40.7 Å²	40.7	9%	0.088	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.2	178.3	-58.6	-91.6	0	0	0	108.9	F34 Y41 F42 V76 V77 V79 A87 F112 P113	F34-F89 HydrophobicContact CD1-CD2 4.46Å; F34-F89 HydrophobicContact CE1-CB 3.88Å; F34-F89 HydrophobicContact CE1-CD1 4.05Å; F34-F89 AromaticContact CE1-CD2 3.86Å; F34-F89 HydrophobicContact CE1-CD2 3.86Å; F34-F89 HydrophobicContact CE1-CE2 4.42Å; F34-F89 AromaticContact CE1-CG 3.65Å; F34-F89 HydrophobicContact CE1-CG 3.65Å; F34-F89 HydrophobicContact CZ-CB 4.21Å; F34-F89 HydrophobicContact CZ-CG 4.42Å; Y41-F89 HydrophobicContact CD1-CD1 4.09Å; Y41-F89 AromaticContact CD1-CE1 3.53Å; Y41-F89 HydrophobicContact CD1-CE1 3.53Å; Y41-F89 HydrophobicContact CD1-CZ 4.28Å; Y41-F89 HydrophobicContact CE1-CD1 4.17Å; Y41-F89 AromaticContact CE1-CE1 3.9Å; Y41-F89 HydrophobicContact CE1-CE1 3.9Å; Y41-F89 HydrophobicContact CG-CE1 4.16Å; F42-F89 AromaticContact CE2-CE2 3.67Å; F42-F89 HydrophobicContact CE2-CE2 3.67Å; F42-F89 AromaticContact CE2-CZ 3.88Å; F42-F89 HydrophobicContact CE2-CZ 3.88Å; F42-F89 HydrophobicContact CZ-CE2 4.25Å; F42-F89 HydrophobicContact CZ-CZ 4.49Å; V76-F89 CarbonylContact C-O 3.55Å; V76-F89 WeakPolarHBondContact CA-O 3.33Å; V77-F89 PolarHBondContact N-O 3.02Å; V77-F89 PolarHBondContact O-N 3.42Å; V79-F89 HydrophobicContact CG2-CE2 4.49Å; A87-F89 HydrophobicContact CB-CE2 3.6Å; A87-F89 HydrophobicContact CB-CZ 4.11Å; F89-F112 CarbonylContact C-O 3.59Å; F89-F112 WeakPolarHBondContact CA-O 3.44Å; F89-P113 HydrophobicContact CD1-CB 4.03Å; F89-P113 HydrophobicContact CD1-CG 4.42Å; F89-P113 HydrophobicContact CE1-CB 4.09Å; F89-P113 HydrophobicContact CE1-CG 4.33Å
90	F	97.8	Very high	94.2	Very high	10 Å²	10	45 Å²	45	4%	0.044	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	137.5	163.4	-171.1	-93.3	0	0	0	109	P74 G75 V76 A111 F112 L114 L117 A154 I155 A158	P74-F90 HydrophobicContact CB-CZ 4.21Å; G75-F90 WeakPolarHBondContact O-CA 3.18Å; V76-F90 HydrophobicContact CG2-CD2 4.46Å; F90-A111 CarbonylContact O-C 3.6Å; F90-A111 WeakPolarHBondContact O-CA 3.34Å; F90-F112 PolarHBondContact N-O 2.88Å; F90-F112 PolarHBondContact O-N 3.32Å; F90-L114 HydrophobicContact CB-CD2 4Å; F90-L117 HydrophobicContact CB-CD1 3.59Å; F90-L117 HydrophobicContact CD1-CD1 4.49Å; F90-L117 HydrophobicContact CG-CD1 4Å; F90-A154 HydrophobicContact CE2-CB 4.02Å; F90-A154 HydrophobicContact CZ-CB 4.12Å; F90-I155 HydrophobicContact CD1-CG1 4.05Å; F90-I155 HydrophobicContact CD2-CG1 4.27Å; F90-I155 HydrophobicContact CE1-CD1 4.02Å; F90-I155 HydrophobicContact CE1-CG1 3.42Å; F90-I155 VanDerWaalsContact CE1-CG1 3.42Å; F90-I155 HydrophobicContact CE2-CB 4.32Å; F90-I155 HydrophobicContact CE2-CG1 3.68Å; F90-I155 HydrophobicContact CG-CG1 4.44Å; F90-I155 HydrophobicContact CZ-CB 4.28Å; F90-I155 HydrophobicContact CZ-CD1 4.21Å; F90-I155 HydrophobicContact CZ-CG1 3.22Å; F90-A158 HydrophobicContact CD2-CB 3.94Å; F90-A158 HydrophobicContact CE2-CB 4.36Å
91	V	97.3	Very high	94	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.1	176.7	174.7	0	0	0	0	108.5	F34 L72 P74 G75 V77 S93 A108 E110 A111	F34-V91 HydrophobicContact CE2-CG2 4.3Å; F34-V91 HydrophobicContact CZ-CG2 3.92Å; L72-V91 HydrophobicContact CD1-CG1 3.83Å; P74-V91 WeakPolarHBondContact CA-O 3.19Å; G75-V91 PolarHBondContact N-O 3.45Å; G75-V91 PolarHBondContact O-N 3.08Å; V77-V91 HydrophobicContact CB-CG2 4.25Å; V77-V91 HydrophobicContact CG2-CB 4.28Å; V77-V91 HydrophobicContact CG2-CG2 3.6Å; V91-S93 WeakPolarHBondContact CG1-O 3.41Å; V91-A108 HydrophobicContact CG1-CB 3.55Å; V91-A108 HydrophobicContact CG2-CB 4.29Å; V91-E110 WeakPolarHBondContact CA-O 3.37Å; V91-A111 HydrophobicContact CG2-CB 3.98Å
92	S	95.2	Very high	93.9	Very high	27 Å²	27	47 Å²	47	19%	0.189	30%	0.301	C	S	.	.			trans	-77.7	-63	176.7	60.5	0	0	0	0	111.6	P74 E110	P74-S92 WeakPolarHBondContact CA-O 3.3Å; P74-S92 WeakPolarHBondContact CD-O 3.34Å; P74-S92 WeakPolarHBondContact CG-O 3.39Å; P74-S92 VanDerWaalsContact N-O 3.09Å; S92-E110 PolarHBondContact N-O 2.9Å; S92-E110 WeakPolarHBondContact OG-CB 3.32Å; S92-E110 PolarHBondContact OG-N 2.93Å; S92-E110 VanDerWaalsContact OG-N 3.13Å; S92-E110 PolarHBondContact OG-O 3.01Å
93	S	95.7	Very high	94.3	Very high	37 Å²	37	44.2 Å²	44.2	26%	0.259	29%	0.288	S	S	.	.	S	Bend	trans	-148.5	174.2	-177.8	85.3	0	0	0	0	108.6	V91 A108 E109	V91-S93 WeakPolarHBondContact CG1-O 3.41Å; S93-A108 CarbonylContact O-C 3.58Å; S93-A108 VanDerWaalsContact O-CA 3.27Å; S93-A108 WeakPolarHBondContact O-CA 3.18Å; S93-E109 PolarHBondContact O-N 3.3Å; S93-E109 VanDerWaalsContact OG-CB 3.22Å; S93-E109 WeakPolarHBondContact OG-CB 3.47Å; S93-E109 PolarHBondContact OG-OE2 2.6Å
94	G	96.6	Very high	94.8	Very high	18 Å²	18	38.3 Å²	38.3	19%	0.186	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.6	-161.5	172.9	0	0	0	0	0	113.2	V71 L72 L107	V71-G94 WeakPolarHBondContact CA-O 3.29Å; V71-G94 WeakPolarHBondContact CG1-O 3.44Å; L72-G94 PolarHBondContact N-O 2.97Å; G94-L107 CarbonylContact C-O 3.58Å; G94-L107 WeakPolarHBondContact CA-O 3.15Å
95	S	97.2	Very high	95.4	Very high	48 Å²	48	39.5 Å²	39.5	34%	0.336	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	154.4	175.5	61.3	0	0	0	0	112	Q70 L107	Q70-S95 WeakPolarHBondContact O-CA 3.47Å; S95-L107 PolarHBondContact N-O 2.95Å; S95-L107 PolarHBondContact O-N 2.61Å
96	I	97.2	Very high	95.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.6	174.3	-178	62.1	0	0	0	108.8	T54 I61 L69 Q70 L72 V104 Q105 L106	T54-I96 HydrophobicContact CG2-CG2 4.36Å; I61-I96 HydrophobicContact CD1-CD1 4.19Å; I61-I96 HydrophobicContact CD1-CG1 3.93Å; L69-I96 WeakPolarHBondContact CA-O 3.23Å; Q70-I96 HydrophobicContact CB-CG2 3.71Å; Q70-I96 PolarHBondContact N-O 3.34Å; Q70-I96 WeakPolarHBondContact O-CG2 3.46Å; Q70-I96 PolarHBondContact O-N 3.43Å; L72-I96 HydrophobicContact CD2-CB 4.14Å; L72-I96 HydrophobicContact CD2-CG2 4.05Å; I96-V104 HydrophobicContact CD1-CG1 3.49Å; I96-V104 VanDerWaalsContact CD1-CG1 3.49Å; I96-Q105 WeakPolarHBondContact CA-O 3.27Å; I96-Q105 WeakPolarHBondContact CD1-O 3.24Å; I96-L106 HydrophobicContact CD1-CB 3.79Å; I96-L106 HydrophobicContact CD1-CD1 4.23Å; I96-L106 HydrophobicContact CD1-CG 4.13Å
97	T	97.5	Very high	95.8	Very high	32 Å²	32	38.4 Å²	38.4	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.5	175.6	-60	0	0	0	0	109.7	L69 V104 Q105	L69-T97 HydrophobicContact CD2-CG2 3.46Å; L69-T97 VanDerWaalsContact CD2-CG2 3.46Å; L69-T97 WeakPolarHBondContact CD2-OG1 3.49Å; T97-V104 CarbonylContact O-C 3.6Å; T97-V104 WeakPolarHBondContact O-CA 3.36Å; T97-Q105 PolarHBondContact N-O 3.49Å; T97-Q105 PolarHBondContact O-N 3.15Å
98	V	96.6	Very high	95.9	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121	171.9	-177.9	0	0	0	0	107.4	I61 H65 P67 T68 V104	I61-V98 HydrophobicContact CD1-CG2 3.85Å; I61-V98 HydrophobicContact CG1-CG2 4.41Å; I61-V98 HydrophobicContact CG2-CG2 4.14Å; H65-V98 HydrophobicContact CB-CG1 4.27Å; P67-V98 CarbonylContact C-O 3.59Å; P67-V98 WeakPolarHBondContact CA-O 3.18Å; T68-V98 PolarHBondContact N-O 2.84Å; T68-V98 PolarHBondContact O-N 2.8Å; V98-V104 HydrophobicContact CG1-CG2 4.24Å; V98-V104 HydrophobicContact CG2-CG1 4.27Å; V98-V104 HydrophobicContact CG2-CG2 4.22Å
99	N	95.1	Very high	95.9	Very high	53 Å²	53	38.1 Å²	38.1	28%	0.283	23%	0.226	S	C	.	.			trans	-98.9	165.5	-178.5	-65.5	-51.4	0	0	0	111.9	D101 S102 S103	N99-D101 WeakPolarHBondContact CB-OD1 3.37Å; N99-D101 PolarHBondContact O-N 2.92Å; N99-S102 PolarHBondContact O-N 2.77Å; N99-S102 VanDerWaalsContact O-N 3.11Å; N99-S103 WeakPolarHBondContact CB-OG 3.42Å; N99-S103 PolarHBondContact N-O 3.26Å; N99-S103 PolarHBondContact ND2-OG 3.43Å
100	A	91.4	Very high	95.8	Very high	91 Å²	91	42.6 Å²	42.6	75%	0.752	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.3	-179.9	0	0	0	0	0	114.1	P67 S102	P67-A100 HydrophobicContact CG-CB 3.92Å; A100-S102 PolarHBondContact O-N 2.85Å
101	D	90.6	Very high	95.7	Very high	119 Å²	119	42.3 Å²	42.3	64%	0.636	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	8.7	174.8	65.5	-5.1	0	0	0	113	N99 S103	N99-D101 WeakPolarHBondContact CB-OD1 3.37Å; N99-D101 PolarHBondContact O-N 2.92Å; D101-S103 PolarHBondContact O-N 3.03Å; D101-S103 VanDerWaalsContact OD1-CB 3.28Å; D101-S103 WeakPolarHBondContact OD1-CB 3.44Å; D101-S103 PolarHBondContact OD1-N 3.19Å; D101-S103 PolarHBondContact OD1-OG 3Å; D101-S103 PolarHBondContact OD2-OG 3.23Å
102	S	89.6	Confident	95.7	Very high	23 Å²	23	46.3 Å²	46.3	16%	0.161	26%	0.264	C	S	.	.	S	Bend	trans	62.5	21.7	-173.1	-52.5	0	0	0	0	114.1	M30 S31 A64 N99 A100	M30-S102 VanDerWaalsContact CB-O 3.27Å; M30-S102 WeakPolarHBondContact CB-O 3.28Å; S31-S102 PolarHBondContact N-O 3.35Å; A64-S102 PolarHBondContact N-OG 3.29Å; N99-S102 PolarHBondContact O-N 2.77Å; N99-S102 VanDerWaalsContact O-N 3.11Å; A100-S102 PolarHBondContact O-N 2.85Å
103	S	94.1	Very high	95.7	Very high	20 Å²	20	46.2 Å²	46.2	14%	0.14	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.8	163.4	64.9	0	0	0	0	110.4	S31 N99 D101	S31-S103 CarbonylContact O-C 3.49Å; S31-S103 WeakPolarHBondContact O-CA 3.44Å; N99-S103 WeakPolarHBondContact CB-OG 3.42Å; N99-S103 PolarHBondContact N-O 3.26Å; N99-S103 PolarHBondContact ND2-OG 3.43Å; D101-S103 PolarHBondContact O-N 3.03Å; D101-S103 VanDerWaalsContact OD1-CB 3.28Å; D101-S103 WeakPolarHBondContact OD1-CB 3.44Å; D101-S103 PolarHBondContact OD1-N 3.19Å; D101-S103 PolarHBondContact OD1-OG 3Å; D101-S103 PolarHBondContact OD2-OG 3.23Å
104	V	97.1	Very high	95.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.012	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.6	-177.8	-178.1	0	0	0	0	109.1	M30 S31 F32 T33 I61 I96 T97 V98	M30-V104 HydrophobicContact CE-CG2 4.45Å; M30-V104 HydrophobicContact SD-CG2 3.74Å; S31-V104 PolarHBondContact O-N 3.06Å; F32-V104 WeakPolarHBondContact CA-O 3.48Å; F32-V104 HydrophobicContact CD2-CB 3.95Å; F32-V104 HydrophobicContact CD2-CG1 3.76Å; F32-V104 HydrophobicContact CE2-CG1 4.03Å; T33-V104 PolarHBondContact N-O 2.95Å; I61-V104 HydrophobicContact CD1-CG1 4.19Å; I61-V104 HydrophobicContact CG2-CG2 3.98Å; I96-V104 HydrophobicContact CD1-CG1 3.49Å; I96-V104 VanDerWaalsContact CD1-CG1 3.49Å; T97-V104 CarbonylContact O-C 3.6Å; T97-V104 WeakPolarHBondContact O-CA 3.36Å; V98-V104 HydrophobicContact CG1-CG2 4.24Å; V98-V104 HydrophobicContact CG2-CG1 4.27Å; V98-V104 HydrophobicContact CG2-CG2 4.22Å
105	Q	97.8	Very high	95.5	Very high	80 Å²	80	52 Å²	52	37%	0.374	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.3	-179	-62	174.8	32.7	0	0	109.4	T33 I96 T97	T33-Q105 CarbonylContact O-C 3.53Å; T33-Q105 WeakPolarHBondContact O-CA 3.43Å; I96-Q105 WeakPolarHBondContact CA-O 3.27Å; I96-Q105 WeakPolarHBondContact CD1-O 3.24Å; T97-Q105 PolarHBondContact N-O 3.49Å; T97-Q105 PolarHBondContact O-N 3.15Å
106	L	97.8	Very high	95.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.3	172.9	-161.5	153.5	0	0	0	108.4	F32 T33 F34 A35 V52 L72 V77 I96 A108	F32-L106 HydrophobicContact CE2-CB 3.82Å; F32-L106 HydrophobicContact CE2-CD1 4.49Å; F32-L106 HydrophobicContact CZ-CB 4.04Å; F32-L106 HydrophobicContact CZ-CD1 4.36Å; T33-L106 PolarHBondContact O-N 3.32Å; F34-L106 VanDerWaalsContact CA-O 3.29Å; F34-L106 WeakPolarHBondContact CA-O 3.46Å; F34-L106 HydrophobicContact CB-CB 4.41Å; F34-L106 HydrophobicContact CD2-CB 4.13Å; F34-L106 HydrophobicContact CD2-CD2 3.34Å; F34-L106 HydrophobicContact CD2-CG 4.27Å; F34-L106 WeakPolarHBondContact CD2-O 3.39Å; F34-L106 HydrophobicContact CE2-CD2 3.34Å; F34-L106 HydrophobicContact CG-CD2 4.27Å; F34-L106 HydrophobicContact CZ-CD2 4.24Å; A35-L106 PolarHBondContact N-O 3.37Å; A35-L106 VanDerWaalsContact N-O 3.1Å; V52-L106 HydrophobicContact CG1-CD1 3.52Å; L72-L106 HydrophobicContact CD1-CD1 4.45Å; L72-L106 HydrophobicContact CD1-CD2 3.67Å; L72-L106 HydrophobicContact CD1-CG 3.95Å; V77-L106 HydrophobicContact CG1-CD1 3.95Å; V77-L106 HydrophobicContact CG2-CD1 3.95Å; I96-L106 HydrophobicContact CD1-CB 3.79Å; I96-L106 HydrophobicContact CD1-CD1 4.23Å; I96-L106 HydrophobicContact CD1-CG 4.13Å; L106-A108 HydrophobicContact CD2-CB 4.27Å
107	L	98	Very high	95.2	Very high	79 Å²	79	57.3 Å²	57.3	41%	0.414	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	103.8	179.6	-59.8	-179.4	0	0	0	107.8	A35 G94 S95	A35-L107 HydrophobicContact CB-CD2 4.18Å; A35-L107 WeakPolarHBondContact O-CA 3.42Å; G94-L107 CarbonylContact C-O 3.58Å; G94-L107 WeakPolarHBondContact CA-O 3.15Å; S95-L107 PolarHBondContact N-O 2.95Å; S95-L107 PolarHBondContact O-N 2.61Å
108	A	97.4	Very high	95	Very high	5 Å²	5	60.5 Å²	60.5	4%	0.041	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	148.1	178.3	0	0	0	0	0	110.7	F34 A35 S36 P37 V91 S93 L106 A111	F34-A108 HydrophobicContact CE2-CB 3.85Å; A35-A108 PolarHBondContact O-N 2.94Å; S36-A108 VanDerWaalsContact CA-O 3.31Å; S36-A108 WeakPolarHBondContact CA-O 3.46Å; P37-A108 WeakPolarHBondContact CD-O 3.43Å; V91-A108 HydrophobicContact CG1-CB 3.55Å; V91-A108 HydrophobicContact CG2-CB 4.29Å; S93-A108 CarbonylContact O-C 3.58Å; S93-A108 VanDerWaalsContact O-CA 3.27Å; S93-A108 WeakPolarHBondContact O-CA 3.18Å; L106-A108 HydrophobicContact CD2-CB 4.27Å; A108-A111 HydrophobicContact CB-CB 3.95Å
109	E	96.3	Very high	94.9	Very high	130 Å²	130	62.5 Å²	62.5	61%	0.607	34%	0.336	S	S	*	.	S	Bend	trans	-72.8	-52.2	169.9	-174.3	167.7	-170.4	0	0	110.5	P37 S93	P37-E109 WeakPolarHBondContact CD-O 3.44Å; S93-E109 PolarHBondContact O-N 3.3Å; S93-E109 VanDerWaalsContact OG-CB 3.22Å; S93-E109 WeakPolarHBondContact OG-CB 3.47Å; S93-E109 PolarHBondContact OG-OE2 2.6Å
110	E	95.2	Very high	94.9	Very high	115 Å²	115	63.1 Å²	63.1	54%	0.537	35%	0.348	S	S	.	.	S	Bend	trans	-128.3	141.2	167.3	-55.6	-172.2	155.2	0	0	109.9	V91 S92 F112	V91-E110 WeakPolarHBondContact CA-O 3.37Å; S92-E110 PolarHBondContact N-O 2.9Å; S92-E110 WeakPolarHBondContact OG-CB 3.32Å; S92-E110 PolarHBondContact OG-N 2.93Å; S92-E110 VanDerWaalsContact OG-N 3.13Å; S92-E110 PolarHBondContact OG-O 3.01Å; E110-F112 HydrophobicContact CB-CE2 4.2Å
111	A	96.6	Very high	95.1	Very high	3 Å²	3	60.8 Å²	60.8	3%	0.025	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	143.3	172.6	0	0	0	0	0	110.3	F34 Y41 F90 V91 A108	F34-A111 HydrophobicContact CE2-CB 3.94Å; F34-A111 HydrophobicContact CZ-CB 3.51Å; Y41-A111 HydrophobicContact CE2-CB 3.87Å; Y41-A111 PolarHBondContact OH-O 2.95Å; F90-A111 CarbonylContact O-C 3.6Å; F90-A111 WeakPolarHBondContact O-CA 3.34Å; V91-A111 HydrophobicContact CG2-CB 3.98Å; A108-A111 HydrophobicContact CB-CB 3.95Å
112	F	96.2	Very high	95.2	Very high	84 Å²	84	55.4 Å²	55.4	37%	0.368	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.8	178.9	-64.9	-81	0	0	0	110.1	F89 F90 E110 L117	F89-F112 CarbonylContact C-O 3.59Å; F89-F112 WeakPolarHBondContact CA-O 3.44Å; F90-F112 PolarHBondContact N-O 2.88Å; F90-F112 PolarHBondContact O-N 3.32Å; E110-F112 HydrophobicContact CB-CE2 4.2Å; F112-L117 HydrophobicContact CB-CD2 4.22Å
113	P	96.1	Very high	95.5	Very high	25 Å²	25	58.2 Å²	58.2	16%	0.162	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	151.5	167.6	16.1	-6.7	0	0	0	110.2	F89 D115 Q116	F89-P113 HydrophobicContact CD1-CB 4.03Å; F89-P113 HydrophobicContact CD1-CG 4.42Å; F89-P113 HydrophobicContact CE1-CB 4.09Å; F89-P113 HydrophobicContact CE1-CG 4.33Å; P113-D115 VanDerWaalsContact CB-OD1 3.27Å; P113-D115 WeakPolarHBondContact CB-OD1 3.45Å; P113-D115 PolarHBondContact O-N 2.99Å; P113-D115 VanDerWaalsContact O-N 3.15Å; P113-Q116 HydrophobicContact CG-CG 4.3Å; P113-Q116 PolarHBondContact O-N 2.84Å; P113-Q116 VanDerWaalsContact O-N 3.1Å
114	L	94.2	Very high	95.7	Very high	39 Å²	39	59.9 Å²	59.9	20%	0.204	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-63.6	-23.7	-169	-61.4	-178.3	0	0	0	113.8	V76 K88 F90 Q116 L117 A158 L159	V76-L114 HydrophobicContact CG2-CD2 4.26Å; K88-L114 HydrophobicContact CB-CD1 3.61Å; K88-L114 HydrophobicContact CB-CG 4.03Å; K88-L114 HydrophobicContact CD-CD1 3.85Å; K88-L114 HydrophobicContact CG-CD1 4.41Å; F90-L114 HydrophobicContact CB-CD2 4Å; L114-Q116 PolarHBondContact O-N 2.84Å; L114-L117 HydrophobicContact CD2-CD1 4.34Å; L114-L117 PolarHBondContact O-N 2.85Å; L114-A158 HydrophobicContact CD2-CB 4.35Å; L114-L159 HydrophobicContact CB-CD2 4.36Å
115	D	94.3	Very high	95.6	Very high	138 Å²	138	63.7 Å²	63.7	74%	0.738	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-71.9	-15	178.2	63.5	-26	0	0	0	113.8	P113	P113-D115 VanDerWaalsContact CB-OD1 3.27Å; P113-D115 WeakPolarHBondContact CB-OD1 3.45Å; P113-D115 PolarHBondContact O-N 2.99Å; P113-D115 VanDerWaalsContact O-N 3.15Å
116	Q	93.4	Very high	95.5	Very high	120 Å²	120	61.2 Å²	61.2	56%	0.561	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-93.1	-1.7	177.6	-62.9	-175.7	15.7	0	0	113.4	P113 L114	P113-Q116 HydrophobicContact CG-CG 4.3Å; P113-Q116 PolarHBondContact O-N 2.84Å; P113-Q116 VanDerWaalsContact O-N 3.1Å; L114-Q116 PolarHBondContact O-N 2.84Å
117	L	93.6	Very high	95.4	Very high	41 Å²	41	67.2 Å²	67.2	22%	0.215	36%	0.362	C	S	.	.			trans	-100.7	137.5	-177.9	-59.7	176.3	0	0	0	111.2	F90 F112 L114 I155 L159	F90-L117 HydrophobicContact CB-CD1 3.59Å; F90-L117 HydrophobicContact CD1-CD1 4.49Å; F90-L117 HydrophobicContact CG-CD1 4Å; F112-L117 HydrophobicContact CB-CD2 4.22Å; L114-L117 HydrophobicContact CD2-CD1 4.34Å; L114-L117 PolarHBondContact O-N 2.85Å; L117-I155 HydrophobicContact CD1-CG2 4.39Å; L117-L159 HydrophobicContact CB-CD1 3.75Å; L117-L159 HydrophobicContact CB-CD2 3.91Å; L117-L159 HydrophobicContact CB-CG 4.39Å; L117-L159 HydrophobicContact CD1-CD2 4.29Å
118	D	94.6	Very high	95.3	Very high	98 Å²	98	69.5 Å²	69.5	52%	0.524	37%	0.369	S	S	.	.			trans	-101.8	121.7	175.4	176.1	25.3	0	0	0	111.3	A120 A121 A122	D118-A120 VanDerWaalsContact C-N 3.33Å; D118-A120 PolarHBondContact O-N 3.41Å; D118-A120 PolarHBondContact OD1-N 3.01Å; D118-A121 HydrophobicContact CB-CB 4.08Å; D118-A121 WeakPolarHBondContact OD2-CB 3.29Å; D118-A121 PolarHBondContact OD2-N 3.3Å; D118-A121 VanDerWaalsContact OD2-N 3.16Å; D118-A122 WeakPolarHBondContact O-CB 3.46Å; D118-A122 PolarHBondContact O-N 3.03Å
119	V	93.8	Very high	95.2	Very high	48 Å²	48	69.5 Å²	69.5	29%	0.291	37%	0.368	S	S	.	.	H	α-helix	trans	-63.3	-39.3	177.9	-176.6	0	0	0	0	111.6	A122 K123 L159	V119-A122 PolarHBondContact O-N 2.94Å; V119-K123 HydrophobicContact CG1-CD 4.11Å; V119-K123 HydrophobicContact CG1-CG 4.42Å; V119-K123 WeakPolarHBondContact O-CG 3.31Å; V119-K123 PolarHBondContact O-N 3.13Å; V119-L159 HydrophobicContact CB-CD1 4.41Å; V119-L159 HydrophobicContact CG2-CB 3.47Å; V119-L159 VanDerWaalsContact CG2-CB 3.47Å; V119-L159 HydrophobicContact CG2-CD1 3.65Å; V119-L159 HydrophobicContact CG2-CG 4.14Å
120	A	94.8	Very high	95.1	Very high	65 Å²	65	68.3 Å²	68.3	54%	0.537	36%	0.363	S	S	.	.	H	α-helix	trans	-67.3	-45.7	-176.5	0	0	0	0	0	110.7	D118 K123 A124	D118-A120 VanDerWaalsContact C-N 3.33Å; D118-A120 PolarHBondContact O-N 3.41Å; D118-A120 PolarHBondContact OD1-N 3.01Å; A120-K123 PolarHBondContact O-N 2.76Å; A120-A124 PolarHBondContact O-N 3.28Å
121	A	94.8	Very high	95.1	Very high	43 Å²	43	67 Å²	67	36%	0.355	37%	0.367	S	S	.	.	H	α-helix	trans	-59.5	-44.1	172.6	0	0	0	0	0	112.4	D118 K123 A124 N125	D118-A121 HydrophobicContact CB-CB 4.08Å; D118-A121 WeakPolarHBondContact OD2-CB 3.29Å; D118-A121 PolarHBondContact OD2-N 3.3Å; D118-A121 VanDerWaalsContact OD2-N 3.16Å; A121-K123 PolarHBondContact O-N 2.98Å; A121-A124 PolarHBondContact O-N 2.84Å; A121-N125 WeakPolarHBondContact O-CB 3.47Å; A121-N125 VanDerWaalsContact O-CG 3.23Å; A121-N125 PolarHBondContact O-N 3.15Å; A121-N125 PolarHBondContact O-ND2 3.14Å
122	A	94.3	Very high	94.9	Very high	5 Å²	5	70.2 Å²	70.2	4%	0.041	38%	0.381	C	S	.	.	H	α-helix	trans	-61.7	-42.8	179	0	0	0	0	0	112.6	D118 V119 N125 L126 I155 V156	D118-A122 WeakPolarHBondContact O-CB 3.46Å; D118-A122 PolarHBondContact O-N 3.03Å; V119-A122 PolarHBondContact O-N 2.94Å; A122-N125 PolarHBondContact O-N 2.85Å; A122-L126 WeakPolarHBondContact O-CB 3.29Å; A122-L126 PolarHBondContact O-N 2.81Å; A122-I155 HydrophobicContact CB-CB 4.26Å; A122-I155 HydrophobicContact CB-CG2 3.56Å; A122-V156 HydrophobicContact CB-CG2 3.89Å
123	K	95.9	Very high	94.7	Very high	83 Å²	83	68.5 Å²	68.5	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-65.6	-43.1	176.6	-72.4	-177.3	178.2	-172.3	0	112.2	V119 A120 A121 N125 L126 E127 V156 E160	V119-K123 HydrophobicContact CG1-CD 4.11Å; V119-K123 HydrophobicContact CG1-CG 4.42Å; V119-K123 WeakPolarHBondContact O-CG 3.31Å; V119-K123 PolarHBondContact O-N 3.13Å; A120-K123 PolarHBondContact O-N 2.76Å; A121-K123 PolarHBondContact O-N 2.98Å; K123-N125 VanDerWaalsContact C-N 3.33Å; K123-N125 PolarHBondContact O-N 2.63Å; K123-L126 WeakPolarHBondContact O-CB 3.18Å; K123-L126 PolarHBondContact O-N 3.22Å; K123-E127 WeakPolarHBondContact O-CG 3.38Å; K123-E127 PolarHBondContact O-N 3.27Å; K123-V156 HydrophobicContact CG-CG1 4.24Å; K123-V156 HydrophobicContact CG-CG2 3.78Å; K123-E160 VanDerWaalsContact CE-OE1 3.28Å; K123-E160 WeakPolarHBondContact CE-OE1 3.15Å; K123-E160 IonicContact NZ-OE1 3.77Å; K123-E160 PolarHBondContact NZ-OE1 3.48Å
124	A	96.8	Very high	94.2	Very high	54 Å²	54	72 Å²	72	45%	0.446	41%	0.406	S	S	.	.	H	α-helix	trans	-62.1	-40.4	175.9	0	0	0	0	0	112.2	A120 A121 E127 K128	A120-A124 PolarHBondContact O-N 3.28Å; A121-A124 PolarHBondContact O-N 2.84Å; A124-E127 PolarHBondContact O-N 2.8Å; A124-K128 WeakPolarHBondContact O-CB 3.3Å; A124-K128 PolarHBondContact O-N 3.1Å
125	N	95.8	Very high	94	Very high	83 Å²	83	74.5 Å²	74.5	44%	0.444	43%	0.427	S	S	.	.	H	α-helix	trans	-66.3	-39.2	175.8	-71.6	-20.2	0	0	0	112.3	A121 A122 K123 K128 A129 N152	A121-N125 WeakPolarHBondContact O-CB 3.47Å; A121-N125 VanDerWaalsContact O-CG 3.23Å; A121-N125 PolarHBondContact O-N 3.15Å; A121-N125 PolarHBondContact O-ND2 3.14Å; A122-N125 PolarHBondContact O-N 2.85Å; K123-N125 VanDerWaalsContact C-N 3.33Å; K123-N125 PolarHBondContact O-N 2.63Å; N125-K128 PolarHBondContact O-N 3.46Å; N125-A129 WeakPolarHBondContact O-CB 3.22Å; N125-A129 PolarHBondContact O-N 3.36Å; N125-N152 VanDerWaalsContact CB-OD1 3.23Å; N125-N152 WeakPolarHBondContact CB-OD1 3.13Å
126	L	95.7	Very high	93.8	Very high	27 Å²	27	68.6 Å²	68.6	14%	0.141	40%	0.397	C	S	.	.	H	α-helix	trans	-60.3	-50.6	174.9	-174.5	164	0	0	0	111	A122 K123 K128 A129 Q130 N152 E153 V156	A122-L126 WeakPolarHBondContact O-CB 3.29Å; A122-L126 PolarHBondContact O-N 2.81Å; K123-L126 WeakPolarHBondContact O-CB 3.18Å; K123-L126 PolarHBondContact O-N 3.22Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 3.27Å; L126-A129 PolarHBondContact O-N 3.05Å; L126-Q130 HydrophobicContact CD2-CG 3.98Å; L126-Q130 VanDerWaalsContact CD2-NE2 3.27Å; L126-Q130 WeakPolarHBondContact O-CG 3.49Å; L126-Q130 PolarHBondContact O-N 3.43Å; L126-N152 HydrophobicContact CB-CB 3.95Å; L126-E153 HydrophobicContact CD1-CB 4.28Å; L126-V156 HydrophobicContact CD1-CG2 4.14Å
127	E	96.1	Very high	93.6	Very high	126 Å²	126	67.2 Å²	67.2	59%	0.589	40%	0.4	S	S	*	.	H	α-helix	trans	-60.1	-39.8	178.8	-71.9	176.2	-175.9	0	0	112	K123 A124 S131	K123-E127 WeakPolarHBondContact O-CG 3.38Å; K123-E127 PolarHBondContact O-N 3.27Å; A124-E127 PolarHBondContact O-N 2.8Å; E127-S131 PolarHBondContact O-N 3.34Å; E127-S131 PolarHBondContact O-OG 3.18Å
128	K	95.8	Very high	93.6	Very high	128 Å²	128	70.3 Å²	70.3	56%	0.557	42%	0.417	S	S	*	.	H	α-helix	trans	-62.3	-50.1	174.5	-177.7	-177.4	169.7	-169.3	0	111.5	A124 N125 L126 Q130 S131 E132	A124-K128 WeakPolarHBondContact O-CB 3.3Å; A124-K128 PolarHBondContact O-N 3.1Å; N125-K128 PolarHBondContact O-N 3.46Å; L126-K128 VanDerWaalsContact C-N 3.28Å; L126-K128 PolarHBondContact O-N 3.27Å; K128-Q130 VanDerWaalsContact C-N 3.32Å; K128-Q130 PolarHBondContact O-N 3.03Å; K128-S131 WeakPolarHBondContact O-CB 3.36Å; K128-S131 PolarHBondContact O-N 2.79Å; K128-S131 VanDerWaalsContact O-N 3.11Å; K128-E132 WeakPolarHBondContact CE-OE1 3.42Å; K128-E132 IonicContact NZ-OE1 2.75Å; K128-E132 WeakPolarHBondContact O-CG 3.45Å; K128-E132 PolarHBondContact O-N 2.88Å
129	A	95	Very high	93.5	Very high	4 Å²	4	72.3 Å²	72.3	3%	0.033	42%	0.424	C	S	.	.	H	α-helix	trans	-62.2	-39.1	179.8	0	0	0	0	0	111.9	N125 L126 S131 E132 M133 V145 N148 I149	N125-A129 WeakPolarHBondContact O-CB 3.22Å; N125-A129 PolarHBondContact O-N 3.36Å; L126-A129 PolarHBondContact O-N 3.05Å; A129-S131 VanDerWaalsContact C-N 3.32Å; A129-S131 PolarHBondContact O-N 2.97Å; A129-E132 PolarHBondContact O-N 2.75Å; A129-M133 PolarHBondContact O-N 2.94Å; A129-M133 VanDerWaalsContact O-N 3.12Å; A129-V145 WeakPolarHBondContact O-CG1 3.32Å; A129-N148 HydrophobicContact CB-CB 4.35Å; A129-I149 HydrophobicContact CB-CG1 3.72Å
130	Q	94.9	Very high	93.6	Very high	105 Å²	105	73.3 Å²	73.3	49%	0.491	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-37	173.9	-74.7	-178.2	-15.8	0	0	112.8	L126 K128 M133 I149	L126-Q130 HydrophobicContact CD2-CG 3.98Å; L126-Q130 VanDerWaalsContact CD2-NE2 3.27Å; L126-Q130 WeakPolarHBondContact O-CG 3.49Å; L126-Q130 PolarHBondContact O-N 3.43Å; K128-Q130 VanDerWaalsContact C-N 3.32Å; K128-Q130 PolarHBondContact O-N 3.03Å; Q130-M133 WeakPolarHBondContact O-CB 3.33Å; Q130-M133 PolarHBondContact O-N 2.87Å; Q130-I149 HydrophobicContact CG-CD1 4.16Å; Q130-I149 HydrophobicContact CG-CG1 4.29Å
131	S	94	Very high	93.5	Very high	88 Å²	88	71.8 Å²	71.8	62%	0.615	42%	0.424	S	S	*	.	H	α-helix	trans	-68.5	-37.9	176	-57.7	0	0	0	0	111.8	E127 K128 A129 M133 A134	E127-S131 PolarHBondContact O-N 3.34Å; E127-S131 PolarHBondContact O-OG 3.18Å; K128-S131 WeakPolarHBondContact O-CB 3.36Å; K128-S131 PolarHBondContact O-N 2.79Å; K128-S131 VanDerWaalsContact O-N 3.11Å; A129-S131 VanDerWaalsContact C-N 3.32Å; A129-S131 PolarHBondContact O-N 2.97Å; S131-M133 VanDerWaalsContact C-N 3.31Å; S131-M133 PolarHBondContact O-N 2.78Å; S131-A134 PolarHBondContact O-N 2.88Å
132	E	93.2	Very high	93.5	Very high	71 Å²	71	75.1 Å²	75.1	33%	0.332	43%	0.428	S	S	.	.	H	α-helix	trans	-65.5	-32.8	177.1	-72.2	172.7	-179.3	0	0	112.3	K128 A129 A134 S135 A136 V145	K128-E132 WeakPolarHBondContact CE-OE1 3.42Å; K128-E132 IonicContact NZ-OE1 2.75Å; K128-E132 WeakPolarHBondContact O-CG 3.45Å; K128-E132 PolarHBondContact O-N 2.88Å; A129-E132 PolarHBondContact O-N 2.75Å; E132-A134 PolarHBondContact O-N 3.18Å; E132-S135 WeakPolarHBondContact O-CA 3.43Å; E132-S135 PolarHBondContact O-N 2.81Å; E132-S135 PolarHBondContact O-OG 3.26Å; E132-A136 PolarHBondContact O-N 2.89Å; E132-V145 HydrophobicContact CB-CG1 4.18Å; E132-V145 HydrophobicContact CB-CG2 4.29Å
133	M	91.6	Very high	93.6	Very high	48 Å²	48	77.1 Å²	77.1	24%	0.236	44%	0.444	C	S	.	.	H	α-helix	trans	-57.8	-37.8	178.9	-178.5	63.9	79.5	0	0	112.1	A129 Q130 S131 S135 A136 R142 V145 Q146 I149	A129-M133 PolarHBondContact O-N 2.94Å; A129-M133 VanDerWaalsContact O-N 3.12Å; Q130-M133 WeakPolarHBondContact O-CB 3.33Å; Q130-M133 PolarHBondContact O-N 2.87Å; S131-M133 VanDerWaalsContact C-N 3.31Å; S131-M133 PolarHBondContact O-N 2.78Å; M133-S135 PolarHBondContact O-N 2.84Å; M133-A136 PolarHBondContact O-N 3.4Å; M133-R142 HydrophobicContact SD-CB 4.44Å; M133-V145 HydrophobicContact CB-CG1 3.84Å; M133-V145 HydrophobicContact CE-CB 4.15Å; M133-V145 HydrophobicContact CE-CG1 3.98Å; M133-V145 HydrophobicContact SD-CB 4.47Å; M133-V145 HydrophobicContact SD-CG1 4.4Å; M133-Q146 HydrophobicContact CE-CB 3.8Å; M133-Q146 HydrophobicContact CE-CG 4.47Å; M133-I149 HydrophobicContact CB-CD1 4.12Å; M133-I149 HydrophobicContact CE-CD1 3.67Å
134	A	86.5	Confident	93.5	Very high	98 Å²	98	79.1 Å²	79.1	81%	0.81	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.9	177.7	0	0	0	0	0	113.3	S131 E132	S131-A134 PolarHBondContact O-N 2.88Å; E132-A134 PolarHBondContact O-N 3.18Å
135	S	88.7	Confident	93.5	Very high	92 Å²	92	77.3 Å²	77.3	64%	0.643	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-9.7	-178	67.9	0	0	0	0	114.3	E132 M133 S137	E132-S135 WeakPolarHBondContact O-CA 3.43Å; E132-S135 PolarHBondContact O-N 2.81Å; E132-S135 PolarHBondContact O-OG 3.26Å; M133-S135 PolarHBondContact O-N 2.84Å; S135-S137 PolarHBondContact O-N 2.89Å
136	A	89.9	Confident	93.5	Very high	14 Å²	14	77.4 Å²	77.4	12%	0.116	44%	0.436	C	S	.	.			trans	-72.4	113.1	-177.5	0	0	0	0	0	112	E132 M133 A141 R142	E132-A136 PolarHBondContact O-N 2.89Å; M133-A136 PolarHBondContact O-N 3.4Å; A136-A141 HydrophobicContact CB-CB 4.23Å; A136-R142 HydrophobicContact CB-CB 4.47Å; A136-R142 HydrophobicContact CB-CG 3.59Å; A136-R142 PolarHBondContact O-NE 3.1Å
137	S	89.2	Confident	93.5	Very high	90 Å²	90	81.3 Å²	81.3	63%	0.629	46%	0.456	S	S	*	.			trans	-80.5	-37.1	-176.2	61.8	0	0	0	0	113.5	S135	S135-S137 PolarHBondContact O-N 2.89Å
138	D	94.3	Very high	93.4	Very high	106 Å²	106	79.1 Å²	79.1	57%	0.567	45%	0.448	S	S	*	.	S	Bend	trans	-110.1	152.2	-168.2	-60.1	1.6	0	0	0	110.8	A140 A141 R142	D138-A140 VanDerWaalsContact C-N 3.32Å; D138-A140 PolarHBondContact O-N 3.28Å; D138-A141 PolarHBondContact O-N 2.79Å; D138-A141 VanDerWaalsContact O-N 3.15Å; D138-R142 PolarHBondContact O-N 2.8Å
139	E	93.6	Very high	93.4	Very high	141 Å²	141	73.7 Å²	73.7	66%	0.659	43%	0.425	S	S	*	.	H	α-helix	trans	-61	-40	-175.8	-172.5	60.6	-161.3	0	0	112.7	A141 R142 A143	E139-A141 PolarHBondContact O-N 3.5Å; E139-R142 PolarHBondContact O-N 2.82Å; E139-A143 PolarHBondContact O-N 2.9Å
140	A	94.1	Very high	93.4	Very high	68 Å²	68	75.9 Å²	75.9	56%	0.562	44%	0.436	S	S	*	.	H	α-helix	trans	-62.2	-44	176.4	0	0	0	0	0	111.7	D138 R142 A143 E144	D138-A140 VanDerWaalsContact C-N 3.32Å; D138-A140 PolarHBondContact O-N 3.28Å; A140-R142 VanDerWaalsContact C-N 3.34Å; A140-R142 PolarHBondContact O-N 2.85Å; A140-A143 PolarHBondContact O-N 3.24Å; A140-E144 WeakPolarHBondContact O-CG 3.2Å; A140-E144 PolarHBondContact O-N 3.23Å
141	A	93.8	Very high	93.5	Very high	34 Å²	34	72 Å²	72	28%	0.281	42%	0.422	S	S	.	.	H	α-helix	trans	-64.3	-39.1	177.5	0	0	0	0	0	111.6	A136 D138 E139 E144 V145	A136-A141 HydrophobicContact CB-CB 4.23Å; D138-A141 PolarHBondContact O-N 2.79Å; D138-A141 VanDerWaalsContact O-N 3.15Å; E139-A141 PolarHBondContact O-N 3.5Å; A141-E144 PolarHBondContact O-N 2.89Å; A141-V145 VanDerWaalsContact O-CG2 3.28Å; A141-V145 WeakPolarHBondContact O-CG2 3.22Å; A141-V145 PolarHBondContact O-N 3.43Å
142	R	94.8	Very high	93.6	Very high	113 Å²	113	68.9 Å²	68.9	43%	0.426	40%	0.398	S	S	.	.	H	α-helix	trans	-63.6	-41.6	174.4	-70.7	178.9	-172.2	164.9	3.4	112.1	M133 A136 D138 E139 A140 V145 Q146	M133-R142 HydrophobicContact SD-CB 4.44Å; A136-R142 HydrophobicContact CB-CB 4.47Å; A136-R142 HydrophobicContact CB-CG 3.59Å; A136-R142 PolarHBondContact O-NE 3.1Å; D138-R142 PolarHBondContact O-N 2.8Å; E139-R142 PolarHBondContact O-N 2.82Å; A140-R142 VanDerWaalsContact C-N 3.34Å; A140-R142 PolarHBondContact O-N 2.85Å; R142-V145 PolarHBondContact O-N 3.43Å; R142-Q146 WeakPolarHBondContact O-CB 3.34Å; R142-Q146 PolarHBondContact O-N 3.02Å
143	A	95.5	Very high	93.7	Very high	46 Å²	46	70.8 Å²	70.8	38%	0.38	41%	0.407	S	S	.	.	H	α-helix	trans	-63.5	-42.8	177.5	0	0	0	0	0	111.8	E139 A140 Q146 I147	E139-A143 PolarHBondContact O-N 2.9Å; A140-A143 PolarHBondContact O-N 3.24Å; A143-Q146 PolarHBondContact O-N 2.83Å; A143-I147 VanDerWaalsContact O-CG1 3.29Å; A143-I147 WeakPolarHBondContact O-CG1 3.45Å; A143-I147 PolarHBondContact O-N 3.05Å
144	E	94.2	Very high	93.9	Very high	126 Å²	126	69.5 Å²	69.5	59%	0.589	40%	0.404	S	S	*	.	H	α-helix	trans	-61.8	-46.5	175.6	-72.4	173.9	-171.7	0	0	111.9	A140 A141 Q146 I147 N148	A140-E144 WeakPolarHBondContact O-CG 3.2Å; A140-E144 PolarHBondContact O-N 3.23Å; A141-E144 PolarHBondContact O-N 2.89Å; E144-Q146 VanDerWaalsContact C-N 3.3Å; E144-Q146 PolarHBondContact O-N 2.85Å; E144-I147 PolarHBondContact O-N 2.89Å; E144-N148 PolarHBondContact O-N 3.01Å
145	V	96.4	Very high	94.3	Very high	16 Å²	16	66.3 Å²	66.3	10%	0.097	37%	0.373	C	S	.	.	H	α-helix	trans	-65	-37.3	177.2	-179.2	0	0	0	0	110.9	A129 E132 M133 A141 R142 I147 N148 I149	A129-V145 WeakPolarHBondContact O-CG1 3.32Å; E132-V145 HydrophobicContact CB-CG1 4.18Å; E132-V145 HydrophobicContact CB-CG2 4.29Å; M133-V145 HydrophobicContact CB-CG1 3.84Å; M133-V145 HydrophobicContact CE-CB 4.15Å; M133-V145 HydrophobicContact CE-CG1 3.98Å; M133-V145 HydrophobicContact SD-CB 4.47Å; M133-V145 HydrophobicContact SD-CG1 4.4Å; A141-V145 VanDerWaalsContact O-CG2 3.28Å; A141-V145 WeakPolarHBondContact O-CG2 3.22Å; A141-V145 PolarHBondContact O-N 3.43Å; R142-V145 PolarHBondContact O-N 3.43Å; V145-I147 PolarHBondContact O-N 3.29Å; V145-N148 WeakPolarHBondContact O-CB 3.27Å; V145-N148 PolarHBondContact O-N 3.06Å; V145-I149 HydrophobicContact CG1-CD1 4.13Å; V145-I149 HydrophobicContact CG1-CG1 4.45Å; V145-I149 WeakPolarHBondContact O-CG1 3.41Å; V145-I149 PolarHBondContact O-N 3.27Å
146	Q	95.8	Very high	94.7	Very high	85 Å²	85	62.6 Å²	62.6	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-44	175.3	-169.4	59	54.3	0	0	111.6	M133 R142 A143 E144 N148 I149 D150	M133-Q146 HydrophobicContact CE-CB 3.8Å; M133-Q146 HydrophobicContact CE-CG 4.47Å; R142-Q146 WeakPolarHBondContact O-CB 3.34Å; R142-Q146 PolarHBondContact O-N 3.02Å; A143-Q146 PolarHBondContact O-N 2.83Å; E144-Q146 VanDerWaalsContact C-N 3.3Å; E144-Q146 PolarHBondContact O-N 2.85Å; Q146-N148 VanDerWaalsContact C-N 3.27Å; Q146-N148 PolarHBondContact O-N 3.07Å; Q146-I149 PolarHBondContact O-N 2.96Å; Q146-D150 PolarHBondContact NE2-OD1 3.36Å; Q146-D150 WeakPolarHBondContact O-CB 3.45Å; Q146-D150 PolarHBondContact O-N 3.38Å
147	I	95.4	Very high	94.9	Very high	109 Å²	109	69.8 Å²	69.8	56%	0.559	38%	0.375	S	S	*	.	H	α-helix	trans	-60	-41.2	175.9	-68.7	162.1	0	0	0	110.4	A143 E144 V145 D150 A151	A143-I147 VanDerWaalsContact O-CG1 3.29Å; A143-I147 WeakPolarHBondContact O-CG1 3.45Å; A143-I147 PolarHBondContact O-N 3.05Å; E144-I147 PolarHBondContact O-N 2.89Å; V145-I147 PolarHBondContact O-N 3.29Å; I147-D150 PolarHBondContact O-N 2.91Å; I147-A151 WeakPolarHBondContact O-CB 3.43Å; I147-A151 PolarHBondContact O-N 2.93Å
148	N	95.1	Very high	95.2	Very high	79 Å²	79	66.5 Å²	66.5	42%	0.422	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-40.8	176.7	-72	-19.8	0	0	0	112.4	A129 E144 V145 Q146 N152	A129-N148 HydrophobicContact CB-CB 4.35Å; E144-N148 PolarHBondContact O-N 3.01Å; V145-N148 WeakPolarHBondContact O-CB 3.27Å; V145-N148 PolarHBondContact O-N 3.06Å; Q146-N148 VanDerWaalsContact C-N 3.27Å; Q146-N148 PolarHBondContact O-N 3.07Å; N148-N152 PolarHBondContact O-N 2.9Å; N148-N152 VanDerWaalsContact O-N 3.08Å; N148-N152 PolarHBondContact O-ND2 3.09Å
149	I	96.3	Very high	95.1	Very high	14 Å²	14	63.5 Å²	63.5	7%	0.072	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-50.6	175	-69.3	169.1	0	0	0	109.8	A129 Q130 M133 V145 Q146 A151 N152 E153	A129-I149 HydrophobicContact CB-CG1 3.72Å; Q130-I149 HydrophobicContact CG-CD1 4.16Å; Q130-I149 HydrophobicContact CG-CG1 4.29Å; M133-I149 HydrophobicContact CB-CD1 4.12Å; M133-I149 HydrophobicContact CE-CD1 3.67Å; V145-I149 HydrophobicContact CG1-CD1 4.13Å; V145-I149 HydrophobicContact CG1-CG1 4.45Å; V145-I149 WeakPolarHBondContact O-CG1 3.41Å; V145-I149 PolarHBondContact O-N 3.27Å; Q146-I149 PolarHBondContact O-N 2.96Å; I149-A151 VanDerWaalsContact C-N 3.27Å; I149-A151 PolarHBondContact O-N 3.45Å; I149-N152 PolarHBondContact O-N 3.48Å; I149-E153 WeakPolarHBondContact O-CB 3.33Å; I149-E153 PolarHBondContact O-N 3.3Å
150	D	95.3	Very high	94.7	Very high	50 Å²	50	65.2 Å²	65.2	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-57.3	-40.8	-179.5	-77.3	19.4	0	0	0	112	R73 Q146 I147 A154	R73-D150 IonicContact NH2-OD2 3.97Å; Q146-D150 PolarHBondContact NE2-OD1 3.36Å; Q146-D150 WeakPolarHBondContact O-CB 3.45Å; Q146-D150 PolarHBondContact O-N 3.38Å; I147-D150 PolarHBondContact O-N 2.91Å; D150-A154 WeakPolarHBondContact O-CB 3.33Å; D150-A154 PolarHBondContact O-N 3.48Å; D150-A154 VanDerWaalsContact O-N 3.07Å
151	A	95.2	Very high	94.8	Very high	24 Å²	24	65.1 Å²	65.1	20%	0.198	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-48.4	177.7	0	0	0	0	0	112.2	P74 I147 I149 A154 I155	P74-A151 HydrophobicContact CB-CB 4.29Å; P74-A151 HydrophobicContact CG-CB 4.11Å; I147-A151 WeakPolarHBondContact O-CB 3.43Å; I147-A151 PolarHBondContact O-N 2.93Å; I149-A151 VanDerWaalsContact C-N 3.27Å; I149-A151 PolarHBondContact O-N 3.45Å; A151-A154 PolarHBondContact O-N 3.11Å; A151-I155 WeakPolarHBondContact O-CG1 3.37Å; A151-I155 PolarHBondContact O-N 3.27Å
152	N	96.3	Very high	94.8	Very high	23 Å²	23	66.7 Å²	66.7	12%	0.123	34%	0.337	C	S	.	.	H	α-helix	trans	-68.2	-37.5	-179.9	-74.6	-73.5	0	0	0	112.2	N125 L126 N148 I149 A154 I155 V156	N125-N152 VanDerWaalsContact CB-OD1 3.23Å; N125-N152 WeakPolarHBondContact CB-OD1 3.13Å; L126-N152 HydrophobicContact CB-CB 3.95Å; N148-N152 PolarHBondContact O-N 2.9Å; N148-N152 VanDerWaalsContact O-N 3.08Å; N148-N152 PolarHBondContact O-ND2 3.09Å; I149-N152 PolarHBondContact O-N 3.48Å; N152-A154 VanDerWaalsContact C-N 3.32Å; N152-A154 PolarHBondContact O-N 2.64Å; N152-I155 PolarHBondContact O-N 2.92Å; N152-V156 WeakPolarHBondContact O-CG2 3.11Å; N152-V156 PolarHBondContact O-N 3.1Å
153	E	95.9	Very high	94.8	Very high	111 Å²	111	64.1 Å²	64.1	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-42.6	173.4	-172.9	-178.8	172.8	0	0	111.1	L126 I149 I155 V156 K157	L126-E153 HydrophobicContact CD1-CB 4.28Å; I149-E153 WeakPolarHBondContact O-CB 3.33Å; I149-E153 PolarHBondContact O-N 3.3Å; E153-I155 VanDerWaalsContact C-N 3.33Å; E153-I155 PolarHBondContact O-N 2.83Å; E153-V156 PolarHBondContact O-N 2.89Å; E153-K157 WeakPolarHBondContact O-CB 3.45Å; E153-K157 PolarHBondContact O-N 3.3Å
154	A	95.9	Very high	94.8	Very high	21 Å²	21	65.2 Å²	65.2	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-38.4	175.2	0	0	0	0	0	112.5	P74 F90 D150 A151 N152 A158	P74-A154 HydrophobicContact CB-CB 3.93Å; F90-A154 HydrophobicContact CE2-CB 4.02Å; F90-A154 HydrophobicContact CZ-CB 4.12Å; D150-A154 WeakPolarHBondContact O-CB 3.33Å; D150-A154 PolarHBondContact O-N 3.48Å; D150-A154 VanDerWaalsContact O-N 3.07Å; A151-A154 PolarHBondContact O-N 3.11Å; N152-A154 VanDerWaalsContact C-N 3.32Å; N152-A154 PolarHBondContact O-N 2.64Å; A154-A158 VanDerWaalsContact O-CB 3.3Å; A154-A158 WeakPolarHBondContact O-CB 3.4Å; A154-A158 PolarHBondContact O-N 3.34Å
155	I	95.8	Very high	94.8	Very high	31 Å²	31	61.4 Å²	61.4	16%	0.159	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-49.4	175.2	-65.5	168.4	0	0	0	110.4	F90 L117 A122 A151 N152 E153 K157 A158 L159	F90-I155 HydrophobicContact CD1-CG1 4.05Å; F90-I155 HydrophobicContact CD2-CG1 4.27Å; F90-I155 HydrophobicContact CE1-CD1 4.02Å; F90-I155 HydrophobicContact CE1-CG1 3.42Å; F90-I155 VanDerWaalsContact CE1-CG1 3.42Å; F90-I155 HydrophobicContact CE2-CB 4.32Å; F90-I155 HydrophobicContact CE2-CG1 3.68Å; F90-I155 HydrophobicContact CG-CG1 4.44Å; F90-I155 HydrophobicContact CZ-CB 4.28Å; F90-I155 HydrophobicContact CZ-CD1 4.21Å; F90-I155 HydrophobicContact CZ-CG1 3.22Å; L117-I155 HydrophobicContact CD1-CG2 4.39Å; A122-I155 HydrophobicContact CB-CB 4.26Å; A122-I155 HydrophobicContact CB-CG2 3.56Å; A151-I155 WeakPolarHBondContact O-CG1 3.37Å; A151-I155 PolarHBondContact O-N 3.27Å; N152-I155 PolarHBondContact O-N 2.92Å; E153-I155 VanDerWaalsContact C-N 3.33Å; E153-I155 PolarHBondContact O-N 2.83Å; I155-K157 VanDerWaalsContact C-N 3.31Å; I155-K157 PolarHBondContact O-N 3.35Å; I155-A158 WeakPolarHBondContact O-CB 3.28Å; I155-A158 PolarHBondContact O-N 3.25Å; I155-A158 VanDerWaalsContact O-N 3.09Å; I155-L159 HydrophobicContact CG2-CD1 3.81Å; I155-L159 WeakPolarHBondContact O-CG 3.37Å; I155-L159 PolarHBondContact O-N 3.31Å
156	V	96	Very high	94.7	Very high	13 Å²	13	64.4 Å²	64.4	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-47.3	179.4	172.5	0	0	0	0	110.2	A122 K123 L126 N152 E153 A158 L159 E160	A122-V156 HydrophobicContact CB-CG2 3.89Å; K123-V156 HydrophobicContact CG-CG1 4.24Å; K123-V156 HydrophobicContact CG-CG2 3.78Å; L126-V156 HydrophobicContact CD1-CG2 4.14Å; N152-V156 WeakPolarHBondContact O-CG2 3.11Å; N152-V156 PolarHBondContact O-N 3.1Å; E153-V156 PolarHBondContact O-N 2.89Å; V156-A158 VanDerWaalsContact C-N 3.25Å; V156-A158 PolarHBondContact O-N 3.07Å; V156-L159 PolarHBondContact O-N 3.39Å; V156-L159 VanDerWaalsContact O-N 3.15Å; V156-E160 HydrophobicContact CG1-CG 4.32Å; V156-E160 WeakPolarHBondContact O-CG 3.15Å; V156-E160 PolarHBondContact O-N 3.44Å; V156-E160 VanDerWaalsContact O-N 3.14Å
157	K	95.1	Very high	94.7	Very high	165 Å²	165	62.9 Å²	62.9	72%	0.717	32%	0.323	S	S	*	.	H	α-helix	trans	-63.8	-28.6	177.7	-173.5	176.8	-178.7	178.6	0	113.7	E153 I155 L159	E153-K157 WeakPolarHBondContact O-CB 3.45Å; E153-K157 PolarHBondContact O-N 3.3Å; I155-K157 VanDerWaalsContact C-N 3.31Å; I155-K157 PolarHBondContact O-N 3.35Å; K157-L159 VanDerWaalsContact C-N 3.31Å
158	A	93.9	Very high	94.6	Very high	22 Å²	22	59.4 Å²	59.4	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-74.1	-23.7	178	0	0	0	0	0	113.1	V76 F90 L114 A154 I155 V156	V76-A158 HydrophobicContact CG2-CB 3.38Å; F90-A158 HydrophobicContact CD2-CB 3.94Å; F90-A158 HydrophobicContact CE2-CB 4.36Å; L114-A158 HydrophobicContact CD2-CB 4.35Å; A154-A158 VanDerWaalsContact O-CB 3.3Å; A154-A158 WeakPolarHBondContact O-CB 3.4Å; A154-A158 PolarHBondContact O-N 3.34Å; I155-A158 WeakPolarHBondContact O-CB 3.28Å; I155-A158 PolarHBondContact O-N 3.25Å; I155-A158 VanDerWaalsContact O-N 3.09Å; V156-A158 VanDerWaalsContact C-N 3.25Å; V156-A158 PolarHBondContact O-N 3.07Å
159	L	92.4	Very high	94.6	Very high	42 Å²	42	57.8 Å²	57.8	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-105.7	-12.8	-173.8	-59.3	171.2	0	0	0	114.2	L114 L117 V119 I155 V156 K157	L114-L159 HydrophobicContact CB-CD2 4.36Å; L117-L159 HydrophobicContact CB-CD1 3.75Å; L117-L159 HydrophobicContact CB-CD2 3.91Å; L117-L159 HydrophobicContact CB-CG 4.39Å; L117-L159 HydrophobicContact CD1-CD2 4.29Å; V119-L159 HydrophobicContact CB-CD1 4.41Å; V119-L159 HydrophobicContact CG2-CB 3.47Å; V119-L159 VanDerWaalsContact CG2-CB 3.47Å; V119-L159 HydrophobicContact CG2-CD1 3.65Å; V119-L159 HydrophobicContact CG2-CG 4.14Å; I155-L159 HydrophobicContact CG2-CD1 3.81Å; I155-L159 WeakPolarHBondContact O-CG 3.37Å; I155-L159 PolarHBondContact O-N 3.31Å; V156-L159 PolarHBondContact O-N 3.39Å; V156-L159 VanDerWaalsContact O-N 3.15Å; K157-L159 VanDerWaalsContact C-N 3.31Å
160	E	86.8	Confident	94.4	Very high	177 Å²	177	61.7 Å²	61.7	83%	0.827	32%	0.315	S	S	*	.			trans	-81.1	0	170.6	-70.6	-177.5	164.1	0	0	112.3	K123 V156	K123-E160 VanDerWaalsContact CE-OE1 3.28Å; K123-E160 WeakPolarHBondContact CE-OE1 3.15Å; K123-E160 IonicContact NZ-OE1 3.77Å; K123-E160 PolarHBondContact NZ-OE1 3.48Å; V156-E160 HydrophobicContact CG1-CG 4.32Å; V156-E160 WeakPolarHBondContact O-CG 3.15Å; V156-E160 PolarHBondContact O-N 3.44Å; V156-E160 VanDerWaalsContact O-N 3.14Å

Retrieved 160 of 160 residues in 646.7 ms (Link to these results)

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