A0A075B619_MOUSE Loading...

T cell receptor alpha variable 14D-3-DV8

AlphaFold DB , UniProt , Accession A0A075B619, Species MOUSE (Mus musculus, Mouse), Gene Trav14d-3-dv8, Length 120 aa.

						>A0A075B619_MOUSE|A0A075B619|Trav14d-3-dv8
MDKILTASFLLLGLHLAGVSGQQEKRDQQQVRQSPQSLTVWEGETAILNCSYENSAFDYFPWYQQFPGEGPALLISILSVSDKKEDGRFTIFFNKREKKLSLHIADSQPGDSATYFCAAS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.9	Very low	47.4	Very low	231 Å²	231	156.2 Å²	156.2	100%	1.138	84%	0.838	S	S	*	*				0	98.1	0	-172.1	169.3	77.6	0	0	106.7
2	D	42.1	Very low	48.1	Very low	157 Å²	157	157.3 Å²	157.3	84%	0.84	84%	0.842	S	S	*	*			trans	-148.3	97.3	167.3	-75.4	-47.2	0	0	0	105.4
3	K	38.1	Very low	48.7	Very low	188 Å²	188	150.5 Å²	150.5	82%	0.817	83%	0.832	S	S	*	*				51.7	88.8	95.8	-72.8	-176.1	175.1	178.6	0	112.6
4	I	51.3	Low	50.1	Low	145 Å²	145	150.4 Å²	150.4	74%	0.744	83%	0.829	S	S	*	*				46.1	117.3	89.8	-48.7	174.4	0	0	0	113.2
5	L	46.6	Very low	50.5	Low	152 Å²	152	153.1 Å²	153.1	80%	0.796	83%	0.832	S	S	*	*				171.6	100.9	124.5	-106.4	100.6	0	0	0	109.4
6	T	44.7	Very low	51.3	Low	111 Å²	111	152.9 Å²	152.9	68%	0.681	83%	0.829	S	S	*	*				60.4	103.3	110.6	56.1	0	0	0	0	115.6
7	A	47	Very low	52	Low	106 Å²	106	149.1 Å²	149.1	88%	0.876	82%	0.824	S	S	*	*			trans	-110.2	122.3	149.8	0	0	0	0	0	107.7
8	S	52.9	Low	52.8	Low	111 Å²	111	145.1 Å²	145.1	78%	0.776	82%	0.821	S	S	*	*			trans	-70.6	154	-162.7	-59	0	0	0	0	115.2
9	F	49.9	Very low	53.4	Low	187 Å²	187	144.6 Å²	144.6	82%	0.82	82%	0.822	S	S	*	*			trans	-58.1	129.3	169.2	-73.9	-108.1	0	0	0	112.4
10	L	53.2	Low	53.8	Low	169 Å²	169	142.8 Å²	142.8	89%	0.885	82%	0.819	S	S	*	*			trans	-123.3	107.9	153.3	-72.5	175.2	0	0	0	108.4
11	L	53.3	Low	54.1	Low	161 Å²	161	138.9 Å²	138.9	84%	0.843	81%	0.809	S	S	*	*			trans	-74.5	123.1	172.8	-69.2	152.2	0	0	0	109.2
12	L	55.7	Low	54.8	Low	169 Å²	169	137 Å²	137	89%	0.885	80%	0.798	S	S	*	*			trans	-120	117.5	155.3	-89.4	112.8	0	0	0	107.9
13	G	56.9	Low	55.3	Low	70 Å²	70	138.5 Å²	138.5	72%	0.722	80%	0.8	S	S	*	*			trans	-69	137.1	-171.8	0	0	0	0	0	113.4
14	L	67.5	Low	55.9	Low	149 Å²	149	137.4 Å²	137.4	78%	0.78	80%	0.797	S	S	*	*			trans	-107.1	96.2	165.2	-138.1	83.6	0	0	0	107.7	L16	L14-L16 VanDerWaalsContact C-N 3.29Å; L14-L16 HydrophobicContact CD2-CD2 3.93Å; L14-L16 HydrophobicContact CD2-CG 4.11Å; L14-L16 PolarHBondContact O-N 3.35Å
15	H	55.7	Low	55.9	Low	191 Å²	191	137.9 Å²	137.9	88%	0.884	79%	0.794	S	S	*	*			trans	-74.4	89.6	164.9	-72.9	-77.3	0	0	0	107.5	A17	H15-A17 VanDerWaalsContact C-N 3.28Å; H15-A17 PolarHBondContact O-N 3.11Å
16	L	64.1	Low	56.3	Low	149 Å²	149	140 Å²	140	78%	0.78	79%	0.791	S	S	*	*			trans	-69.3	96.6	163	-68.6	174.1	0	0	0	106.5	L14 G18	L14-L16 VanDerWaalsContact C-N 3.29Å; L14-L16 HydrophobicContact CD2-CD2 3.93Å; L14-L16 HydrophobicContact CD2-CG 4.11Å; L14-L16 PolarHBondContact O-N 3.35Å; L16-G18 PolarHBondContact O-N 3.45Å
17	A	63.8	Low	56.8	Low	89 Å²	89	139.3 Å²	139.3	74%	0.736	78%	0.784	S	S	*	*			trans	-52.8	112.1	163.7	0	0	0	0	0	106.6	H15 V19	H15-A17 VanDerWaalsContact C-N 3.28Å; H15-A17 PolarHBondContact O-N 3.11Å; A17-V19 PolarHBondContact O-N 2.87Å
18	G	65.1	Low	57.5	Low	76 Å²	76	140.5 Å²	140.5	78%	0.784	77%	0.771	S	S	*	*			trans	-59.4	105.1	174.2	0	0	0	0	0	107.9	L16 S20	L16-G18 PolarHBondContact O-N 3.45Å; G18-S20 PolarHBondContact O-N 2.88Å; G18-S20 VanDerWaalsContact O-N 3.09Å
19	V	65.6	Low	58.2	Low	136 Å²	136	139.6 Å²	139.6	82%	0.824	76%	0.755	S	S	*	*			trans	-70.6	105	164.3	178.9	0	0	0	0	104.6	A17 G21	A17-V19 PolarHBondContact O-N 2.87Å; V19-G21 PolarHBondContact O-N 2.87Å
20	S	60.5	Low	60	Low	109 Å²	109	134.8 Å²	134.8	76%	0.762	74%	0.735	S	S	*	*			trans	-66	83.6	164.6	57.2	0	0	0	0	107	G18 Q22	G18-S20 PolarHBondContact O-N 2.88Å; G18-S20 VanDerWaalsContact O-N 3.09Å; S20-Q22 PolarHBondContact O-N 3.22Å
21	G	60.1	Low	62.1	Low	60 Å²	60	128.3 Å²	128.3	62%	0.619	70%	0.702	S	S	*	*			trans	-59.5	108.1	165.4	0	0	0	0	0	106.5	V19 Q23	V19-G21 PolarHBondContact O-N 2.87Å; G21-Q23 PolarHBondContact O-N 3.05Å
22	Q	56.7	Low	64.2	Low	192 Å²	192	126.7 Å²	126.7	90%	0.897	69%	0.685	S	S	*	*			trans	-60.4	97.5	156.5	-72.1	-179.2	-46.1	0	0	104.6	S20 E24	S20-Q22 PolarHBondContact O-N 3.22Å; Q22-E24 PolarHBondContact O-N 3.37Å
23	Q	52.3	Low	66.2	Low	189 Å²	189	122.1 Å²	122.1	88%	0.883	66%	0.659	S	S	*	*			trans	-66.1	96.5	172.4	-164.4	157.2	-41.6	0	0	105.1	G21 K25	G21-Q23 PolarHBondContact O-N 3.05Å; Q23-K25 PolarHBondContact O-N 2.95Å
24	E	51.2	Low	68.2	Low	165 Å²	165	121.7 Å²	121.7	77%	0.771	65%	0.645	S	S	*	*			trans	-57.1	97.2	169.4	-168.8	177.4	-162.1	0	0	105.2	Q22 R26	Q22-E24 PolarHBondContact O-N 3.37Å; E24-R26 PolarHBondContact O-N 2.66Å
25	K	51.8	Low	69.7	Low	155 Å²	155	117.3 Å²	117.3	67%	0.674	63%	0.625	S	S	*	*			trans	-59	93.1	167.8	-172.5	-172.9	-177.7	-131.6	0	103.8	Q23 D27	Q23-K25 PolarHBondContact O-N 2.95Å; K25-D27 WeakPolarHBondContact CE-OD1 3.48Å; K25-D27 VanDerWaalsContact NZ-CG 3.28Å; K25-D27 IonicContact NZ-OD1 3.31Å; K25-D27 PolarHBondContact NZ-OD1 2.88Å; K25-D27 IonicContact NZ-OD2 3.03Å; K25-D27 PolarHBondContact NZ-OD2 3.44Å; K25-D27 PolarHBondContact O-N 3.33Å
26	R	53.7	Low	71.6	Confident	195 Å²	195	118 Å²	118	74%	0.736	63%	0.629	S	S	*	*			trans	-62.6	82.1	168	-75	-165.7	-157.9	-166.2	7.2	105.8	E24 Q28	E24-R26 PolarHBondContact O-N 2.66Å; R26-Q28 PolarHBondContact O-N 3.42Å
27	D	56.5	Low	73.3	Confident	97 Å²	97	115.7 Å²	115.7	52%	0.519	63%	0.625	S	S	.	*			trans	-73	47.3	164.5	-106.5	0.2	0	0	0	108.2	K25 Q29	K25-D27 WeakPolarHBondContact CE-OD1 3.48Å; K25-D27 VanDerWaalsContact NZ-CG 3.28Å; K25-D27 IonicContact NZ-OD1 3.31Å; K25-D27 PolarHBondContact NZ-OD1 2.88Å; K25-D27 IonicContact NZ-OD2 3.03Å; K25-D27 PolarHBondContact NZ-OD2 3.44Å; K25-D27 PolarHBondContact O-N 3.33Å; D27-Q29 PolarHBondContact O-N 2.99Å
28	Q	61.9	Low	74.9	Confident	132 Å²	132	115 Å²	115	62%	0.617	61%	0.609	S	S	*	*			trans	-75.9	49.5	160	-71	-176.5	-43.4	0	0	108.1	R26 Q30	R26-Q28 PolarHBondContact O-N 3.42Å; Q28-Q30 PolarHBondContact O-N 2.83Å
29	Q	66.1	Low	76.5	Confident	92 Å²	92	117.6 Å²	117.6	43%	0.43	61%	0.61	S	S	.	*			trans	-77	77.5	177.9	-169.1	176.5	-49.4	0	0	108.4	D27 V31 R32	D27-Q29 PolarHBondContact O-N 2.99Å; Q29-V31 WeakPolarHBondContact CG-O 3.36Å; Q29-V31 PolarHBondContact O-N 2.89Å; Q29-R32 HydrophobicContact CG-CG 4.24Å; Q29-R32 VanDerWaalsContact NE2-CG 3.3Å
30	Q	89.3	Confident	78	Confident	85 Å²	85	113.5 Å²	113.5	40%	0.397	59%	0.585	S	S	.	*			trans	-68	-16.3	-177.7	-70.4	177.9	-26.9	0	0	113.1	Q28 Y52 E53 F57	Q28-Q30 PolarHBondContact O-N 2.83Å; Q30-Y52 CarbonylContact O-C 3.48Å; Q30-Y52 WeakPolarHBondContact O-CA 3.48Å; Q30-Y52 WeakPolarHBondContact O-CB 3.39Å; Q30-E53 PolarHBondContact O-N 2.78Å; Q30-F57 HydrophobicContact CB-CE2 4.02Å; Q30-F57 HydrophobicContact CB-CZ 4.22Å
31	V	96.6	Very high	79.8	Confident	33 Å²	33	117.9 Å²	117.9	20%	0.2	59%	0.585	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.5	133.8	-180	-176.7	0	0	0	0	109.6	Q29 C50 S51 C117 A119	Q29-V31 WeakPolarHBondContact CG-O 3.36Å; Q29-V31 PolarHBondContact O-N 2.89Å; V31-C50 WeakPolarHBondContact CG1-SG 3.47Å; V31-S51 CarbonylContact C-O 3.6Å; V31-S51 VanDerWaalsContact CA-O 3.3Å; V31-S51 WeakPolarHBondContact CA-O 3.46Å; V31-C117 HydrophobicContact CG1-CB 4.42Å; V31-A119 HydrophobicContact CG2-CB 3.71Å
32	R	97.4	Very high	81.6	Confident	127 Å²	127	122.2 Å²	122.2	48%	0.479	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.2	137.9	178.5	-37.3	-163.4	175.6	180	-0.8	110.3	Q29 C50 S51 E53	Q29-R32 HydrophobicContact CG-CG 4.24Å; Q29-R32 VanDerWaalsContact NE2-CG 3.3Å; R32-C50 CarbonylContact O-C 3.54Å; R32-C50 VanDerWaalsContact O-CA 3.26Å; R32-C50 WeakPolarHBondContact O-CA 3.41Å; R32-S51 PolarHBondContact N-O 3.03Å; R32-S51 PolarHBondContact O-N 2.79Å; R32-E53 IonicContact CZ-OE1 2.72Å; R32-E53 IonicContact NE-OE1 2.79Å; R32-E53 IonicContact NH2-OE1 3.03Å; R32-E53 PolarHBondContact NH2-OE1 2.72Å
33	Q	98	Very high	83.6	Confident	73 Å²	73	115 Å²	115	34%	0.341	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.8	150.9	179.1	-72.8	178.5	-112	0	0	112.3	N49 C50 Y115 C117	Q33-N49 CarbonylContact C-O 3.47Å; Q33-N49 VanDerWaalsContact CA-O 3.23Å; Q33-N49 WeakPolarHBondContact CA-O 3.45Å; Q33-C50 HydrophobicContact CG-CB 4.24Å; Q33-Y115 PolarHBondContact NE2-O 3.11Å; Q33-C117 VanDerWaalsContact CD-N 3.26Å; Q33-C117 HydrophobicContact CG-CB 3.71Å
34	S	98.3	Very high	85.8	Confident	62 Å²	62	110.4 Å²	110.4	43%	0.434	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	148.6	173.1	59.7	0	0	0	0	112.1	N49	S34-N49 PolarHBondContact N-O 2.87Å; S34-N49 WeakPolarHBondContact O-CB 3.28Å; S34-N49 PolarHBondContact O-N 3.27Å
35	P	98.3	Very high	88.1	Confident	56 Å²	56	106 Å²	106	36%	0.364	53%	0.529	S	S	.	.			cis	-70.1	169.8	-10.8	34.2	-37.8	0	0	0	111.8	S37 L38	P35-S37 VanDerWaalsContact C-N 3.31Å; P35-S37 WeakPolarHBondContact CB-O 3.47Å; P35-S37 WeakPolarHBondContact CG-O 3.34Å; P35-L38 HydrophobicContact CG-CB 3.98Å; P35-L38 HydrophobicContact CG-CD1 4.33Å
36	Q	97.2	Very high	90.3	Very high	205 Å²	205	99 Å²	99	96%	0.958	50%	0.5	S	S	*	.	S	Bend	trans	-72.3	-27.5	175.5	-71.1	-178.5	-5.7	0	0	112.7
37	S	98.1	Very high	92.5	Very high	101 Å²	101	92.9 Å²	92.9	71%	0.706	48%	0.482	S	S	*	.	S	Bend	trans	-145.3	143.6	175.3	-177.3	0	0	0	0	107.9	P35	P35-S37 VanDerWaalsContact C-N 3.31Å; P35-S37 WeakPolarHBondContact CB-O 3.47Å; P35-S37 WeakPolarHBondContact CG-O 3.34Å
38	L	98.2	Very high	94.5	Very high	75 Å²	75	89.3 Å²	89.3	39%	0.393	46%	0.462	S	S	.	.			trans	-136.7	136.3	-179.4	179.6	63.8	0	0	0	108.2	P35 V40 A46 L48	P35-L38 HydrophobicContact CG-CB 3.98Å; P35-L38 HydrophobicContact CG-CD1 4.33Å; L38-V40 HydrophobicContact CD1-CG1 4.13Å; L38-V40 HydrophobicContact CD2-CG1 4.11Å; L38-V40 HydrophobicContact CG-CG1 3.97Å; L38-A46 HydrophobicContact CD2-CB 3.72Å; L38-L48 HydrophobicContact CB-CD2 4.44Å; L38-L48 HydrophobicContact CD2-CD2 4.19Å
39	T	98.4	Very high	96.3	Very high	131 Å²	131	86.4 Å²	86.4	80%	0.804	45%	0.451	S	S	*	.			trans	-123.6	130.8	169.6	-55.6	0	0	0	0	107.3
40	V	97.9	Very high	97.8	Very high	50 Å²	50	82.2 Å²	82.2	30%	0.303	43%	0.432	S	S	.	.			trans	-134.1	156	178.6	-66.5	0	0	0	0	109.3	L38 E44 A46	L38-V40 HydrophobicContact CD1-CG1 4.13Å; L38-V40 HydrophobicContact CD2-CG1 4.11Å; L38-V40 HydrophobicContact CG-CG1 3.97Å; V40-E44 HydrophobicContact CB-CB 4.41Å; V40-A46 HydrophobicContact CG1-CB 4.04Å; V40-A46 HydrophobicContact CG2-CB 3.99Å
41	W	98.3	Very high	98.2	Very high	201 Å²	201	80.1 Å²	80.1	76%	0.761	43%	0.426	S	S	*	.			trans	-80.2	157.1	172.7	-61.2	104.5	0	0	0	111.4	G43 E44	W41-G43 PolarHBondContact O-N 3.05Å; W41-E44 HydrophobicContact CB-CG 3.98Å; W41-E44 WeakPolarHBondContact CB-OE2 3.38Å; W41-E44 PolarHBondContact N-OE2 2.9Å; W41-E44 WeakPolarHBondContact O-CB 3.23Å; W41-E44 PolarHBondContact O-N 2.92Å; W41-E44 VanDerWaalsContact O-N 3.11Å
42	E	98.3	Very high	98.2	Very high	151 Å²	151	79 Å²	79	71%	0.706	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	136.3	172.9	-172.6	175.1	178.1	0	0	110.4	E44 S107	E42-E44 PolarHBondContact O-N 2.92Å; E42-S107 CarbonylContact C-O 3.45Å; E42-S107 VanDerWaalsContact CA-O 3.28Å; E42-S107 WeakPolarHBondContact CA-O 3.42Å; E42-S107 WeakPolarHBondContact CG-O 3.46Å
43	G	98.5	Very high	98.2	Very high	41 Å²	41	77.3 Å²	77.3	42%	0.423	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-13.7	-175.9	0	0	0	0	0	115.2	W41 S107	W41-G43 PolarHBondContact O-N 3.05Å; G43-S107 PolarHBondContact N-O 2.9Å
44	E	98.6	Very high	98	Very high	92 Å²	92	76.8 Å²	76.8	43%	0.43	42%	0.416	S	S	.	.	S	Bend	trans	-76	167.1	174	-65.9	-172	141.4	0	0	112	V40 W41 E42 S107	V40-E44 HydrophobicContact CB-CB 4.41Å; W41-E44 HydrophobicContact CB-CG 3.98Å; W41-E44 WeakPolarHBondContact CB-OE2 3.38Å; W41-E44 PolarHBondContact N-OE2 2.9Å; W41-E44 WeakPolarHBondContact O-CB 3.23Å; W41-E44 PolarHBondContact O-N 2.92Å; W41-E44 VanDerWaalsContact O-N 3.11Å; E42-E44 PolarHBondContact O-N 2.92Å; E44-S107 VanDerWaalsContact O-CB 3.23Å; E44-S107 WeakPolarHBondContact O-CB 3.29Å; E44-S107 PolarHBondContact O-N 3.14Å; E44-S107 PolarHBondContact O-OG 2.8Å
45	T	98.7	Very high	97.8	Very high	72 Å²	72	77.6 Å²	77.6	44%	0.442	42%	0.422	S	S	.	.			trans	-95.9	115.8	174.7	-59.3	0	0	0	0	110.5	I47 H103 I104	T45-I47 HydrophobicContact CG2-CG1 4.09Å; T45-H103 HydrophobicContact CG2-CB 4.3Å; T45-I104 CarbonylContact C-O 3.55Å; T45-I104 VanDerWaalsContact CA-O 3.29Å; T45-I104 WeakPolarHBondContact CA-O 3.43Å
46	A	98.7	Very high	97.7	Very high	8 Å²	8	78.4 Å²	78.4	7%	0.066	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.6	167.8	0	0	0	0	0	111	L38 V40 H103 I104	L38-A46 HydrophobicContact CD2-CB 3.72Å; V40-A46 HydrophobicContact CG1-CB 4.04Å; V40-A46 HydrophobicContact CG2-CB 3.99Å; A46-H103 CarbonylContact O-C 3.59Å; A46-H103 WeakPolarHBondContact O-CA 3.35Å; A46-I104 HydrophobicContact CB-CB 4.22Å; A46-I104 HydrophobicContact CB-CD1 4.5Å; A46-I104 PolarHBondContact N-O 3.35Å; A46-I104 PolarHBondContact O-N 2.94Å
47	I	98.8	Very high	97.6	Very high	67 Å²	67	69.4 Å²	69.4	34%	0.344	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.2	179.5	-56.4	177	0	0	0	109.5	T45 L102	T45-I47 HydrophobicContact CG2-CG1 4.09Å; I47-L102 WeakPolarHBondContact CA-O 3.35Å
48	L	98.9	Very high	97.6	Very high	22 Å²	22	68.9 Å²	68.9	12%	0.115	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.1	172.7	-61.7	172.5	0	0	0	109	L38 W62 S101 L102 Y115	L38-L48 HydrophobicContact CB-CD2 4.44Å; L38-L48 HydrophobicContact CD2-CD2 4.19Å; L48-W62 HydrophobicContact CB-CH2 3.77Å; L48-W62 HydrophobicContact CB-CZ3 3.94Å; L48-W62 HydrophobicContact CD1-CZ3 4.2Å; L48-S101 CarbonylContact O-C 3.57Å; L48-S101 WeakPolarHBondContact O-CA 3.3Å; L48-L102 HydrophobicContact CB-CB 4.45Å; L48-L102 HydrophobicContact CD1-CD2 4.42Å; L48-L102 PolarHBondContact N-O 3.22Å; L48-L102 PolarHBondContact O-N 3.05Å; L48-Y115 VanDerWaalsContact CD1-CB 3.43Å; L48-Y115 HydrophobicContact CD1-CD1 4.37Å; L48-Y115 HydrophobicContact CD1-CD2 3.93Å; L48-Y115 HydrophobicContact CD1-CG 3.67Å
49	N	98.7	Very high	97.6	Very high	71 Å²	71	68.5 Å²	68.5	38%	0.38	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	146.2	-178.7	-61.2	-75.4	0	0	0	110.5	Q33 S34	Q33-N49 CarbonylContact C-O 3.47Å; Q33-N49 VanDerWaalsContact CA-O 3.23Å; Q33-N49 WeakPolarHBondContact CA-O 3.45Å; S34-N49 PolarHBondContact N-O 2.87Å; S34-N49 WeakPolarHBondContact O-CB 3.28Å; S34-N49 PolarHBondContact O-N 3.27Å
50	C	98.5	Very high	97.6	Very high	4 Å²	4	62.3 Å²	62.3	3%	0.027	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	138.3	177.3	175.9	0	0	0	0	109.9	V31 R32 Q33 W62 K99 L100 C117	V31-C50 WeakPolarHBondContact CG1-SG 3.47Å; R32-C50 CarbonylContact O-C 3.54Å; R32-C50 VanDerWaalsContact O-CA 3.26Å; R32-C50 WeakPolarHBondContact O-CA 3.41Å; Q33-C50 HydrophobicContact CG-CB 4.24Å; C50-W62 HydrophobicContact CB-CH2 3.9Å; C50-W62 HydrophobicContact CB-CZ2 3.62Å; C50-K99 CarbonylContact O-C 3.49Å; C50-K99 VanDerWaalsContact O-CA 3.3Å; C50-K99 WeakPolarHBondContact O-CA 3.35Å; C50-L100 HydrophobicContact CB-CD1 4.44Å; C50-L100 HydrophobicContact CB-CG 3.97Å; C50-L100 PolarHBondContact N-O 3.03Å; C50-L100 PolarHBondContact O-N 2.03Å; C50-C117 HydrophobicContact CB-CB 3.53Å; C50-C117 WeakPolarHBondContact CB-SG 3.31Å; C50-C117 WeakPolarHBondContact SG-CB 3.38Å; C50-C117 CovalentContact SG-SG 2.03Å; C50-C117 PolarHBondContact SG-SG 2.95Å
51	S	98.1	Very high	97.6	Very high	40 Å²	40	60 Å²	60	28%	0.28	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.9	176.8	61.6	0	0	0	0	109.9	V31 R32 K98	V31-S51 CarbonylContact C-O 3.6Å; V31-S51 VanDerWaalsContact CA-O 3.3Å; V31-S51 WeakPolarHBondContact CA-O 3.46Å; R32-S51 PolarHBondContact N-O 3.03Å; R32-S51 PolarHBondContact O-N 2.79Å; S51-K98 CarbonylContact C-O 3.6Å; S51-K98 VanDerWaalsContact CA-O 3.27Å; S51-K98 WeakPolarHBondContact CA-O 3.43Å
52	Y	97.1	Very high	97.6	Very high	10 Å²	10	50.5 Å²	50.5	4%	0.039	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158.1	-179.4	67.6	-82.2	0	0	0	112.4	Q30 N54 F57 F60 F93 K98 L100	Q30-Y52 CarbonylContact O-C 3.48Å; Q30-Y52 WeakPolarHBondContact O-CA 3.48Å; Q30-Y52 WeakPolarHBondContact O-CB 3.39Å; Y52-N54 VanDerWaalsContact CD2-O 3.27Å; Y52-N54 WeakPolarHBondContact CD2-O 3.39Å; Y52-N54 WeakPolarHBondContact CE2-O 3.17Å; Y52-F57 HydrophobicContact CD2-CB 4.47Å; Y52-F57 AromaticContact CD2-CD2 3.96Å; Y52-F57 HydrophobicContact CD2-CD2 3.96Å; Y52-F60 HydrophobicContact CD1-CD1 4.38Å; Y52-F60 AromaticContact CD1-CE1 3.63Å; Y52-F60 HydrophobicContact CD1-CE1 3.63Å; Y52-F60 HydrophobicContact CD1-CZ 4.36Å; Y52-F60 HydrophobicContact CD2-CE1 4.07Å; Y52-F60 HydrophobicContact CD2-CZ 4.46Å; Y52-F60 AromaticContact CE1-CE1 3.6Å; Y52-F60 HydrophobicContact CE1-CE1 3.6Å; Y52-F60 AromaticContact CE1-CZ 3.88Å; Y52-F60 HydrophobicContact CE1-CZ 3.88Å; Y52-F60 HydrophobicContact CE2-CE1 4.03Å; Y52-F60 AromaticContact CE2-CZ 3.99Å; Y52-F60 HydrophobicContact CE2-CZ 3.99Å; Y52-F60 AromaticContact CG-CE1 3.88Å; Y52-F60 HydrophobicContact CG-CE1 3.88Å; Y52-F60 AromaticContact CZ-CE1 3.81Å; Y52-F60 AromaticContact CZ-CZ 3.69Å; Y52-F93 AromaticContact CE1-CE2 3.71Å; Y52-F93 HydrophobicContact CE1-CE2 3.71Å; Y52-F93 HydrophobicContact CE1-CZ 4.32Å; Y52-F93 WeakPolarHBondContact OH-CZ 3.19Å; Y52-K98 HydrophobicContact CD1-CB 4Å; Y52-K98 VanDerWaalsContact CD1-O 3.26Å; Y52-K98 WeakPolarHBondContact CD1-O 3.12Å; Y52-K98 HydrophobicContact CD2-CB 4.27Å; Y52-K98 HydrophobicContact CE1-CB 3.72Å; Y52-K98 HydrophobicContact CE1-CG 4.48Å; Y52-K98 HydrophobicContact CE2-CB 4.03Å; Y52-K98 HydrophobicContact CE2-CD 4.39Å; Y52-K98 HydrophobicContact CE2-CG 4.07Å; Y52-K98 HydrophobicContact CG-CB 4.26Å; Y52-K98 PolarHBondContact N-O 3.38Å; Y52-K98 WeakPolarHBondContact O-CB 3.4Å; Y52-K98 WeakPolarHBondContact O-CD 3.35Å; Y52-L100 HydrophobicContact CD1-CD2 3.85Å; Y52-L100 HydrophobicContact CE1-CD2 4.13Å
53	E	95.9	Very high	97.7	Very high	92 Å²	92	46.9 Å²	46.9	43%	0.43	27%	0.266	S	S	.	.			trans	-102.2	-40.6	-174.3	-64.1	-175.6	178.4	0	0	112.7	Q30 R32 S55 K98	Q30-E53 PolarHBondContact O-N 2.78Å; R32-E53 IonicContact CZ-OE1 2.72Å; R32-E53 IonicContact NE-OE1 2.79Å; R32-E53 IonicContact NH2-OE1 3.03Å; R32-E53 PolarHBondContact NH2-OE1 2.72Å; E53-S55 PolarHBondContact O-N 2.8Å; E53-K98 PolarHBondContact O-NZ 2.82Å
54	N	95	Very high	97.7	Very high	62 Å²	62	46.3 Å²	46.3	33%	0.332	25%	0.253	S	S	.	.			trans	-80.5	116.3	-174.7	-174	0.2	0	0	0	112.2	Y52 A56 F57	Y52-N54 VanDerWaalsContact CD2-O 3.27Å; Y52-N54 WeakPolarHBondContact CD2-O 3.39Å; Y52-N54 WeakPolarHBondContact CE2-O 3.17Å; N54-A56 PolarHBondContact O-N 2.86Å; N54-A56 VanDerWaalsContact OD1-CB 3.28Å; N54-A56 WeakPolarHBondContact OD1-CB 3.26Å; N54-A56 PolarHBondContact OD1-N 3.09Å; N54-F57 HydrophobicContact CB-CD1 4.24Å; N54-F57 HydrophobicContact CB-CD2 3.76Å; N54-F57 HydrophobicContact CB-CE1 4.05Å; N54-F57 HydrophobicContact CB-CE2 3.56Å; N54-F57 HydrophobicContact CB-CG 4.12Å; N54-F57 HydrophobicContact CB-CZ 3.72Å; N54-F57 WeakPolarHBondContact ND2-CE1 3.23Å; N54-F57 WeakPolarHBondContact O-CD2 2.98Å; N54-F57 PolarHBondContact O-N 2.98Å
55	S	93.9	Very high	97.7	Very high	79 Å²	79	44.5 Å²	44.5	55%	0.552	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.5	178.2	-57	0	0	0	0	114.3	E53 F57 K98	E53-S55 PolarHBondContact O-N 2.8Å; S55-F57 VanDerWaalsContact C-N 3.31Å; S55-K98 WeakPolarHBondContact OG-CE 3.3Å; S55-K98 PolarHBondContact OG-NZ 3.09Å
56	A	95.3	Very high	97.7	Very high	73 Å²	73	44.2 Å²	44.2	60%	0.603	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-16.7	178.3	0	0	0	0	0	113.3	N54 D58	N54-A56 PolarHBondContact O-N 2.86Å; N54-A56 VanDerWaalsContact OD1-CB 3.28Å; N54-A56 WeakPolarHBondContact OD1-CB 3.26Å; N54-A56 PolarHBondContact OD1-N 3.09Å; A56-D58 PolarHBondContact O-N 2.9Å
57	F	96.4	Very high	97.6	Very high	16 Å²	16	49.4 Å²	49.4	7%	0.07	27%	0.27	C	S	.	.			trans	-65.8	132.3	177.8	-61.8	-29.6	0	0	0	111.4	Q30 Y52 N54 S55 F60 A119 S120	Q30-F57 HydrophobicContact CB-CE2 4.02Å; Q30-F57 HydrophobicContact CB-CZ 4.22Å; Y52-F57 HydrophobicContact CD2-CB 4.47Å; Y52-F57 AromaticContact CD2-CD2 3.96Å; Y52-F57 HydrophobicContact CD2-CD2 3.96Å; N54-F57 HydrophobicContact CB-CD1 4.24Å; N54-F57 HydrophobicContact CB-CD2 3.76Å; N54-F57 HydrophobicContact CB-CE1 4.05Å; N54-F57 HydrophobicContact CB-CE2 3.56Å; N54-F57 HydrophobicContact CB-CG 4.12Å; N54-F57 HydrophobicContact CB-CZ 3.72Å; N54-F57 WeakPolarHBondContact ND2-CE1 3.23Å; N54-F57 WeakPolarHBondContact O-CD2 2.98Å; N54-F57 PolarHBondContact O-N 2.98Å; S55-F57 VanDerWaalsContact C-N 3.31Å; F57-F60 HydrophobicContact CB-CE1 4.07Å; F57-F60 HydrophobicContact CB-CZ 3.95Å; F57-F60 WeakPolarHBondContact O-CZ 3.35Å; F57-A119 HydrophobicContact CB-CB 4.09Å; F57-A119 HydrophobicContact CD2-CB 3.36Å; F57-A119 HydrophobicContact CE2-CB 3.84Å; F57-A119 HydrophobicContact CG-CB 3.89Å; F57-S120 CarbonylContact C-O 3.6Å; F57-S120 WeakPolarHBondContact CA-O 3.34Å; F57-S120 VanDerWaalsContact CD1-OXT 3.3Å; F57-S120 WeakPolarHBondContact CD1-OXT 3.28Å
58	D	97	Very high	97.6	Very high	89 Å²	89	50.6 Å²	50.6	48%	0.476	30%	0.298	S	S	.	.			trans	-127.7	-7	-178.2	70.5	5.7	0	0	0	114.2	A56 L78 S79 S120	A56-D58 PolarHBondContact O-N 2.9Å; D58-L78 CarbonylContact O-C 3.58Å; D58-L78 VanDerWaalsContact O-CA 3.29Å; D58-L78 WeakPolarHBondContact O-CA 3.42Å; D58-S79 PolarHBondContact O-N 2.82Å; D58-S120 PolarHBondContact N-O 3.47Å
59	Y	98.3	Very high	97.5	Very high	68 Å²	68	55.1 Å²	55.1	27%	0.267	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.9	176.9	-179	-114.7	0	0	0	111.8	P61 S76 L78 A119 S120	Y59-P61 HydrophobicContact CD1-CG 4.11Å; Y59-P61 HydrophobicContact CE1-CB 3.86Å; Y59-P61 HydrophobicContact CE1-CG 3.67Å; Y59-S76 VanDerWaalsContact CE2-CB 3.46Å; Y59-S76 WeakPolarHBondContact CE2-OG 3.32Å; Y59-S76 VanDerWaalsContact OH-CB 3.27Å; Y59-S76 WeakPolarHBondContact OH-CB 3.48Å; Y59-S76 PolarHBondContact OH-OG 2.82Å; Y59-S76 VanDerWaalsContact OH-OG 3.11Å; Y59-L78 HydrophobicContact CD2-CD2 3.83Å; Y59-A119 WeakPolarHBondContact O-CA 3.3Å; Y59-S120 PolarHBondContact N-O 3Å; Y59-S120 PolarHBondContact O-N 2.93Å
60	F	98.4	Very high	97.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	87.4	-173.5	-55.3	-88.4	0	0	0	111.4	Y52 F57 S76 I77 F93 L100 A118 A119	Y52-F60 HydrophobicContact CD1-CD1 4.38Å; Y52-F60 AromaticContact CD1-CE1 3.63Å; Y52-F60 HydrophobicContact CD1-CE1 3.63Å; Y52-F60 HydrophobicContact CD1-CZ 4.36Å; Y52-F60 HydrophobicContact CD2-CE1 4.07Å; Y52-F60 HydrophobicContact CD2-CZ 4.46Å; Y52-F60 AromaticContact CE1-CE1 3.6Å; Y52-F60 HydrophobicContact CE1-CE1 3.6Å; Y52-F60 AromaticContact CE1-CZ 3.88Å; Y52-F60 HydrophobicContact CE1-CZ 3.88Å; Y52-F60 HydrophobicContact CE2-CE1 4.03Å; Y52-F60 AromaticContact CE2-CZ 3.99Å; Y52-F60 HydrophobicContact CE2-CZ 3.99Å; Y52-F60 AromaticContact CG-CE1 3.88Å; Y52-F60 HydrophobicContact CG-CE1 3.88Å; Y52-F60 AromaticContact CZ-CE1 3.81Å; Y52-F60 AromaticContact CZ-CZ 3.69Å; F57-F60 HydrophobicContact CB-CE1 4.07Å; F57-F60 HydrophobicContact CB-CZ 3.95Å; F57-F60 WeakPolarHBondContact O-CZ 3.35Å; F60-S76 WeakPolarHBondContact O-CA 3.28Å; F60-I77 HydrophobicContact CB-CG2 3.93Å; F60-I77 HydrophobicContact CD2-CG2 4.48Å; F60-I77 PolarHBondContact N-O 2.96Å; F60-I77 PolarHBondContact O-N 2.86Å; F60-I77 VanDerWaalsContact O-N 3.07Å; F60-F93 HydrophobicContact CD1-CE2 4.27Å; F60-F93 HydrophobicContact CD2-CD2 4.1Å; F60-F93 AromaticContact CD2-CE2 3.68Å; F60-F93 HydrophobicContact CD2-CE2 3.68Å; F60-F93 HydrophobicContact CD2-CZ 4.16Å; F60-F93 AromaticContact CE1-CE2 3.94Å; F60-F93 HydrophobicContact CE1-CE2 3.94Å; F60-F93 HydrophobicContact CE2-CD2 4.18Å; F60-F93 HydrophobicContact CE2-CE1 4.42Å; F60-F93 AromaticContact CE2-CE2 3.32Å; F60-F93 HydrophobicContact CE2-CE2 3.32Å; F60-F93 AromaticContact CE2-CZ 3.47Å; F60-F93 HydrophobicContact CE2-CZ 3.47Å; F60-F93 VanDerWaalsContact CE2-CZ 3.47Å; F60-F93 HydrophobicContact CG-CD2 4.42Å; F60-F93 HydrophobicContact CG-CE2 4.15Å; F60-F93 AromaticContact CZ-CE2 3.47Å; F60-F93 HydrophobicContact CZ-CE2 3.47Å; F60-F93 VanDerWaalsContact CZ-CE2 3.47Å; F60-F93 AromaticContact CZ-CZ 3.74Å; F60-F93 HydrophobicContact CZ-CZ 3.74Å; F60-L100 HydrophobicContact CB-CD1 3.8Å; F60-L100 HydrophobicContact CD1-CD1 4.41Å; F60-L100 HydrophobicContact CD1-CD2 3.73Å; F60-L100 HydrophobicContact CE1-CD2 4.25Å; F60-L100 HydrophobicContact CG-CD1 4.37Å; F60-L100 HydrophobicContact CG-CD2 4.28Å; F60-A118 WeakPolarHBondContact CA-O 3.29Å; F60-A119 HydrophobicContact CD1-CB 3.64Å; F60-A119 HydrophobicContact CE1-CB 3.65Å
61	P	98.5	Very high	97.5	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.019	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	146.4	175.6	33.6	-34.6	0	0	0	112.5	Y59 Y63 L73 A118	Y59-P61 HydrophobicContact CD1-CG 4.11Å; Y59-P61 HydrophobicContact CE1-CB 3.86Å; Y59-P61 HydrophobicContact CE1-CG 3.67Å; P61-Y63 HydrophobicContact CB-CE2 3.81Å; P61-Y63 HydrophobicContact CG-CE2 3.68Å; P61-L73 HydrophobicContact CB-CD1 3.63Å; P61-A118 WeakPolarHBondContact CD-O 3.21Å; P61-A118 HydrophobicContact CG-CB 4.01Å; P61-A118 PolarHBondContact O-N 2.98Å
62	W	98.8	Very high	97.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.3	162.7	-75.1	86.2	0	0	0	109.9	L48 C50 L74 I75 L100 L102 F116 C117	L48-W62 HydrophobicContact CB-CH2 3.77Å; L48-W62 HydrophobicContact CB-CZ3 3.94Å; L48-W62 HydrophobicContact CD1-CZ3 4.2Å; C50-W62 HydrophobicContact CB-CH2 3.9Å; C50-W62 HydrophobicContact CB-CZ2 3.62Å; W62-L74 WeakPolarHBondContact O-CB 3.46Å; W62-L74 PolarHBondContact O-N 2.96Å; W62-I75 HydrophobicContact CB-CG2 4.26Å; W62-I75 PolarHBondContact N-O 2.92Å; W62-I75 PolarHBondContact O-N 2.77Å; W62-L100 HydrophobicContact CZ2-CD1 4.48Å; W62-L102 HydrophobicContact CB-CD2 4.27Å; W62-L102 HydrophobicContact CD2-CB 3.75Å; W62-L102 HydrophobicContact CD2-CD2 3.85Å; W62-L102 HydrophobicContact CD2-CG 4.34Å; W62-L102 HydrophobicContact CE3-CB 4.07Å; W62-L102 HydrophobicContact CE3-CD2 3.73Å; W62-L102 HydrophobicContact CG-CB 4.26Å; W62-L102 HydrophobicContact CG-CD2 4.1Å; W62-L102 HydrophobicContact CH2-CB 4.06Å; W62-L102 HydrophobicContact CZ2-CB 3.75Å; W62-L102 HydrophobicContact CZ3-CB 4.21Å; W62-L102 HydrophobicContact CZ3-CD2 4.32Å; W62-F116 CarbonylContact C-O 3.58Å; W62-F116 VanDerWaalsContact CA-O 3.28Å; W62-F116 WeakPolarHBondContact CA-O 3.29Å; W62-C117 HydrophobicContact CD2-CB 4.11Å; W62-C117 HydrophobicContact CE3-CB 4.01Å; W62-C117 HydrophobicContact CH2-CB 3.77Å; W62-C117 HydrophobicContact CZ2-CB 3.83Å; W62-C117 HydrophobicContact CZ3-CB 3.85Å
63	Y	98.7	Very high	97.6	Very high	76 Å²	76	62.5 Å²	62.5	30%	0.298	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.1	175.8	-58.9	-95.3	0	0	0	110.3	P61 P71 A72 L73 Y115 F116 A118	P61-Y63 HydrophobicContact CB-CE2 3.81Å; P61-Y63 HydrophobicContact CG-CE2 3.68Å; Y63-P71 HydrophobicContact CD1-CB 4.46Å; Y63-P71 HydrophobicContact CG-CB 4.5Å; Y63-A72 CarbonylContact C-O 3.58Å; Y63-A72 WeakPolarHBondContact CA-O 3.33Å; Y63-A72 WeakPolarHBondContact CB-O 3.3Å; Y63-L73 HydrophobicContact CD1-CB 4.35Å; Y63-L73 HydrophobicContact CE1-CB 4.23Å; Y63-L73 HydrophobicContact CE1-CD1 4.2Å; Y63-Y115 CarbonylContact O-C 3.59Å; Y63-Y115 VanDerWaalsContact O-CA 3.29Å; Y63-Y115 WeakPolarHBondContact O-CA 3.4Å; Y63-F116 PolarHBondContact N-O 3.07Å; Y63-F116 PolarHBondContact O-N 2.81Å; Y63-A118 HydrophobicContact CE2-CB 4.27Å
64	Q	98.6	Very high	97.7	Very high	29 Å²	29	59.7 Å²	59.7	14%	0.136	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.2	170.8	-173.4	-177.6	36.1	0	0	108.8	F66 A72 L74 A113 T114 Y115	Q64-F66 HydrophobicContact CG-CZ 4.36Å; Q64-A72 PolarHBondContact N-O 2.82Å; Q64-A72 PolarHBondContact O-N 3.26Å; Q64-L74 HydrophobicContact CB-CB 4.32Å; Q64-A113 HydrophobicContact CG-CB 3.57Å; Q64-T114 CarbonylContact C-O 3.5Å; Q64-Y115 HydrophobicContact CB-CD1 4.34Å; Q64-Y115 HydrophobicContact CB-CE1 4.13Å; Q64-Y115 HydrophobicContact CG-CD1 4.4Å; Q64-Y115 HydrophobicContact CG-CE1 3.88Å; Q64-Y115 PolarHBondContact NE2-OH 3.21Å
65	Q	98.8	Very high	97.9	Very high	53 Å²	53	57 Å²	57	25%	0.248	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	112.6	176	-177.3	-178.6	33.4	0	0	110	E69 A113 T114 F116	Q65-E69 WeakPolarHBondContact CG-O 3.42Å; Q65-E69 PolarHBondContact NE2-O 2.85Å; Q65-A113 WeakPolarHBondContact O-CB 3.47Å; Q65-T114 PolarHBondContact N-O 2.94Å; Q65-T114 PolarHBondContact O-N 2.94Å; Q65-F116 HydrophobicContact CB-CE2 3.78Å; Q65-F116 VanDerWaalsContact OE1-CE2 3.26Å
66	F	98.4	Very high	98.1	Very high	66 Å²	66	54 Å²	54	29%	0.289	33%	0.332	S	S	.	.			trans	-75.1	155.6	170	-66.5	-62.8	0	0	0	111.6	Q64 G68 E69 G110 A113	Q64-F66 HydrophobicContact CG-CZ 4.36Å; F66-G68 PolarHBondContact O-N 2.88Å; F66-E69 HydrophobicContact CB-CB 4.37Å; F66-E69 HydrophobicContact CB-CG 4.26Å; F66-E69 PolarHBondContact O-N 2.78Å; F66-G110 VanDerWaalsContact CE1-O 3.31Å; F66-G110 WeakPolarHBondContact CE1-O 3.11Å; F66-A113 HydrophobicContact CD1-CB 3.88Å; F66-A113 HydrophobicContact CE1-CB 3.96Å
67	P	97.7	Very high	98.3	Very high	118 Å²	118	50.8 Å²	50.8	77%	0.766	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	124.3	175.4	-25.8	35.1	0	0	0	112.2	E69	P67-E69 VanDerWaalsContact C-N 3.31Å
68	G	97.9	Very high	98.4	Very high	91 Å²	91	54.3 Å²	54.3	94%	0.938	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-2.8	179.7	0	0	0	0	0	115.2	F66	F66-G68 PolarHBondContact O-N 2.88Å
69	E	97.9	Very high	98.3	Very high	118 Å²	118	51 Å²	51	55%	0.551	31%	0.307	S	S	*	.	S	Bend	trans	-105.9	169.8	178.1	-62.9	-175.7	-155.7	0	0	112.3	Q65 F66 P67	Q65-E69 WeakPolarHBondContact CG-O 3.42Å; Q65-E69 PolarHBondContact NE2-O 2.85Å; F66-E69 HydrophobicContact CB-CB 4.37Å; F66-E69 HydrophobicContact CB-CG 4.26Å; F66-E69 PolarHBondContact O-N 2.78Å; P67-E69 VanDerWaalsContact C-N 3.31Å
70	G	97.8	Very high	98.3	Very high	50 Å²	50	53.9 Å²	53.9	52%	0.515	33%	0.331	S	S	.	.			trans	-84.8	162.2	169.5	0	0	0	0	0	112	A72	G70-A72 PolarHBondContact O-N 2.74Å
71	P	98.3	Very high	98.3	Very high	77 Å²	77	56.4 Å²	56.4	50%	0.5	35%	0.349	S	S	.	.			trans	-62.9	126.4	172.5	-20.1	32.6	0	0	0	111.6	Y63 F116	Y63-P71 HydrophobicContact CD1-CB 4.46Å; Y63-P71 HydrophobicContact CG-CB 4.5Å; P71-F116 HydrophobicContact CB-CD2 4.4Å; P71-F116 HydrophobicContact CG-CD2 4.5Å; P71-F116 HydrophobicContact CG-CE2 4.25Å
72	A	98.6	Very high	98.3	Very high	56 Å²	56	62 Å²	62	46%	0.463	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	144	174.6	0	0	0	0	0	110.3	Y63 Q64 G70 L74	Y63-A72 CarbonylContact C-O 3.58Å; Y63-A72 WeakPolarHBondContact CA-O 3.33Å; Y63-A72 WeakPolarHBondContact CB-O 3.3Å; Q64-A72 PolarHBondContact N-O 2.82Å; Q64-A72 PolarHBondContact O-N 3.26Å; G70-A72 PolarHBondContact O-N 2.74Å; A72-L74 PolarHBondContact O-N 2.96Å
73	L	98.6	Very high	98.3	Very high	97 Å²	97	66.4 Å²	66.4	51%	0.508	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	124	176.9	179.8	68.2	0	0	0	109.3	P61 Y63	P61-L73 HydrophobicContact CB-CD1 3.63Å; Y63-L73 HydrophobicContact CD1-CB 4.35Å; Y63-L73 HydrophobicContact CE1-CB 4.23Å; Y63-L73 HydrophobicContact CE1-CD1 4.2Å
74	L	98.7	Very high	98.3	Very high	32 Å²	32	67 Å²	67	17%	0.168	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-62.3	177.1	178.4	69.1	0	0	0	110.5	W62 Q64 A72 F89 L102 Y115	W62-L74 WeakPolarHBondContact O-CB 3.46Å; W62-L74 PolarHBondContact O-N 2.96Å; Q64-L74 HydrophobicContact CB-CB 4.32Å; A72-L74 PolarHBondContact O-N 2.96Å; L74-F89 HydrophobicContact CD1-CD1 4.17Å; L74-F89 HydrophobicContact CD1-CD2 4.08Å; L74-F89 HydrophobicContact CD1-CE1 3.99Å; L74-F89 HydrophobicContact CD1-CE2 3.89Å; L74-F89 HydrophobicContact CD1-CG 4.23Å; L74-F89 HydrophobicContact CD1-CZ 3.85Å; L74-F89 HydrophobicContact CD2-CD1 3.74Å; L74-F89 HydrophobicContact CD2-CE1 3.91Å; L74-F89 HydrophobicContact CD2-CG 4.31Å; L74-F89 HydrophobicContact CG-CD1 4.25Å; L74-F89 HydrophobicContact CG-CE1 4.45Å; L74-F89 HydrophobicContact CG-CG 4.37Å; L74-L102 HydrophobicContact CD2-CD1 4.44Å; L74-L102 HydrophobicContact CD2-CD2 3.86Å; L74-Y115 HydrophobicContact CD2-CD1 4.01Å; L74-Y115 HydrophobicContact CD2-CE1 3.73Å
75	I	98.8	Very high	98.3	Very high	6 Å²	6	71 Å²	71	3%	0.031	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	151.4	-177	-174.9	171.4	0	0	0	108.7	W62 K84 D86 F89 I91 L102	W62-I75 HydrophobicContact CB-CG2 4.26Å; W62-I75 PolarHBondContact N-O 2.92Å; W62-I75 PolarHBondContact O-N 2.77Å; I75-K84 HydrophobicContact CD1-CD 4.26Å; I75-K84 HydrophobicContact CD1-CG 4.18Å; I75-K84 HydrophobicContact CG1-CD 4.02Å; I75-K84 HydrophobicContact CG1-CG 4.49Å; I75-D86 HydrophobicContact CD1-CB 3.85Å; I75-F89 HydrophobicContact CD1-CB 4.46Å; I75-F89 HydrophobicContact CG2-CB 4.43Å; I75-I91 HydrophobicContact CB-CD1 4.3Å; I75-I91 HydrophobicContact CD1-CD1 4.4Å; I75-I91 HydrophobicContact CD1-CG1 4.29Å; I75-I91 HydrophobicContact CG1-CD1 3.91Å; I75-I91 HydrophobicContact CG1-CG1 4.3Å; I75-I91 HydrophobicContact CG2-CD1 3.82Å; I75-I91 HydrophobicContact CG2-CG1 3.87Å; I75-L102 HydrophobicContact CG2-CD1 3.87Å
76	S	98.6	Very high	98.2	Very high	17 Å²	17	73.1 Å²	73.1	12%	0.119	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.6	178.7	61.6	0	0	0	0	112.5	Y59 F60 K84	Y59-S76 VanDerWaalsContact CE2-CB 3.46Å; Y59-S76 WeakPolarHBondContact CE2-OG 3.32Å; Y59-S76 VanDerWaalsContact OH-CB 3.27Å; Y59-S76 WeakPolarHBondContact OH-CB 3.48Å; Y59-S76 PolarHBondContact OH-OG 2.82Å; Y59-S76 VanDerWaalsContact OH-OG 3.11Å; F60-S76 WeakPolarHBondContact O-CA 3.28Å; S76-K84 WeakPolarHBondContact O-CD 3.47Å; S76-K84 WeakPolarHBondContact O-CE 3.26Å; S76-K84 PolarHBondContact O-NZ 2.96Å
77	I	98.7	Very high	98.2	Very high	4 Å²	4	73.7 Å²	73.7	2%	0.021	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148.5	178.2	-166.3	168	0	0	0	110.8	F60 K84 I91 F93	F60-I77 HydrophobicContact CB-CG2 3.93Å; F60-I77 HydrophobicContact CD2-CG2 4.48Å; F60-I77 PolarHBondContact N-O 2.96Å; F60-I77 PolarHBondContact O-N 2.86Å; F60-I77 VanDerWaalsContact O-N 3.07Å; I77-K84 HydrophobicContact CB-CB 4.36Å; I77-K84 HydrophobicContact CD1-CB 4.03Å; I77-K84 HydrophobicContact CG1-CB 4.17Å; I77-I91 HydrophobicContact CB-CB 4.45Å; I77-I91 HydrophobicContact CB-CD1 4.01Å; I77-I91 HydrophobicContact CB-CG2 4.28Å; I77-I91 HydrophobicContact CD1-CG2 4.39Å; I77-I91 HydrophobicContact CG2-CB 4.34Å; I77-I91 HydrophobicContact CG2-CD1 4.02Å; I77-I91 HydrophobicContact CG2-CG2 3.66Å; I77-F93 HydrophobicContact CD1-CB 3.97Å; I77-F93 HydrophobicContact CG2-CB 4.3Å
78	L	98.5	Very high	98.3	Very high	91 Å²	91	70.7 Å²	70.7	48%	0.476	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	150.3	171.9	-68.7	169.2	0	0	0	110.2	D58 Y59 V80 S81	D58-L78 CarbonylContact O-C 3.58Å; D58-L78 VanDerWaalsContact O-CA 3.29Å; D58-L78 WeakPolarHBondContact O-CA 3.42Å; Y59-L78 HydrophobicContact CD2-CD2 3.83Å; L78-V80 HydrophobicContact CB-CG2 3.96Å; L78-V80 PolarHBondContact O-N 2.79Å; L78-S81 PolarHBondContact O-N 2.81Å
79	S	96.7	Very high	98.3	Very high	18 Å²	18	68 Å²	68	13%	0.126	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-7.5	-176.2	76.8	0	0	0	0	115.8	D58 K95	D58-S79 PolarHBondContact O-N 2.82Å; S79-K95 PolarHBondContact OG-NZ 2.93Å
80	V	97	Very high	98.3	Very high	130 Å²	130	63.3 Å²	63.3	79%	0.788	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-14.4	174.1	-62.2	0	0	0	0	112.8	L78	L78-V80 HydrophobicContact CB-CG2 3.96Å; L78-V80 PolarHBondContact O-N 2.79Å
81	S	98.3	Very high	98.4	Very high	53 Å²	53	60.9 Å²	60.9	37%	0.371	35%	0.349	S	S	.	.			trans	-110.4	144.7	178.2	-61.4	0	0	0	0	110.1	L78 F93	L78-S81 PolarHBondContact O-N 2.81Å; S81-F93 VanDerWaalsContact O-CD1 3.3Å; S81-F93 WeakPolarHBondContact O-CD1 3.15Å
82	D	98.3	Very high	98.4	Very high	121 Å²	121	61.3 Å²	61.3	65%	0.647	34%	0.343	S	S	*	.	S	Bend	trans	-98.7	-17.1	175.2	61.1	-8.8	0	0	0	112.9	F92 F93	D82-F92 CarbonylContact O-C 3.53Å; D82-F92 WeakPolarHBondContact O-CA 3.28Å; D82-F93 PolarHBondContact O-N 2.85Å
83	K	98.7	Very high	98.4	Very high	91 Å²	91	59.3 Å²	59.3	40%	0.396	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	143	179.4	-167.8	-178.8	71.1	154.4	0	111.7	E85 T90 I91 F92	K83-E85 HydrophobicContact CD-CG 4.36Å; K83-E85 WeakPolarHBondContact CD-OE1 3.05Å; K83-E85 VanDerWaalsContact CE-OE1 3.3Å; K83-E85 WeakPolarHBondContact CE-OE1 3.24Å; K83-E85 HydrophobicContact CG-CG 4.4Å; K83-E85 VanDerWaalsContact NZ-CD 3.33Å; K83-E85 IonicContact NZ-OE1 3.5Å; K83-E85 PolarHBondContact NZ-OE1 2.94Å; K83-E85 IonicContact NZ-OE2 3.67Å; K83-T90 HydrophobicContact CD-CG2 4.35Å; K83-T90 HydrophobicContact CG-CG2 3.99Å; K83-I91 VanDerWaalsContact CA-O 3.28Å; K83-I91 WeakPolarHBondContact CA-O 3.01Å; K83-F92 HydrophobicContact CD-CD1 4.33Å; K83-F92 HydrophobicContact CD-CE1 3.69Å; K83-F92 HydrophobicContact CD-CZ 4.26Å; K83-F92 HydrophobicContact CG-CD1 4.12Å; K83-F92 HydrophobicContact CG-CE1 3.94Å
84	K	98.8	Very high	98.4	Very high	89 Å²	89	57.7 Å²	57.7	39%	0.387	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	134.8	165.3	-171.4	-176.2	-179.6	179.1	0	110.2	I75 S76 I77 T90 I91	I75-K84 HydrophobicContact CD1-CD 4.26Å; I75-K84 HydrophobicContact CD1-CG 4.18Å; I75-K84 HydrophobicContact CG1-CD 4.02Å; I75-K84 HydrophobicContact CG1-CG 4.49Å; S76-K84 WeakPolarHBondContact O-CD 3.47Å; S76-K84 WeakPolarHBondContact O-CE 3.26Å; S76-K84 PolarHBondContact O-NZ 2.96Å; I77-K84 HydrophobicContact CB-CB 4.36Å; I77-K84 HydrophobicContact CD1-CB 4.03Å; I77-K84 HydrophobicContact CG1-CB 4.17Å; K84-T90 CarbonylContact O-C 3.5Å; K84-T90 WeakPolarHBondContact O-CA 3.26Å; K84-I91 PolarHBondContact N-O 3.15Å; K84-I91 PolarHBondContact O-N 2.7Å
85	E	98.6	Very high	98.3	Very high	112 Å²	112	61.5 Å²	61.5	52%	0.523	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	138.6	-179.3	-67.3	173.4	173.3	0	0	109.7	K83 F89 T90	K83-E85 HydrophobicContact CD-CG 4.36Å; K83-E85 WeakPolarHBondContact CD-OE1 3.05Å; K83-E85 VanDerWaalsContact CE-OE1 3.3Å; K83-E85 WeakPolarHBondContact CE-OE1 3.24Å; K83-E85 HydrophobicContact CG-CG 4.4Å; K83-E85 VanDerWaalsContact NZ-CD 3.33Å; K83-E85 IonicContact NZ-OE1 3.5Å; K83-E85 PolarHBondContact NZ-OE1 2.94Å; K83-E85 IonicContact NZ-OE2 3.67Å; E85-F89 CarbonylContact C-O 3.59Å; E85-F89 WeakPolarHBondContact CA-O 3.3Å; E85-T90 HydrophobicContact CG-CG2 3.65Å
86	D	98.3	Very high	98.2	Very high	99 Å²	99	72.5 Å²	72.5	53%	0.529	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	103.7	169.6	-172	4.8	0	0	0	109.3	I75 R88 F89	I75-D86 HydrophobicContact CD1-CB 3.85Å; D86-R88 PolarHBondContact O-N 2.68Å; D86-R88 VanDerWaalsContact O-N 3.15Å; D86-F89 PolarHBondContact N-O 2.82Å; D86-F89 WeakPolarHBondContact O-CB 3.42Å; D86-F89 PolarHBondContact O-N 2.74Å
87	G	98	Very high	98.1	Very high	77 Å²	77	77 Å²	77	79%	0.794	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	-117.8	-173.9	0	0	0	0	0	112.2	F89	G87-F89 VanDerWaalsContact C-N 3.34Å
88	R	98.3	Very high	98.1	Very high	56 Å²	56	79.9 Å²	79.9	21%	0.211	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.8	178.7	-66.3	-171.1	-58.1	104	-1.2	113.6	D86 A105 D106 D111	D86-R88 PolarHBondContact O-N 2.68Å; D86-R88 VanDerWaalsContact O-N 3.15Å; R88-A105 WeakPolarHBondContact CB-O 3.47Å; R88-A105 WeakPolarHBondContact CD-O 3.49Å; R88-A105 PolarHBondContact NH1-O 2.83Å; R88-A105 PolarHBondContact O-N 3.25Å; R88-D106 PolarHBondContact NH1-O 2.85Å; R88-D111 IonicContact CZ-OD1 2.85Å; R88-D111 IonicContact CZ-OD2 2.74Å; R88-D111 VanDerWaalsContact CZ-OD2 3.31Å; R88-D111 IonicContact NH1-OD1 2.7Å; R88-D111 IonicContact NH1-OD2 3.56Å; R88-D111 PolarHBondContact NH1-OD2 3.42Å; R88-D111 VanDerWaalsContact NH2-CG 3.28Å; R88-D111 IonicContact NH2-OD1 3.53Å; R88-D111 PolarHBondContact NH2-OD1 2.75Å; R88-D111 IonicContact NH2-OD2 3.7Å; R88-D111 PolarHBondContact NH2-OD2 3.36Å
89	F	98.8	Very high	98.1	Very high	33 Å²	33	80.6 Å²	80.6	15%	0.145	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.9	-176.4	-57.6	-78.6	0	0	0	111	L74 I75 E85 D86 G87 L102 H103 I104	L74-F89 HydrophobicContact CD1-CD1 4.17Å; L74-F89 HydrophobicContact CD1-CD2 4.08Å; L74-F89 HydrophobicContact CD1-CE1 3.99Å; L74-F89 HydrophobicContact CD1-CE2 3.89Å; L74-F89 HydrophobicContact CD1-CG 4.23Å; L74-F89 HydrophobicContact CD1-CZ 3.85Å; L74-F89 HydrophobicContact CD2-CD1 3.74Å; L74-F89 HydrophobicContact CD2-CE1 3.91Å; L74-F89 HydrophobicContact CD2-CG 4.31Å; L74-F89 HydrophobicContact CG-CD1 4.25Å; L74-F89 HydrophobicContact CG-CE1 4.45Å; L74-F89 HydrophobicContact CG-CG 4.37Å; I75-F89 HydrophobicContact CD1-CB 4.46Å; I75-F89 HydrophobicContact CG2-CB 4.43Å; E85-F89 CarbonylContact C-O 3.59Å; E85-F89 WeakPolarHBondContact CA-O 3.3Å; D86-F89 PolarHBondContact N-O 2.82Å; D86-F89 WeakPolarHBondContact O-CB 3.42Å; D86-F89 PolarHBondContact O-N 2.74Å; G87-F89 VanDerWaalsContact C-N 3.34Å; F89-L102 HydrophobicContact CB-CD1 4.39Å; F89-L102 HydrophobicContact CD1-CD1 4.45Å; F89-H103 CarbonylContact C-O 3.6Å; F89-H103 WeakPolarHBondContact CA-O 3.4Å; F89-I104 HydrophobicContact CD1-CB 4.4Å; F89-I104 HydrophobicContact CD1-CD1 4.44Å; F89-I104 HydrophobicContact CD1-CG1 3.86Å; F89-I104 HydrophobicContact CD1-CG2 4.13Å; F89-I104 HydrophobicContact CE1-CB 4.34Å; F89-I104 HydrophobicContact CE1-CD1 4.06Å; F89-I104 HydrophobicContact CE1-CG1 3.9Å; F89-I104 HydrophobicContact CE1-CG2 3.7Å; F89-I104 HydrophobicContact CZ-CG2 4.41Å
90	T	98.9	Very high	98.1	Very high	20 Å²	20	80 Å²	80	12%	0.123	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	127.6	175.2	-53.8	0	0	0	0	110.4	K83 K84 E85 F92 L102 H103	K83-T90 HydrophobicContact CD-CG2 4.35Å; K83-T90 HydrophobicContact CG-CG2 3.99Å; K84-T90 CarbonylContact O-C 3.5Å; K84-T90 WeakPolarHBondContact O-CA 3.26Å; E85-T90 HydrophobicContact CG-CG2 3.65Å; T90-F92 HydrophobicContact CG2-CD2 4Å; T90-F92 HydrophobicContact CG2-CE1 4.34Å; T90-F92 HydrophobicContact CG2-CE2 3.49Å; T90-F92 VanDerWaalsContact CG2-CE2 3.49Å; T90-F92 HydrophobicContact CG2-CZ 3.69Å; T90-L102 CarbonylContact O-C 3.53Å; T90-L102 WeakPolarHBondContact O-CA 3.27Å; T90-H103 PolarHBondContact N-O 2.88Å; T90-H103 PolarHBondContact O-N 2.83Å
91	I	98.9	Very high	98.2	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.1	165.1	-56.5	169.1	0	0	0	108.7	I75 I77 K83 K84 L100 S101 L102	I75-I91 HydrophobicContact CB-CD1 4.3Å; I75-I91 HydrophobicContact CD1-CD1 4.4Å; I75-I91 HydrophobicContact CD1-CG1 4.29Å; I75-I91 HydrophobicContact CG1-CD1 3.91Å; I75-I91 HydrophobicContact CG1-CG1 4.3Å; I75-I91 HydrophobicContact CG2-CD1 3.82Å; I75-I91 HydrophobicContact CG2-CG1 3.87Å; I77-I91 HydrophobicContact CB-CB 4.45Å; I77-I91 HydrophobicContact CB-CD1 4.01Å; I77-I91 HydrophobicContact CB-CG2 4.28Å; I77-I91 HydrophobicContact CD1-CG2 4.39Å; I77-I91 HydrophobicContact CG2-CB 4.34Å; I77-I91 HydrophobicContact CG2-CD1 4.02Å; I77-I91 HydrophobicContact CG2-CG2 3.66Å; K83-I91 VanDerWaalsContact CA-O 3.28Å; K83-I91 WeakPolarHBondContact CA-O 3.01Å; K84-I91 PolarHBondContact N-O 3.15Å; K84-I91 PolarHBondContact O-N 2.7Å; I91-L100 HydrophobicContact CG2-CB 4.31Å; I91-L100 HydrophobicContact CG2-CD1 4.47Å; I91-S101 CarbonylContact C-O 3.53Å; I91-S101 VanDerWaalsContact CA-O 3.26Å; I91-S101 WeakPolarHBondContact CA-O 3.39Å; I91-L102 HydrophobicContact CG1-CD1 4.33Å
92	F	98.8	Very high	98.2	Very high	85 Å²	85	72 Å²	72	37%	0.373	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134.6	160.4	-64.8	-84.8	0	0	0	109.3	D82 K83 T90 L100 S101 H103	D82-F92 CarbonylContact O-C 3.53Å; D82-F92 WeakPolarHBondContact O-CA 3.28Å; K83-F92 HydrophobicContact CD-CD1 4.33Å; K83-F92 HydrophobicContact CD-CE1 3.69Å; K83-F92 HydrophobicContact CD-CZ 4.26Å; K83-F92 HydrophobicContact CG-CD1 4.12Å; K83-F92 HydrophobicContact CG-CE1 3.94Å; T90-F92 HydrophobicContact CG2-CD2 4Å; T90-F92 HydrophobicContact CG2-CE1 4.34Å; T90-F92 HydrophobicContact CG2-CE2 3.49Å; T90-F92 VanDerWaalsContact CG2-CE2 3.49Å; T90-F92 HydrophobicContact CG2-CZ 3.69Å; F92-L100 CarbonylContact O-C 3.48Å; F92-L100 WeakPolarHBondContact O-CA 2.84Å; F92-L100 VanDerWaalsContact O-CB 3.24Å; F92-L100 WeakPolarHBondContact O-CB 3.42Å; F92-S101 PolarHBondContact N-O 2.94Å; F92-S101 PolarHBondContact O-N 2.98Å; F92-H103 AromaticContact CD2-CD2 3.61Å; F92-H103 AromaticContact CD2-CE1 3.99Å; F92-H103 AromaticContact CD2-NE2 3.61Å; F92-H103 HydrophobicContact CE2-CB 4.49Å; F92-H103 AromaticContact CE2-CD2 3.96Å; F92-H103 AromaticContact CE2-CE1 3.92Å; F92-H103 AromaticContact CE2-CG 3.89Å; F92-H103 AromaticContact CE2-ND1 3.86Å
93	F	98.7	Very high	98.3	Very high	15 Å²	15	68.2 Å²	68.2	7%	0.066	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.1	-178.2	176.8	-105.3	0	0	0	110.8	Y52 F60 I77 S81 D82 K95 L100	Y52-F93 AromaticContact CE1-CE2 3.71Å; Y52-F93 HydrophobicContact CE1-CE2 3.71Å; Y52-F93 HydrophobicContact CE1-CZ 4.32Å; Y52-F93 WeakPolarHBondContact OH-CZ 3.19Å; F60-F93 HydrophobicContact CD1-CE2 4.27Å; F60-F93 HydrophobicContact CD2-CD2 4.1Å; F60-F93 AromaticContact CD2-CE2 3.68Å; F60-F93 HydrophobicContact CD2-CE2 3.68Å; F60-F93 HydrophobicContact CD2-CZ 4.16Å; F60-F93 AromaticContact CE1-CE2 3.94Å; F60-F93 HydrophobicContact CE1-CE2 3.94Å; F60-F93 HydrophobicContact CE2-CD2 4.18Å; F60-F93 HydrophobicContact CE2-CE1 4.42Å; F60-F93 AromaticContact CE2-CE2 3.32Å; F60-F93 HydrophobicContact CE2-CE2 3.32Å; F60-F93 AromaticContact CE2-CZ 3.47Å; F60-F93 HydrophobicContact CE2-CZ 3.47Å; F60-F93 VanDerWaalsContact CE2-CZ 3.47Å; F60-F93 HydrophobicContact CG-CD2 4.42Å; F60-F93 HydrophobicContact CG-CE2 4.15Å; F60-F93 AromaticContact CZ-CE2 3.47Å; F60-F93 HydrophobicContact CZ-CE2 3.47Å; F60-F93 VanDerWaalsContact CZ-CE2 3.47Å; F60-F93 AromaticContact CZ-CZ 3.74Å; F60-F93 HydrophobicContact CZ-CZ 3.74Å; I77-F93 HydrophobicContact CD1-CB 3.97Å; I77-F93 HydrophobicContact CG2-CB 4.3Å; S81-F93 VanDerWaalsContact O-CD1 3.3Å; S81-F93 WeakPolarHBondContact O-CD1 3.15Å; D82-F93 PolarHBondContact O-N 2.85Å; F93-K95 HydrophobicContact CD1-CB 4.41Å; F93-K95 HydrophobicContact CE1-CB 3.56Å; F93-K95 HydrophobicContact CE1-CD 4.33Å; F93-K95 HydrophobicContact CE1-CG 4.06Å; F93-K95 HydrophobicContact CZ-CB 3.92Å; F93-K95 HydrophobicContact CZ-CG 4.12Å; F93-L100 HydrophobicContact CD2-CB 4.07Å; F93-L100 HydrophobicContact CD2-CD2 4.15Å; F93-L100 HydrophobicContact CE2-CD2 4.35Å
94	N	98.1	Very high	98.3	Very high	62 Å²	62	64 Å²	64	33%	0.332	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	96.9	175.3	-176.1	-28.4	0	0	0	109.4	R96 E97 K98 K99	N94-R96 VanDerWaalsContact C-N 3.29Å; N94-R96 PolarHBondContact O-N 2.99Å; N94-R96 PolarHBondContact OD1-N 2.82Å; N94-R96 VanDerWaalsContact OD1-N 3.14Å; N94-E97 HydrophobicContact CB-CB 4.35Å; N94-E97 PolarHBondContact ND2-OE1 3.33Å; N94-E97 PolarHBondContact O-N 2.88Å; N94-E97 PolarHBondContact OD1-N 2.85Å; N94-K98 PolarHBondContact O-N 2.99Å; N94-K99 PolarHBondContact N-O 2.99Å; N94-K99 PolarHBondContact O-N 2.98Å; N94-K99 VanDerWaalsContact O-N 3.09Å
95	K	96.5	Very high	98.3	Very high	112 Å²	112	61.7 Å²	61.7	49%	0.487	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-37.4	-179.9	-165.2	166.2	-175.2	159.8	0	113.2	S79 F93 K98	S79-K95 PolarHBondContact OG-NZ 2.93Å; F93-K95 HydrophobicContact CD1-CB 4.41Å; F93-K95 HydrophobicContact CE1-CB 3.56Å; F93-K95 HydrophobicContact CE1-CD 4.33Å; F93-K95 HydrophobicContact CE1-CG 4.06Å; F93-K95 HydrophobicContact CZ-CB 3.92Å; F93-K95 HydrophobicContact CZ-CG 4.12Å; K95-K98 PolarHBondContact O-N 3.46Å
96	R	96.3	Very high	98.3	Very high	238 Å²	238	60.5 Å²	60.5	90%	0.898	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-40.3	-176.7	-174.8	-179.3	179.6	-147.1	0.1	111.3	N94 K98	N94-R96 VanDerWaalsContact C-N 3.29Å; N94-R96 PolarHBondContact O-N 2.99Å; N94-R96 PolarHBondContact OD1-N 2.82Å; N94-R96 VanDerWaalsContact OD1-N 3.14Å; R96-K98 VanDerWaalsContact C-N 3.34Å
97	E	97.7	Very high	98.3	Very high	111 Å²	111	56 Å²	56	52%	0.519	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.5	177.9	-67.7	-177.9	-146.4	0	0	113.5	N94 K99	N94-E97 HydrophobicContact CB-CB 4.35Å; N94-E97 PolarHBondContact ND2-OE1 3.33Å; N94-E97 PolarHBondContact O-N 2.88Å; N94-E97 PolarHBondContact OD1-N 2.85Å; E97-K99 VanDerWaalsContact C-N 3.29Å; E97-K99 HydrophobicContact CB-CB 4.36Å; E97-K99 HydrophobicContact CB-CD 4.15Å; E97-K99 HydrophobicContact CB-CG 4.25Å; E97-K99 PolarHBondContact O-N 3.42Å; E97-K99 IonicContact OE2-NZ 3.51Å
98	K	97.4	Very high	98.3	Very high	64 Å²	64	56.4 Å²	56.4	28%	0.278	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	47	-171.7	-55.5	-178.7	176.9	-177	0	112.4	S51 Y52 E53 S55 N94 K95 R96	S51-K98 CarbonylContact C-O 3.6Å; S51-K98 VanDerWaalsContact CA-O 3.27Å; S51-K98 WeakPolarHBondContact CA-O 3.43Å; Y52-K98 HydrophobicContact CD1-CB 4Å; Y52-K98 VanDerWaalsContact CD1-O 3.26Å; Y52-K98 WeakPolarHBondContact CD1-O 3.12Å; Y52-K98 HydrophobicContact CD2-CB 4.27Å; Y52-K98 HydrophobicContact CE1-CB 3.72Å; Y52-K98 HydrophobicContact CE1-CG 4.48Å; Y52-K98 HydrophobicContact CE2-CB 4.03Å; Y52-K98 HydrophobicContact CE2-CD 4.39Å; Y52-K98 HydrophobicContact CE2-CG 4.07Å; Y52-K98 HydrophobicContact CG-CB 4.26Å; Y52-K98 PolarHBondContact N-O 3.38Å; Y52-K98 WeakPolarHBondContact O-CB 3.4Å; Y52-K98 WeakPolarHBondContact O-CD 3.35Å; E53-K98 PolarHBondContact O-NZ 2.82Å; S55-K98 WeakPolarHBondContact OG-CE 3.3Å; S55-K98 PolarHBondContact OG-NZ 3.09Å; N94-K98 PolarHBondContact O-N 2.99Å; K95-K98 PolarHBondContact O-N 3.46Å; R96-K98 VanDerWaalsContact C-N 3.34Å
99	K	98.4	Very high	98.3	Very high	106 Å²	106	58 Å²	58	46%	0.461	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.5	-178.2	-71.2	176.7	-171	168.1	0	111	C50 N94 E97	C50-K99 CarbonylContact O-C 3.49Å; C50-K99 VanDerWaalsContact O-CA 3.3Å; C50-K99 WeakPolarHBondContact O-CA 3.35Å; N94-K99 PolarHBondContact N-O 2.99Å; N94-K99 PolarHBondContact O-N 2.98Å; N94-K99 VanDerWaalsContact O-N 3.09Å; E97-K99 VanDerWaalsContact C-N 3.29Å; E97-K99 HydrophobicContact CB-CB 4.36Å; E97-K99 HydrophobicContact CB-CD 4.15Å; E97-K99 HydrophobicContact CB-CG 4.25Å; E97-K99 PolarHBondContact O-N 3.42Å; E97-K99 IonicContact OE2-NZ 3.51Å
100	L	98.3	Very high	98.2	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	153.9	166.7	46.7	151.6	0	0	0	109.9	C50 Y52 F60 W62 I91 F92 F93	C50-L100 HydrophobicContact CB-CD1 4.44Å; C50-L100 HydrophobicContact CB-CG 3.97Å; C50-L100 PolarHBondContact N-O 3.03Å; C50-L100 PolarHBondContact O-N 2.03Å; Y52-L100 HydrophobicContact CD1-CD2 3.85Å; Y52-L100 HydrophobicContact CE1-CD2 4.13Å; F60-L100 HydrophobicContact CB-CD1 3.8Å; F60-L100 HydrophobicContact CD1-CD1 4.41Å; F60-L100 HydrophobicContact CD1-CD2 3.73Å; F60-L100 HydrophobicContact CE1-CD2 4.25Å; F60-L100 HydrophobicContact CG-CD1 4.37Å; F60-L100 HydrophobicContact CG-CD2 4.28Å; W62-L100 HydrophobicContact CZ2-CD1 4.48Å; I91-L100 HydrophobicContact CG2-CB 4.31Å; I91-L100 HydrophobicContact CG2-CD1 4.47Å; F92-L100 CarbonylContact O-C 3.48Å; F92-L100 WeakPolarHBondContact O-CA 2.84Å; F92-L100 VanDerWaalsContact O-CB 3.24Å; F92-L100 WeakPolarHBondContact O-CB 3.42Å; F93-L100 HydrophobicContact CD2-CB 4.07Å; F93-L100 HydrophobicContact CD2-CD2 4.15Å; F93-L100 HydrophobicContact CE2-CD2 4.35Å
101	S	98.8	Very high	98.2	Very high	15 Å²	15	58.8 Å²	58.8	11%	0.105	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.4	172.9	58.6	0	0	0	0	110.5	L48 I91 F92 H103	L48-S101 CarbonylContact O-C 3.57Å; L48-S101 WeakPolarHBondContact O-CA 3.3Å; I91-S101 CarbonylContact C-O 3.53Å; I91-S101 VanDerWaalsContact CA-O 3.26Å; I91-S101 WeakPolarHBondContact CA-O 3.39Å; F92-S101 PolarHBondContact N-O 2.94Å; F92-S101 PolarHBondContact O-N 2.98Å; S101-H103 PolarHBondContact OG-CD2 3.28Å; S101-H103 VanDerWaalsContact OG-CD2 3.26Å; S101-H103 PolarHBondContact OG-NE2 2.88Å
102	L	98.9	Very high	98.2	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.8	166.3	175.2	66.3	0	0	0	108.1	I47 L48 W62 L74 I75 F89 T90 I91 I104 Y115	I47-L102 WeakPolarHBondContact CA-O 3.35Å; L48-L102 HydrophobicContact CB-CB 4.45Å; L48-L102 HydrophobicContact CD1-CD2 4.42Å; L48-L102 PolarHBondContact N-O 3.22Å; L48-L102 PolarHBondContact O-N 3.05Å; W62-L102 HydrophobicContact CB-CD2 4.27Å; W62-L102 HydrophobicContact CD2-CB 3.75Å; W62-L102 HydrophobicContact CD2-CD2 3.85Å; W62-L102 HydrophobicContact CD2-CG 4.34Å; W62-L102 HydrophobicContact CE3-CB 4.07Å; W62-L102 HydrophobicContact CE3-CD2 3.73Å; W62-L102 HydrophobicContact CG-CB 4.26Å; W62-L102 HydrophobicContact CG-CD2 4.1Å; W62-L102 HydrophobicContact CH2-CB 4.06Å; W62-L102 HydrophobicContact CZ2-CB 3.75Å; W62-L102 HydrophobicContact CZ3-CB 4.21Å; W62-L102 HydrophobicContact CZ3-CD2 4.32Å; L74-L102 HydrophobicContact CD2-CD1 4.44Å; L74-L102 HydrophobicContact CD2-CD2 3.86Å; I75-L102 HydrophobicContact CG2-CD1 3.87Å; F89-L102 HydrophobicContact CB-CD1 4.39Å; F89-L102 HydrophobicContact CD1-CD1 4.45Å; T90-L102 CarbonylContact O-C 3.53Å; T90-L102 WeakPolarHBondContact O-CA 3.27Å; I91-L102 HydrophobicContact CG1-CD1 4.33Å; L102-I104 HydrophobicContact CG-CG1 4.31Å; L102-Y115 HydrophobicContact CD2-CD1 3.84Å; L102-Y115 HydrophobicContact CD2-CE1 4.3Å
103	H	98.9	Very high	98.2	Very high	42 Å²	42	60.5 Å²	60.5	19%	0.194	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.5	174.6	-69.6	-135	0	0	0	108.3	T45 A46 F89 T90 F92 S101	T45-H103 HydrophobicContact CG2-CB 4.3Å; A46-H103 CarbonylContact O-C 3.59Å; A46-H103 WeakPolarHBondContact O-CA 3.35Å; F89-H103 CarbonylContact C-O 3.6Å; F89-H103 WeakPolarHBondContact CA-O 3.4Å; T90-H103 PolarHBondContact N-O 2.88Å; T90-H103 PolarHBondContact O-N 2.83Å; F92-H103 AromaticContact CD2-CD2 3.61Å; F92-H103 AromaticContact CD2-CE1 3.99Å; F92-H103 AromaticContact CD2-NE2 3.61Å; F92-H103 HydrophobicContact CE2-CB 4.49Å; F92-H103 AromaticContact CE2-CD2 3.96Å; F92-H103 AromaticContact CE2-CE1 3.92Å; F92-H103 AromaticContact CE2-CG 3.89Å; F92-H103 AromaticContact CE2-ND1 3.86Å; S101-H103 PolarHBondContact OG-CD2 3.28Å; S101-H103 VanDerWaalsContact OG-CD2 3.26Å; S101-H103 PolarHBondContact OG-NE2 2.88Å
104	I	98.8	Very high	98.2	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.021	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	100	175.3	-47.9	176.7	0	0	0	105.7	T45 A46 F89 L102 S107 Y115	T45-I104 CarbonylContact C-O 3.55Å; T45-I104 VanDerWaalsContact CA-O 3.29Å; T45-I104 WeakPolarHBondContact CA-O 3.43Å; A46-I104 HydrophobicContact CB-CB 4.22Å; A46-I104 HydrophobicContact CB-CD1 4.5Å; A46-I104 PolarHBondContact N-O 3.35Å; A46-I104 PolarHBondContact O-N 2.94Å; F89-I104 HydrophobicContact CD1-CB 4.4Å; F89-I104 HydrophobicContact CD1-CD1 4.44Å; F89-I104 HydrophobicContact CD1-CG1 3.86Å; F89-I104 HydrophobicContact CD1-CG2 4.13Å; F89-I104 HydrophobicContact CE1-CB 4.34Å; F89-I104 HydrophobicContact CE1-CD1 4.06Å; F89-I104 HydrophobicContact CE1-CG1 3.9Å; F89-I104 HydrophobicContact CE1-CG2 3.7Å; F89-I104 HydrophobicContact CZ-CG2 4.41Å; L102-I104 HydrophobicContact CG-CG1 4.31Å; I104-S107 PolarHBondContact O-OG 2.91Å; I104-Y115 HydrophobicContact CD1-CE1 3.79Å; I104-Y115 HydrophobicContact CD1-CE2 4.12Å
105	A	98.7	Very high	98.2	Very high	39 Å²	39	61.6 Å²	61.6	32%	0.322	33%	0.327	S	S	.	.			trans	-77.5	155.9	178.7	0	0	0	0	0	110.7	R88 S107	R88-A105 WeakPolarHBondContact CB-O 3.47Å; R88-A105 WeakPolarHBondContact CD-O 3.49Å; R88-A105 PolarHBondContact NH1-O 2.83Å; R88-A105 PolarHBondContact O-N 3.25Å; A105-S107 PolarHBondContact O-N 2.95Å
106	D	98.5	Very high	98.3	Very high	87 Å²	87	60 Å²	60	47%	0.465	32%	0.32	S	S	.	.	S	Bend	trans	47.9	58.3	177.9	179.7	53.2	0	0	0	110.8	R88 Q108	R88-D106 PolarHBondContact NH1-O 2.85Å; D106-Q108 WeakPolarHBondContact O-CG 3.27Å; D106-Q108 PolarHBondContact O-N 2.79Å; D106-Q108 PolarHBondContact OD2-NE2 3.07Å
107	S	98.7	Very high	98.4	Very high	6 Å²	6	49.1 Å²	49.1	4%	0.042	28%	0.281	C	S	.	.			trans	-59	136.2	-172.4	-61.3	0	0	0	0	110.9	E42 G43 E44 I104 A105	E42-S107 CarbonylContact C-O 3.45Å; E42-S107 VanDerWaalsContact CA-O 3.28Å; E42-S107 WeakPolarHBondContact CA-O 3.42Å; E42-S107 WeakPolarHBondContact CG-O 3.46Å; G43-S107 PolarHBondContact N-O 2.9Å; E44-S107 VanDerWaalsContact O-CB 3.23Å; E44-S107 WeakPolarHBondContact O-CB 3.29Å; E44-S107 PolarHBondContact O-N 3.14Å; E44-S107 PolarHBondContact O-OG 2.8Å; I104-S107 PolarHBondContact O-OG 2.91Å; A105-S107 PolarHBondContact O-N 2.95Å
108	Q	98.4	Very high	98.4	Very high	84 Å²	84	45.5 Å²	45.5	39%	0.393	27%	0.27	S	S	.	.			trans	-119.6	155.4	-178	-64.9	171.5	14.3	0	0	109.7	D106 G110 D111	D106-Q108 WeakPolarHBondContact O-CG 3.27Å; D106-Q108 PolarHBondContact O-N 2.79Å; D106-Q108 PolarHBondContact OD2-NE2 3.07Å; Q108-G110 PolarHBondContact O-N 2.79Å; Q108-D111 PolarHBondContact N-OD2 3.23Å; Q108-D111 WeakPolarHBondContact O-CB 3.33Å; Q108-D111 PolarHBondContact O-N 2.78Å
109	P	97.9	Very high	98.3	Very high	89 Å²	89	43.3 Å²	43.3	58%	0.578	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-52.6	-32.3	174.7	-28.9	35.9	0	0	0	113.5	D111 S112	P109-D111 PolarHBondContact O-N 3.36Å; P109-S112 WeakPolarHBondContact O-CB 3.27Å; P109-S112 PolarHBondContact O-N 2.77Å; P109-S112 PolarHBondContact O-OG 3.04Å
110	G	97.6	Very high	98.2	Very high	52 Å²	52	42.5 Å²	42.5	54%	0.536	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-68	-9.8	175.7	0	0	0	0	0	115.5	F66 Q108 S112	F66-G110 VanDerWaalsContact CE1-O 3.31Å; F66-G110 WeakPolarHBondContact CE1-O 3.11Å; Q108-G110 PolarHBondContact O-N 2.79Å; G110-S112 VanDerWaalsContact C-N 3.26Å
111	D	98.3	Very high	98.2	Very high	19 Å²	19	44.4 Å²	44.4	10%	0.102	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-83	-3.2	173.2	-61	-38.8	0	0	0	112.6	R88 Q108 P109 A113 Y115	R88-D111 IonicContact CZ-OD1 2.85Å; R88-D111 IonicContact CZ-OD2 2.74Å; R88-D111 VanDerWaalsContact CZ-OD2 3.31Å; R88-D111 IonicContact NH1-OD1 2.7Å; R88-D111 IonicContact NH1-OD2 3.56Å; R88-D111 PolarHBondContact NH1-OD2 3.42Å; R88-D111 VanDerWaalsContact NH2-CG 3.28Å; R88-D111 IonicContact NH2-OD1 3.53Å; R88-D111 PolarHBondContact NH2-OD1 2.75Å; R88-D111 IonicContact NH2-OD2 3.7Å; R88-D111 PolarHBondContact NH2-OD2 3.36Å; Q108-D111 PolarHBondContact N-OD2 3.23Å; Q108-D111 WeakPolarHBondContact O-CB 3.33Å; Q108-D111 PolarHBondContact O-N 2.78Å; P109-D111 PolarHBondContact O-N 3.36Å; D111-A113 PolarHBondContact O-N 2.92Å; D111-Y115 WeakPolarHBondContact O-CE2 3.36Å; D111-Y115 PolarHBondContact O-OH 2.95Å
112	S	98.3	Very high	98.1	Very high	90 Å²	90	45.9 Å²	45.9	63%	0.629	29%	0.293	S	S	*	.			trans	-66.8	98.8	179.5	-58.9	0	0	0	0	111.1	P109 G110	P109-S112 WeakPolarHBondContact O-CB 3.27Å; P109-S112 PolarHBondContact O-N 2.77Å; P109-S112 PolarHBondContact O-OG 3.04Å; G110-S112 VanDerWaalsContact C-N 3.26Å
113	A	98.5	Very high	98.1	Very high	30 Å²	30	48.5 Å²	48.5	25%	0.248	31%	0.309	C	S	.	.	S	Bend	trans	-155.2	171.5	-175.1	0	0	0	0	0	111.6	Q64 Q65 F66 D111 Y115	Q64-A113 HydrophobicContact CG-CB 3.57Å; Q65-A113 WeakPolarHBondContact O-CB 3.47Å; F66-A113 HydrophobicContact CD1-CB 3.88Å; F66-A113 HydrophobicContact CE1-CB 3.96Å; D111-A113 PolarHBondContact O-N 2.92Å; A113-Y115 HydrophobicContact CB-CD2 4.46Å; A113-Y115 HydrophobicContact CB-CE2 3.91Å; A113-Y115 WeakPolarHBondContact O-CD2 3.5Å
114	T	98.6	Very high	98	Very high	75 Å²	75	48.9 Å²	48.9	46%	0.46	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.8	164.9	-54.1	0	0	0	0	109.3	Q64 Q65 F116	Q64-T114 CarbonylContact C-O 3.5Å; Q65-T114 PolarHBondContact N-O 2.94Å; Q65-T114 PolarHBondContact O-N 2.94Å; T114-F116 HydrophobicContact CG2-CD2 4.41Å; T114-F116 HydrophobicContact CG2-CE1 3.79Å; T114-F116 HydrophobicContact CG2-CE2 3.68Å; T114-F116 HydrophobicContact CG2-CZ 3.32Å
115	Y	98.7	Very high	98	Very high	26 Å²	26	51.7 Å²	51.7	10%	0.102	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.3	-179.7	-69	-95.2	0	0	0	111.2	Q33 L48 Y63 Q64 L74 L102 I104 D111 A113	Q33-Y115 PolarHBondContact NE2-O 3.11Å; L48-Y115 VanDerWaalsContact CD1-CB 3.43Å; L48-Y115 HydrophobicContact CD1-CD1 4.37Å; L48-Y115 HydrophobicContact CD1-CD2 3.93Å; L48-Y115 HydrophobicContact CD1-CG 3.67Å; Y63-Y115 CarbonylContact O-C 3.59Å; Y63-Y115 VanDerWaalsContact O-CA 3.29Å; Y63-Y115 WeakPolarHBondContact O-CA 3.4Å; Q64-Y115 HydrophobicContact CB-CD1 4.34Å; Q64-Y115 HydrophobicContact CB-CE1 4.13Å; Q64-Y115 HydrophobicContact CG-CD1 4.4Å; Q64-Y115 HydrophobicContact CG-CE1 3.88Å; Q64-Y115 PolarHBondContact NE2-OH 3.21Å; L74-Y115 HydrophobicContact CD2-CD1 4.01Å; L74-Y115 HydrophobicContact CD2-CE1 3.73Å; L102-Y115 HydrophobicContact CD2-CD1 3.84Å; L102-Y115 HydrophobicContact CD2-CE1 4.3Å; I104-Y115 HydrophobicContact CD1-CE1 3.79Å; I104-Y115 HydrophobicContact CD1-CE2 4.12Å; D111-Y115 WeakPolarHBondContact O-CE2 3.36Å; D111-Y115 PolarHBondContact O-OH 2.95Å; A113-Y115 HydrophobicContact CB-CD2 4.46Å; A113-Y115 HydrophobicContact CB-CE2 3.91Å; A113-Y115 WeakPolarHBondContact O-CD2 3.5Å
116	F	98.3	Very high	98	Very high	77 Å²	77	52.5 Å²	52.5	34%	0.338	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.2	-179.6	-54.3	-83.6	0	0	0	110.7	W62 Y63 Q65 P71 T114	W62-F116 CarbonylContact C-O 3.58Å; W62-F116 VanDerWaalsContact CA-O 3.28Å; W62-F116 WeakPolarHBondContact CA-O 3.29Å; Y63-F116 PolarHBondContact N-O 3.07Å; Y63-F116 PolarHBondContact O-N 2.81Å; Q65-F116 HydrophobicContact CB-CE2 3.78Å; Q65-F116 VanDerWaalsContact OE1-CE2 3.26Å; P71-F116 HydrophobicContact CB-CD2 4.4Å; P71-F116 HydrophobicContact CG-CD2 4.5Å; P71-F116 HydrophobicContact CG-CE2 4.25Å; T114-F116 HydrophobicContact CG2-CD2 4.41Å; T114-F116 HydrophobicContact CG2-CE1 3.79Å; T114-F116 HydrophobicContact CG2-CE2 3.68Å; T114-F116 HydrophobicContact CG2-CZ 3.32Å
117	C	98.2	Very high	97.9	Very high	11 Å²	11	50.1 Å²	50.1	7%	0.074	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	139	168.2	178.8	0	0	0	0	109	V31 Q33 C50 W62	V31-C117 HydrophobicContact CG1-CB 4.42Å; Q33-C117 VanDerWaalsContact CD-N 3.26Å; Q33-C117 HydrophobicContact CG-CB 3.71Å; C50-C117 HydrophobicContact CB-CB 3.53Å; C50-C117 WeakPolarHBondContact CB-SG 3.31Å; C50-C117 WeakPolarHBondContact SG-CB 3.38Å; C50-C117 CovalentContact SG-SG 2.03Å; C50-C117 PolarHBondContact SG-SG 2.95Å; W62-C117 HydrophobicContact CD2-CB 4.11Å; W62-C117 HydrophobicContact CE3-CB 4.01Å; W62-C117 HydrophobicContact CH2-CB 3.77Å; W62-C117 HydrophobicContact CZ2-CB 3.83Å; W62-C117 HydrophobicContact CZ3-CB 3.85Å
118	A	97.6	Very high	97.9	Very high	35 Å²	35	53.5 Å²	53.5	29%	0.289	35%	0.348	S	S	.	.			trans	-130.4	168.4	168.1	0	0	0	0	0	111.5	F60 P61 Y63	F60-A118 WeakPolarHBondContact CA-O 3.29Å; P61-A118 WeakPolarHBondContact CD-O 3.21Å; P61-A118 HydrophobicContact CG-CB 4.01Å; P61-A118 PolarHBondContact O-N 2.98Å; Y63-A118 HydrophobicContact CE2-CB 4.27Å
119	A	97.1	Very high	97.8	Very high	18 Å²	18	50.9 Å²	50.9	15%	0.149	34%	0.344	C	S	.	.			trans	-145.8	137.6	174.6	0	0	0	0	0	108.9	V31 F57 Y59 F60	V31-A119 HydrophobicContact CG2-CB 3.71Å; F57-A119 HydrophobicContact CB-CB 4.09Å; F57-A119 HydrophobicContact CD2-CB 3.36Å; F57-A119 HydrophobicContact CE2-CB 3.84Å; F57-A119 HydrophobicContact CG-CB 3.89Å; Y59-A119 WeakPolarHBondContact O-CA 3.3Å; F60-A119 HydrophobicContact CD1-CB 3.64Å; F60-A119 HydrophobicContact CE1-CB 3.65Å
120	S	94.8	Very high	97.8	Very high	89 Å²	89	47.5 Å²	47.5	62%	0.622	32%	0.323	S	S	*	.			trans	-144.6	0	178.5	59.8	0	0	0	0	112	F57 D58 Y59	F57-S120 CarbonylContact C-O 3.6Å; F57-S120 WeakPolarHBondContact CA-O 3.34Å; F57-S120 VanDerWaalsContact CD1-OXT 3.3Å; F57-S120 WeakPolarHBondContact CD1-OXT 3.28Å; D58-S120 PolarHBondContact N-O 3.47Å; Y59-S120 PolarHBondContact N-O 3Å; Y59-S120 PolarHBondContact O-N 2.93Å

Retrieved 120 of 120 residues in 47 ms (Link to these results)

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