A0A075B645_MOUSE Loading...

T cell receptor alpha variable 14N-3

AlphaFold DB , UniProt , Accession A0A075B645, Species MOUSE (Mus musculus, Mouse), Gene Trav14n-3, Length 120 aa.

						>A0A075B645_MOUSE|A0A075B645|Trav14n-3
MDKILTALFLLLGLHLAGVSGQQEKHDQQQVRQSSQSLTVWEGETAILNCSYENSAFDYFPWYQQFPGEGPALLIAIRSVSDKKEDGRFTIFFNKREKNLSLHIKDSQPGDSATYFCAAS
					

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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	56.8	Low	51.1	Low	208 Å²	208	132.9 Å²	132.9	100%	1.025	69%	0.685	S	S	*	*				0	23.9	0	-86.1	168.9	-68	0	0	111.2
2	D	54	Low	51.3	Low	138 Å²	138	134.8 Å²	134.8	74%	0.738	70%	0.696	S	S	*	*			trans	-111.8	6.2	-170.3	-47.2	-71	0	0	0	113.9	T6	D2-T6 PolarHBondContact O-OG1 3.07Å
3	K	45.1	Very low	51.8	Low	192 Å²	192	127.8 Å²	127.8	84%	0.835	68%	0.677	S	S	*	*	S	Bend	trans	-104.2	-16.2	178.6	-63.1	-174.6	175.9	-177.7	0	113.8
4	I	53.6	Low	52.1	Low	129 Å²	129	130.4 Å²	130.4	66%	0.662	69%	0.69	S	S	*	*	S	Bend	trans	-86.2	-30.4	-179.7	-63.4	172.1	0	0	0	110.6	A7	I4-A7 PolarHBondContact O-N 2.74Å
5	L	52.3	Low	52.3	Low	111 Å²	111	133.1 Å²	133.1	58%	0.581	70%	0.697	S	S	*	*	H	α-helix	trans	-70.1	-33.7	178.8	-165.7	63.4	0	0	0	112.2	A7 L8 F9	L5-A7 VanDerWaalsContact C-N 3.3Å; L5-A7 PolarHBondContact O-N 3.28Å; L5-L8 PolarHBondContact O-N 2.86Å; L5-F9 HydrophobicContact CD1-CE2 4.46Å; L5-F9 HydrophobicContact CG-CE2 4.14Å; L5-F9 VanDerWaalsContact O-CD2 3.25Å; L5-F9 WeakPolarHBondContact O-CD2 3.28Å
6	T	49.1	Very low	52.2	Low	91 Å²	91	135.9 Å²	135.9	56%	0.558	71%	0.711	S	S	*	*	H	α-helix	trans	-67.8	-29.5	176.9	-22.1	0	0	0	0	112.6	D2	D2-T6 PolarHBondContact O-OG1 3.07Å
7	A	51	Low	52.2	Low	54 Å²	54	132.1 Å²	132.1	45%	0.446	71%	0.705	S	S	.	*	H	α-helix	trans	-75.4	-28.5	178.4	0	0	0	0	0	112.9	I4 L5 L10	I4-A7 PolarHBondContact O-N 2.74Å; L5-A7 VanDerWaalsContact C-N 3.3Å; L5-A7 PolarHBondContact O-N 3.28Å; A7-L10 PolarHBondContact O-N 3.28Å
8	L	49	Very low	52.1	Low	102 Å²	102	128.4 Å²	128.4	53%	0.534	70%	0.703	S	S	.	*	H	α-helix	trans	-71.8	-29.4	176.5	-80.5	161.6	0	0	0	112.8	L5 L10 L11	L5-L8 PolarHBondContact O-N 2.86Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L8-L11 PolarHBondContact O-N 3.09Å
9	F	52.3	Low	51.9	Low	150 Å²	150	128.8 Å²	128.8	66%	0.658	71%	0.709	S	S	*	*	H	α-helix	trans	-73.4	-22.9	175.2	-76.5	-73.1	0	0	0	113.5	L5	L5-F9 HydrophobicContact CD1-CE2 4.46Å; L5-F9 HydrophobicContact CG-CE2 4.14Å; L5-F9 VanDerWaalsContact O-CD2 3.25Å; L5-F9 WeakPolarHBondContact O-CD2 3.28Å
10	L	47.3	Very low	52	Low	142 Å²	142	127.5 Å²	127.5	74%	0.743	71%	0.71	S	S	*	*	H	α-helix	trans	-80.9	-17.9	176	-65.8	175.5	0	0	0	113.3	A7 L8	A7-L10 PolarHBondContact O-N 3.28Å; L8-L10 VanDerWaalsContact C-N 3.33Å
11	L	51.8	Low	51.7	Low	145 Å²	145	124 Å²	124	76%	0.759	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-12.3	176.6	-79.1	161.2	0	0	0	113.7	L8	L8-L11 PolarHBondContact O-N 3.09Å
12	L	53.2	Low	51.2	Low	156 Å²	156	122.2 Å²	122.2	82%	0.817	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-1.6	178.2	-90.8	146.3	0	0	0	113.8
13	G	57.4	Low	50.9	Low	43 Å²	43	124.3 Å²	124.3	44%	0.443	70%	0.697	S	S	.	*	S	Bend	trans	-106.9	128.6	175.1	0	0	0	0	0	111.4
14	L	56.7	Low	50.9	Low	165 Å²	165	122.3 Å²	122.3	86%	0.864	69%	0.69	S	S	*	*	S	Bend	trans	82.4	75.1	177.2	-70.4	82.6	0	0	0	117
15	H	55.2	Low	50.5	Low	171 Å²	171	124.3 Å²	124.3	79%	0.792	69%	0.694	S	S	*	*				-172.2	73.9	109.3	-104.7	-15.1	0	0	0	110.1
16	L	50.1	Low	50.3	Low	177 Å²	177	125.9 Å²	125.9	93%	0.927	70%	0.698	S	S	*	*			trans	-89.7	81.1	136.4	-67.4	174.5	0	0	0	104.5	G18	L16-G18 PolarHBondContact O-N 3.14Å
17	A	52.7	Low	50.4	Low	72 Å²	72	127.7 Å²	127.7	60%	0.595	71%	0.705	S	S	*	*			trans	-57.9	99.2	150.4	0	0	0	0	0	103.5	V19	A17-V19 VanDerWaalsContact C-N 3.3Å; A17-V19 PolarHBondContact O-N 2.89Å
18	G	49.9	Very low	50.7	Low	66 Å²	66	131.7 Å²	131.7	68%	0.68	71%	0.714	S	S	*	*			trans	-52.3	110.6	165.4	0	0	0	0	0	104.4	L16 S20	L16-G18 PolarHBondContact O-N 3.14Å; G18-S20 PolarHBondContact O-N 3.02Å
19	V	48.7	Very low	51.5	Low	135 Å²	135	132 Å²	132	82%	0.818	71%	0.713	S	S	*	*			trans	-61.2	95.9	156	178.2	0	0	0	0	101.5	A17 G21	A17-V19 VanDerWaalsContact C-N 3.3Å; A17-V19 PolarHBondContact O-N 2.89Å; V19-G21 PolarHBondContact O-N 3.49Å
20	S	54.8	Low	53.1	Low	103 Å²	103	127.1 Å²	127.1	72%	0.72	69%	0.692	S	S	*	*			trans	-54.8	97	153	179.4	0	0	0	0	101.8	G18 Q22	G18-S20 PolarHBondContact O-N 3.02Å; S20-Q22 PolarHBondContact O-N 2.77Å
21	G	45.9	Very low	55.4	Low	53 Å²	53	122.4 Å²	122.4	55%	0.546	67%	0.669	S	S	.	*			trans	-53.6	105.3	163.1	0	0	0	0	0	102.1	V19 Q23	V19-G21 PolarHBondContact O-N 3.49Å; G21-Q23 PolarHBondContact O-N 2.84Å
22	Q	45.8	Very low	57.4	Low	172 Å²	172	121.7 Å²	121.7	80%	0.804	66%	0.656	S	S	*	*			trans	-54.5	101	153.8	-73.1	175.3	-74.9	0	0	101.4	S20 E24	S20-Q22 PolarHBondContact O-N 2.77Å; Q22-E24 PolarHBondContact O-N 2.88Å
23	Q	46.3	Very low	59.4	Low	182 Å²	182	117.9 Å²	117.9	85%	0.85	63%	0.634	S	S	*	*			trans	-58.3	89.9	158.9	-167.9	91.3	6.3	0	0	101.2	G21 K25	G21-Q23 PolarHBondContact O-N 2.84Å; Q23-K25 PolarHBondContact O-N 2.87Å
24	E	47.1	Very low	60.6	Low	149 Å²	149	119.8 Å²	119.8	70%	0.696	64%	0.641	S	S	*	*			trans	-55.2	104.4	163.4	-71.6	-167	166.5	0	0	102	Q22 H26	Q22-E24 PolarHBondContact O-N 2.88Å; E24-H26 PolarHBondContact O-N 2.81Å
25	K	43.7	Very low	61.7	Low	171 Å²	171	114.6 Å²	114.6	74%	0.743	62%	0.618	S	S	*	*			trans	-65.6	77.9	164	-170.3	-167.8	178.6	-139.9	0	103.3	Q23 D27	Q23-K25 PolarHBondContact O-N 2.87Å; K25-D27 VanDerWaalsContact C-N 3.32Å; K25-D27 IonicContact NZ-OD1 3.64Å; K25-D27 PolarHBondContact O-N 3.3Å
26	H	49.7	Very low	63	Low	145 Å²	145	116.4 Å²	116.4	67%	0.671	63%	0.627	S	S	*	*			trans	-49.8	113.5	155.3	-115.8	-95.4	0	0	0	102.4	E24 Q28	E24-H26 PolarHBondContact O-N 2.81Å; H26-Q28 PolarHBondContact O-N 3.22Å
27	D	51	Low	64.9	Low	129 Å²	129	112.9 Å²	112.9	69%	0.69	62%	0.617	S	S	*	*			trans	-60.6	83.1	166.3	-74.7	-37.6	0	0	0	105	K25 Q29	K25-D27 VanDerWaalsContact C-N 3.32Å; K25-D27 IonicContact NZ-OD1 3.64Å; K25-D27 PolarHBondContact O-N 3.3Å; D27-Q29 PolarHBondContact O-N 2.87Å
28	Q	57.3	Low	66.9	Low	137 Å²	137	113.4 Å²	113.4	64%	0.64	61%	0.61	S	S	*	*			trans	-59.9	109.1	174.2	-79.1	-175	-27	0	0	103.5	H26 Q30	H26-Q28 PolarHBondContact O-N 3.22Å; Q28-Q30 VanDerWaalsContact C-N 3.28Å; Q28-Q30 WeakPolarHBondContact O-CA 3.42Å; Q28-Q30 WeakPolarHBondContact O-CB 3.48Å; Q28-Q30 PolarHBondContact O-N 3.26Å
29	Q	65.9	Low	69.1	Low	109 Å²	109	116.4 Å²	116.4	51%	0.509	62%	0.615	S	S	.	*			trans	-53.5	103.2	170.9	-66.7	170.4	-108.8	0	0	106.8	D27 N54 F57	D27-Q29 PolarHBondContact O-N 2.87Å; Q29-N54 HydrophobicContact CB-CB 4.12Å; Q29-N54 VanDerWaalsContact CD-ND2 3.27Å; Q29-N54 HydrophobicContact CG-CB 3.82Å; Q29-N54 PolarHBondContact NE2-ND2 2.91Å; Q29-F57 HydrophobicContact CB-CE1 4.44Å; Q29-F57 HydrophobicContact CB-CE2 3.91Å; Q29-F57 HydrophobicContact CB-CZ 3.48Å; Q29-F57 VanDerWaalsContact CB-CZ 3.48Å; Q29-F57 HydrophobicContact CG-CZ 4.16Å
30	Q	85.6	Confident	71.4	Confident	48 Å²	48	112 Å²	112	22%	0.224	59%	0.589	C	S	.	*			trans	-96.8	128.3	-159.3	-145.8	172	-112.5	0	0	108.9	Q28 R32 Y52 E53	Q28-Q30 VanDerWaalsContact C-N 3.28Å; Q28-Q30 WeakPolarHBondContact O-CA 3.42Å; Q28-Q30 WeakPolarHBondContact O-CB 3.48Å; Q28-Q30 PolarHBondContact O-N 3.26Å; Q30-R32 HydrophobicContact CG-CG 4.05Å; Q30-R32 VanDerWaalsContact CG-NE 3.27Å; Q30-Y52 CarbonylContact O-C 3.51Å; Q30-Y52 VanDerWaalsContact O-CA 3.28Å; Q30-Y52 WeakPolarHBondContact O-CA 3.38Å; Q30-E53 HydrophobicContact CB-CB 4.38Å; Q30-E53 VanDerWaalsContact CB-CD 3.47Å; Q30-E53 HydrophobicContact CB-CG 4.04Å; Q30-E53 WeakPolarHBondContact CB-OE1 3.29Å; Q30-E53 PolarHBondContact NE2-OE1 2.93Å; Q30-E53 PolarHBondContact O-N 2.85Å
31	V	93.9	Very high	73.4	Confident	43 Å²	43	116.6 Å²	116.6	26%	0.261	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.6	132.3	162	-179.7	0	0	0	0	107.3	C50 S51 C117 A119	V31-C50 WeakPolarHBondContact CG1-SG 3.47Å; V31-S51 CarbonylContact C-O 3.59Å; V31-S51 WeakPolarHBondContact CA-O 3.3Å; V31-C117 HydrophobicContact CG1-CB 4.2Å; V31-A119 HydrophobicContact CG2-CB 3.82Å
32	R	95.4	Very high	75.9	Confident	129 Å²	129	121.2 Å²	121.2	49%	0.487	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.7	128.5	-176.2	-67.5	-59.6	-172.3	-161.2	-4.7	110.9	Q30 C50 S51	Q30-R32 HydrophobicContact CG-CG 4.05Å; Q30-R32 VanDerWaalsContact CG-NE 3.27Å; R32-C50 CarbonylContact O-C 3.58Å; R32-C50 VanDerWaalsContact O-CA 3.27Å; R32-C50 WeakPolarHBondContact O-CA 3.38Å; R32-S51 PolarHBondContact N-O 3.02Å; R32-S51 PolarHBondContact O-N 2.92Å
33	Q	94.9	Very high	78.4	Confident	77 Å²	77	115 Å²	115	36%	0.36	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	137.7	173.3	-72.5	178.7	-114.5	0	0	109.7	N49 C50 Y115 C117	Q33-N49 WeakPolarHBondContact CA-O 3.45Å; Q33-C50 HydrophobicContact CG-CB 4.31Å; Q33-Y115 PolarHBondContact NE2-O 3.47Å; Q33-C117 HydrophobicContact CG-CB 4.01Å
34	S	82.9	Confident	80.9	Confident	82 Å²	82	111.2 Å²	111.2	57%	0.573	56%	0.562	S	S	*	*	S	Bend	trans	-77.6	-30.2	-170.9	59	0	0	0	0	114.3	N49	S34-N49 PolarHBondContact N-O 2.86Å
35	S	79.3	Confident	83.3	Confident	56 Å²	56	107.3 Å²	107.3	39%	0.392	55%	0.548	S	S	.	.			trans	-114.3	125.2	-169	-54.4	0	0	0	0	110.9
36	Q	81.9	Confident	85.9	Confident	209 Å²	209	99.7 Å²	99.7	98%	0.977	52%	0.516	S	S	*	.	S	Bend	trans	-76.5	-27.3	171.6	-66.2	-178.6	3.2	0	0	112.1
37	S	91.1	Very high	88.2	Confident	104 Å²	104	96.2 Å²	96.2	73%	0.727	50%	0.502	S	S	*	.			trans	-153.7	149.9	175.6	-178.5	0	0	0	0	109.6
38	L	94.2	Very high	90.4	Very high	82 Å²	82	91 Å²	91	43%	0.429	47%	0.474	S	S	.	.			trans	-142.1	128.1	179	178	67.5	0	0	0	108.7	V40 A46 L48	L38-V40 HydrophobicContact CD1-CG2 4.17Å; L38-V40 HydrophobicContact CD2-CG2 3.8Å; L38-V40 HydrophobicContact CG-CG2 3.68Å; L38-A46 HydrophobicContact CD2-CB 4.18Å; L38-L48 HydrophobicContact CD2-CD2 4.08Å
39	T	96.1	Very high	92.4	Very high	130 Å²	130	88.2 Å²	88.2	80%	0.798	46%	0.464	S	S	*	.			trans	-110.9	131.2	171.3	-56.1	0	0	0	0	108.5
40	V	96.4	Very high	93.8	Very high	43 Å²	43	83.2 Å²	83.2	26%	0.261	44%	0.441	S	S	.	.			trans	-134.4	142.9	-177.2	-175.2	0	0	0	0	108.3	L38 E44 A46	L38-V40 HydrophobicContact CD1-CG2 4.17Å; L38-V40 HydrophobicContact CD2-CG2 3.8Å; L38-V40 HydrophobicContact CG-CG2 3.68Å; V40-E44 HydrophobicContact CG1-CB 3.67Å; V40-A46 HydrophobicContact CB-CB 4.4Å; V40-A46 HydrophobicContact CG1-CB 4.35Å; V40-A46 HydrophobicContact CG2-CB 3.75Å
41	W	97.9	Very high	94.3	Very high	198 Å²	198	83 Å²	83	75%	0.75	45%	0.445	S	S	*	.			trans	-75.8	151.5	175.6	-63.9	106.7	0	0	0	111.4	G43 E44	W41-G43 PolarHBondContact O-N 2.79Å; W41-E44 HydrophobicContact CB-CG 4.02Å; W41-E44 WeakPolarHBondContact O-CB 3.17Å; W41-E44 PolarHBondContact O-N 2.92Å; W41-E44 VanDerWaalsContact O-N 3.08Å
42	E	98	Very high	94.4	Very high	151 Å²	151	81.3 Å²	81.3	71%	0.706	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	136.3	173.5	-171.5	174.8	-178	0	0	110.4	E44 S107	E42-E44 PolarHBondContact O-N 3.38Å; E42-S107 CarbonylContact C-O 3.56Å; E42-S107 VanDerWaalsContact CA-O 3.3Å; E42-S107 WeakPolarHBondContact CA-O 3.4Å; E42-S107 WeakPolarHBondContact CG-O 3.27Å
43	G	98	Very high	94.4	Very high	40 Å²	40	80 Å²	80	41%	0.412	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-16.5	-175.6	0	0	0	0	0	115.3	W41 S107	W41-G43 PolarHBondContact O-N 2.79Å; G43-S107 PolarHBondContact N-O 3.12Å
44	E	98.4	Very high	94.3	Very high	104 Å²	104	78.7 Å²	78.7	49%	0.486	43%	0.429	S	S	.	.	S	Bend	trans	-77.9	169.3	175.5	-68.8	-168.9	151.9	0	0	112.4	V40 W41 E42 S107	V40-E44 HydrophobicContact CG1-CB 3.67Å; W41-E44 HydrophobicContact CB-CG 4.02Å; W41-E44 WeakPolarHBondContact O-CB 3.17Å; W41-E44 PolarHBondContact O-N 2.92Å; W41-E44 VanDerWaalsContact O-N 3.08Å; E42-E44 PolarHBondContact O-N 3.38Å; E44-S107 VanDerWaalsContact O-CB 3.26Å; E44-S107 WeakPolarHBondContact O-CB 3.35Å; E44-S107 PolarHBondContact O-N 2.75Å; E44-S107 PolarHBondContact O-OG 2.74Å
45	T	98.5	Very high	94.8	Very high	67 Å²	67	78.4 Å²	78.4	41%	0.411	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-95.2	118.2	176.5	-60.1	0	0	0	0	110.8	I47 H103 I104 K105	T45-I47 HydrophobicContact CG2-CG1 4.12Å; T45-H103 HydrophobicContact CG2-CB 4.27Å; T45-I104 CarbonylContact C-O 3.59Å; T45-I104 VanDerWaalsContact CA-O 3.28Å; T45-I104 WeakPolarHBondContact CA-O 3.49Å; T45-K105 HydrophobicContact CG2-CG 4.46Å
46	A	97.8	Very high	95.5	Very high	10 Å²	10	79.3 Å²	79.3	8%	0.083	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	135.8	168.5	0	0	0	0	0	110.3	L38 V40 H103 I104 S107	L38-A46 HydrophobicContact CD2-CB 4.18Å; V40-A46 HydrophobicContact CB-CB 4.4Å; V40-A46 HydrophobicContact CG1-CB 4.35Å; V40-A46 HydrophobicContact CG2-CB 3.75Å; A46-H103 CarbonylContact O-C 3.57Å; A46-H103 WeakPolarHBondContact O-CA 3.4Å; A46-I104 HydrophobicContact CB-CB 4.13Å; A46-I104 HydrophobicContact CB-CG1 4.45Å; A46-I104 PolarHBondContact N-O 3.25Å; A46-I104 PolarHBondContact O-N 3.01Å; A46-S107 PolarHBondContact N-OG 2.74Å
47	I	97.9	Very high	96.1	Very high	72 Å²	72	70.2 Å²	70.2	37%	0.369	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.3	178.2	-57.2	177	0	0	0	109.1	T45	T45-I47 HydrophobicContact CG2-CG1 4.12Å
48	L	98	Very high	96.4	Very high	21 Å²	21	68.6 Å²	68.6	11%	0.11	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.5	177.9	-63.4	161.7	0	0	0	108.6	L38 W62 S101 L102 I104 Y115	L38-L48 HydrophobicContact CD2-CD2 4.08Å; L48-W62 HydrophobicContact CB-CH2 3.73Å; L48-W62 HydrophobicContact CB-CZ3 3.92Å; L48-W62 HydrophobicContact CD1-CZ3 4.35Å; L48-S101 CarbonylContact O-C 3.48Å; L48-S101 WeakPolarHBondContact O-CA 3.27Å; L48-L102 HydrophobicContact CB-CB 4.32Å; L48-L102 HydrophobicContact CD1-CD2 4.02Å; L48-L102 PolarHBondContact N-O 3.4Å; L48-L102 PolarHBondContact O-N 3.45Å; L48-I104 HydrophobicContact CD1-CD1 4.28Å; L48-Y115 HydrophobicContact CD1-CD1 3.98Å; L48-Y115 HydrophobicContact CD1-CD2 3.82Å; L48-Y115 HydrophobicContact CD1-CE2 4.49Å; L48-Y115 HydrophobicContact CD1-CG 3.52Å
49	N	97.3	Very high	96.5	Very high	77 Å²	77	68 Å²	68	41%	0.412	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	144.6	-178.1	-60.3	-65.1	0	0	0	111.6	Q33 S34 S101	Q33-N49 WeakPolarHBondContact CA-O 3.45Å; S34-N49 PolarHBondContact N-O 2.86Å; N49-S101 WeakPolarHBondContact OD1-CB 3.14Å
50	C	96.6	Very high	96.6	Very high	5 Å²	5	61.8 Å²	61.8	3%	0.034	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.7	178.8	179	0	0	0	0	109.7	V31 R32 Q33 W62 N99 L100 C117	V31-C50 WeakPolarHBondContact CG1-SG 3.47Å; R32-C50 CarbonylContact O-C 3.58Å; R32-C50 VanDerWaalsContact O-CA 3.27Å; R32-C50 WeakPolarHBondContact O-CA 3.38Å; Q33-C50 HydrophobicContact CG-CB 4.31Å; C50-W62 HydrophobicContact CB-CH2 3.99Å; C50-W62 HydrophobicContact CB-CZ2 3.72Å; C50-N99 CarbonylContact O-C 3.5Å; C50-N99 WeakPolarHBondContact O-CA 3.31Å; C50-L100 WeakPolarHBondContact CA-O 3.47Å; C50-L100 HydrophobicContact CB-CD2 3.66Å; C50-L100 HydrophobicContact CB-CG 3.9Å; C50-L100 PolarHBondContact N-O 2.93Å; C50-L100 PolarHBondContact O-N 3.01Å; C50-L100 VanDerWaalsContact SG-CD2 3.52Å; C50-C117 HydrophobicContact CB-CB 3.55Å; C50-C117 WeakPolarHBondContact CB-SG 3.06Å; C50-C117 WeakPolarHBondContact SG-CB 3.45Å; C50-C117 CovalentContact SG-SG 2.04Å; C50-C117 PolarHBondContact SG-SG 3.43Å
51	S	96.8	Very high	96.7	Very high	43 Å²	43	60 Å²	60	30%	0.301	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	156.2	170.6	66.4	0	0	0	0	110.5	V31 R32 K98 N99	V31-S51 CarbonylContact C-O 3.59Å; V31-S51 WeakPolarHBondContact CA-O 3.3Å; R32-S51 PolarHBondContact N-O 3.02Å; R32-S51 PolarHBondContact O-N 2.92Å; S51-K98 CarbonylContact C-O 3.59Å; S51-K98 VanDerWaalsContact CA-O 3.3Å; S51-K98 WeakPolarHBondContact CA-O 3.44Å; S51-N99 WeakPolarHBondContact CB-OD1 3.37Å
52	Y	95.4	Very high	96.7	Very high	8 Å²	8	50.5 Å²	50.5	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154	179.6	69.1	-84.4	0	0	0	111.5	Q30 N54 F57 F60 F93 K98 L100	Q30-Y52 CarbonylContact O-C 3.51Å; Q30-Y52 VanDerWaalsContact O-CA 3.28Å; Q30-Y52 WeakPolarHBondContact O-CA 3.38Å; Y52-N54 VanDerWaalsContact CD2-O 3.29Å; Y52-N54 WeakPolarHBondContact CD2-O 3.45Å; Y52-N54 WeakPolarHBondContact CE2-O 3.42Å; Y52-F57 HydrophobicContact CD2-CD2 4Å; Y52-F60 HydrophobicContact CD1-CD1 4.32Å; Y52-F60 AromaticContact CD1-CE1 3.54Å; Y52-F60 HydrophobicContact CD1-CE1 3.54Å; Y52-F60 HydrophobicContact CD1-CZ 4.24Å; Y52-F60 AromaticContact CD2-CE1 3.94Å; Y52-F60 HydrophobicContact CD2-CE1 3.94Å; Y52-F60 HydrophobicContact CD2-CZ 4.23Å; Y52-F60 HydrophobicContact CE1-CD1 4.49Å; Y52-F60 AromaticContact CE1-CE1 3.59Å; Y52-F60 HydrophobicContact CE1-CE1 3.59Å; Y52-F60 AromaticContact CE1-CZ 3.85Å; Y52-F60 HydrophobicContact CE1-CZ 3.85Å; Y52-F60 AromaticContact CE2-CE1 3.98Å; Y52-F60 HydrophobicContact CE2-CE1 3.98Å; Y52-F60 AromaticContact CE2-CZ 3.84Å; Y52-F60 HydrophobicContact CE2-CZ 3.84Å; Y52-F60 AromaticContact CG-CE1 3.72Å; Y52-F60 HydrophobicContact CG-CE1 3.72Å; Y52-F60 HydrophobicContact CG-CZ 4.42Å; Y52-F60 AromaticContact CZ-CE1 3.82Å; Y52-F60 AromaticContact CZ-CZ 3.65Å; Y52-F93 AromaticContact CE1-CE2 3.67Å; Y52-F93 HydrophobicContact CE1-CE2 3.67Å; Y52-F93 HydrophobicContact CE1-CZ 4.17Å; Y52-F93 WeakPolarHBondContact OH-CZ 3.32Å; Y52-K98 VanDerWaalsContact CD1-C 3.5Å; Y52-K98 HydrophobicContact CD1-CB 4.05Å; Y52-K98 WeakPolarHBondContact CD1-O 3.43Å; Y52-K98 HydrophobicContact CD2-CB 4.28Å; Y52-K98 HydrophobicContact CE1-CB 3.79Å; Y52-K98 WeakPolarHBondContact CE1-O 3.36Å; Y52-K98 HydrophobicContact CE2-CB 4.04Å; Y52-K98 HydrophobicContact CE2-CD 4.47Å; Y52-K98 HydrophobicContact CE2-CG 4.17Å; Y52-K98 HydrophobicContact CG-CB 4.28Å; Y52-K98 PolarHBondContact N-O 2.65Å; Y52-K98 WeakPolarHBondContact O-CB 3.4Å; Y52-K98 WeakPolarHBondContact O-CD 3.43Å; Y52-L100 HydrophobicContact CD1-CD2 4.19Å
53	E	94.8	Very high	96.8	Very high	101 Å²	101	46.9 Å²	46.9	47%	0.472	27%	0.266	S	S	.	.			trans	-101.6	-37.8	-176.7	-71.6	177.7	-160.2	0	0	113.4	Q30 S55 K98	Q30-E53 HydrophobicContact CB-CB 4.38Å; Q30-E53 VanDerWaalsContact CB-CD 3.47Å; Q30-E53 HydrophobicContact CB-CG 4.04Å; Q30-E53 WeakPolarHBondContact CB-OE1 3.29Å; Q30-E53 PolarHBondContact NE2-OE1 2.93Å; Q30-E53 PolarHBondContact O-N 2.85Å; E53-S55 PolarHBondContact O-N 2.95Å; E53-K98 PolarHBondContact O-NZ 2.76Å
54	N	93.9	Very high	96.8	Very high	50 Å²	50	46.3 Å²	46.3	27%	0.267	25%	0.252	S	S	.	.			trans	-81.3	115.5	-176.1	-165.7	-11.4	0	0	0	112.4	Q29 Y52 A56 F57	Q29-N54 HydrophobicContact CB-CB 4.12Å; Q29-N54 VanDerWaalsContact CD-ND2 3.27Å; Q29-N54 HydrophobicContact CG-CB 3.82Å; Q29-N54 PolarHBondContact NE2-ND2 2.91Å; Y52-N54 VanDerWaalsContact CD2-O 3.29Å; Y52-N54 WeakPolarHBondContact CD2-O 3.45Å; Y52-N54 WeakPolarHBondContact CE2-O 3.42Å; N54-A56 PolarHBondContact O-N 2.94Å; N54-A56 VanDerWaalsContact OD1-CB 3.27Å; N54-A56 WeakPolarHBondContact OD1-CB 3.48Å; N54-A56 PolarHBondContact OD1-N 3.46Å; N54-F57 HydrophobicContact CB-CD2 3.78Å; N54-F57 HydrophobicContact CB-CE2 3.71Å; N54-F57 HydrophobicContact CB-CG 4.23Å; N54-F57 HydrophobicContact CB-CZ 4.13Å; N54-F57 WeakPolarHBondContact O-CD2 3.28Å; N54-F57 PolarHBondContact O-N 2.69Å
55	S	91.9	Very high	96.8	Very high	76 Å²	76	44 Å²	44	53%	0.531	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.5	175	-55.6	0	0	0	0	114.5	E53 F57 K98	E53-S55 PolarHBondContact O-N 2.95Å; S55-F57 VanDerWaalsContact C-N 3.31Å; S55-K98 WeakPolarHBondContact OG-CE 3.32Å; S55-K98 PolarHBondContact OG-NZ 3.42Å; S55-K98 VanDerWaalsContact OG-NZ 3.12Å
56	A	93.8	Very high	96.8	Very high	74 Å²	74	44.1 Å²	44.1	61%	0.612	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-19	177	0	0	0	0	0	113.2	N54 D58	N54-A56 PolarHBondContact O-N 2.94Å; N54-A56 VanDerWaalsContact OD1-CB 3.27Å; N54-A56 WeakPolarHBondContact OD1-CB 3.48Å; N54-A56 PolarHBondContact OD1-N 3.46Å; A56-D58 PolarHBondContact O-N 3.06Å
57	F	95.1	Very high	96.7	Very high	18 Å²	18	49.4 Å²	49.4	8%	0.079	27%	0.27	C	S	.	.			trans	-63	131.3	176.7	-64.9	-37.5	0	0	0	111.2	Q29 Y52 N54 S55 F60 A119 S120	Q29-F57 HydrophobicContact CB-CE1 4.44Å; Q29-F57 HydrophobicContact CB-CE2 3.91Å; Q29-F57 HydrophobicContact CB-CZ 3.48Å; Q29-F57 VanDerWaalsContact CB-CZ 3.48Å; Q29-F57 HydrophobicContact CG-CZ 4.16Å; Y52-F57 HydrophobicContact CD2-CD2 4Å; N54-F57 HydrophobicContact CB-CD2 3.78Å; N54-F57 HydrophobicContact CB-CE2 3.71Å; N54-F57 HydrophobicContact CB-CG 4.23Å; N54-F57 HydrophobicContact CB-CZ 4.13Å; N54-F57 WeakPolarHBondContact O-CD2 3.28Å; N54-F57 PolarHBondContact O-N 2.69Å; S55-F57 VanDerWaalsContact C-N 3.31Å; F57-F60 HydrophobicContact CB-CE1 4.05Å; F57-F60 HydrophobicContact CB-CZ 3.71Å; F57-A119 HydrophobicContact CB-CB 4.02Å; F57-A119 HydrophobicContact CD1-CB 4.39Å; F57-A119 HydrophobicContact CD2-CB 3.4Å; F57-A119 HydrophobicContact CE2-CB 3.77Å; F57-A119 HydrophobicContact CG-CB 3.73Å; F57-A119 HydrophobicContact CZ-CB 4.35Å; F57-S120 CarbonylContact C-O 3.58Å; F57-S120 WeakPolarHBondContact CA-O 3.15Å; F57-S120 VanDerWaalsContact CD1-C 3.43Å; F57-S120 WeakPolarHBondContact CD1-OXT 3.25Å
58	D	96.5	Very high	96.7	Very high	70 Å²	70	50.3 Å²	50.3	37%	0.374	30%	0.297	S	S	.	.			trans	-123.2	-11.3	-176.4	90.3	-28.5	0	0	0	113.6	A56 R78 S79 S120	A56-D58 PolarHBondContact O-N 3.06Å; D58-R78 CarbonylContact O-C 3.55Å; D58-R78 WeakPolarHBondContact O-CA 3.3Å; D58-R78 IonicContact OD1-NH1 2.77Å; D58-R78 IonicContact OD2-NH1 3.02Å; D58-R78 PolarHBondContact OD2-NH1 2.97Å; D58-S79 PolarHBondContact O-N 3.04Å; D58-S120 PolarHBondContact N-O 3.34Å
59	Y	97.7	Very high	96.6	Very high	70 Å²	70	54.9 Å²	54.9	28%	0.275	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.6	-179.1	-178.3	-112.8	0	0	0	111.3	P61 A76 R78 A119 S120	Y59-P61 HydrophobicContact CD1-CG 4.08Å; Y59-P61 HydrophobicContact CE1-CB 3.91Å; Y59-P61 HydrophobicContact CE1-CG 3.7Å; Y59-A76 HydrophobicContact CD2-CB 4.43Å; Y59-A76 HydrophobicContact CE1-CB 4.48Å; Y59-A76 HydrophobicContact CE2-CB 3.45Å; Y59-A76 VanDerWaalsContact CE2-CB 3.45Å; Y59-A76 VanDerWaalsContact CZ-CB 3.48Å; Y59-A76 WeakPolarHBondContact OH-CB 3.01Å; Y59-R78 HydrophobicContact CD2-CG 4.17Å; Y59-A119 WeakPolarHBondContact O-CA 3.26Å; Y59-S120 PolarHBondContact N-O 2.66Å; Y59-S120 PolarHBondContact O-N 2.92Å
60	F	98.1	Very high	96.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	86.5	-171.8	-59.2	-93.1	0	0	0	111	Y52 F57 A76 I77 F93 L100 A118 A119	Y52-F60 HydrophobicContact CD1-CD1 4.32Å; Y52-F60 AromaticContact CD1-CE1 3.54Å; Y52-F60 HydrophobicContact CD1-CE1 3.54Å; Y52-F60 HydrophobicContact CD1-CZ 4.24Å; Y52-F60 AromaticContact CD2-CE1 3.94Å; Y52-F60 HydrophobicContact CD2-CE1 3.94Å; Y52-F60 HydrophobicContact CD2-CZ 4.23Å; Y52-F60 HydrophobicContact CE1-CD1 4.49Å; Y52-F60 AromaticContact CE1-CE1 3.59Å; Y52-F60 HydrophobicContact CE1-CE1 3.59Å; Y52-F60 AromaticContact CE1-CZ 3.85Å; Y52-F60 HydrophobicContact CE1-CZ 3.85Å; Y52-F60 AromaticContact CE2-CE1 3.98Å; Y52-F60 HydrophobicContact CE2-CE1 3.98Å; Y52-F60 AromaticContact CE2-CZ 3.84Å; Y52-F60 HydrophobicContact CE2-CZ 3.84Å; Y52-F60 AromaticContact CG-CE1 3.72Å; Y52-F60 HydrophobicContact CG-CE1 3.72Å; Y52-F60 HydrophobicContact CG-CZ 4.42Å; Y52-F60 AromaticContact CZ-CE1 3.82Å; Y52-F60 AromaticContact CZ-CZ 3.65Å; F57-F60 HydrophobicContact CB-CE1 4.05Å; F57-F60 HydrophobicContact CB-CZ 3.71Å; F60-A76 WeakPolarHBondContact O-CA 3.27Å; F60-I77 HydrophobicContact CB-CG2 3.97Å; F60-I77 PolarHBondContact N-O 2.97Å; F60-I77 PolarHBondContact O-N 3.21Å; F60-I77 VanDerWaalsContact O-N 3.16Å; F60-F93 HydrophobicContact CD1-CE2 4.15Å; F60-F93 HydrophobicContact CD2-CD2 4.2Å; F60-F93 AromaticContact CD2-CE2 3.65Å; F60-F93 HydrophobicContact CD2-CE2 3.65Å; F60-F93 HydrophobicContact CD2-CZ 4.15Å; F60-F93 AromaticContact CE1-CE2 3.93Å; F60-F93 HydrophobicContact CE1-CE2 3.93Å; F60-F93 HydrophobicContact CE2-CD2 4.39Å; F60-F93 AromaticContact CE2-CE2 3.43Å; F60-F93 HydrophobicContact CE2-CE2 3.43Å; F60-F93 VanDerWaalsContact CE2-CE2 3.43Å; F60-F93 AromaticContact CE2-CZ 3.59Å; F60-F93 HydrophobicContact CE2-CZ 3.59Å; F60-F93 HydrophobicContact CG-CD2 4.39Å; F60-F93 HydrophobicContact CG-CE2 4.02Å; F60-F93 AromaticContact CZ-CE2 3.57Å; F60-F93 HydrophobicContact CZ-CE2 3.57Å; F60-F93 AromaticContact CZ-CZ 3.85Å; F60-F93 HydrophobicContact CZ-CZ 3.85Å; F60-L100 HydrophobicContact CB-CD1 3.66Å; F60-L100 HydrophobicContact CD1-CD1 4.18Å; F60-L100 HydrophobicContact CD1-CD2 4.25Å; F60-L100 HydrophobicContact CG-CD1 4.21Å; F60-A118 WeakPolarHBondContact CA-O 3.46Å; F60-A119 HydrophobicContact CD1-CB 3.68Å; F60-A119 HydrophobicContact CE1-CB 3.63Å
61	P	98.4	Very high	96.7	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	143.2	175.5	31.1	-32.4	0	0	0	112.4	Y59 Y63 L73 A76 A118	Y59-P61 HydrophobicContact CD1-CG 4.08Å; Y59-P61 HydrophobicContact CE1-CB 3.91Å; Y59-P61 HydrophobicContact CE1-CG 3.7Å; P61-Y63 HydrophobicContact CB-CD2 4.49Å; P61-Y63 HydrophobicContact CB-CE2 3.8Å; P61-Y63 HydrophobicContact CG-CE2 3.72Å; P61-L73 HydrophobicContact CB-CD1 3.62Å; P61-A76 HydrophobicContact CB-CB 3.98Å; P61-A118 WeakPolarHBondContact CD-O 3.48Å; P61-A118 HydrophobicContact CG-CB 4.11Å; P61-A118 PolarHBondContact O-N 3.43Å
62	W	98.6	Very high	96.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.7	162.9	-78.4	87.7	0	0	0	109.7	L48 C50 L74 I75 L102 F116 C117	L48-W62 HydrophobicContact CB-CH2 3.73Å; L48-W62 HydrophobicContact CB-CZ3 3.92Å; L48-W62 HydrophobicContact CD1-CZ3 4.35Å; C50-W62 HydrophobicContact CB-CH2 3.99Å; C50-W62 HydrophobicContact CB-CZ2 3.72Å; W62-L74 WeakPolarHBondContact O-CB 3.31Å; W62-L74 PolarHBondContact O-N 2.78Å; W62-I75 HydrophobicContact CB-CG2 4.17Å; W62-I75 PolarHBondContact N-O 2.89Å; W62-I75 PolarHBondContact O-N 2.89Å; W62-L102 HydrophobicContact CB-CD2 4.2Å; W62-L102 HydrophobicContact CD2-CB 3.66Å; W62-L102 HydrophobicContact CD2-CD2 3.88Å; W62-L102 HydrophobicContact CD2-CG 4.35Å; W62-L102 HydrophobicContact CE3-CB 4.03Å; W62-L102 HydrophobicContact CE3-CD2 3.8Å; W62-L102 HydrophobicContact CG-CB 4.12Å; W62-L102 HydrophobicContact CG-CD2 4.07Å; W62-L102 HydrophobicContact CH2-CB 4.15Å; W62-L102 HydrophobicContact CZ2-CB 3.81Å; W62-L102 HydrophobicContact CZ3-CB 4.26Å; W62-L102 HydrophobicContact CZ3-CD2 4.45Å; W62-F116 CarbonylContact C-O 3.56Å; W62-F116 WeakPolarHBondContact CA-O 3.3Å; W62-C117 HydrophobicContact CD2-CB 4.27Å; W62-C117 HydrophobicContact CE3-CB 4.16Å; W62-C117 HydrophobicContact CH2-CB 3.81Å; W62-C117 HydrophobicContact CZ2-CB 3.9Å; W62-C117 HydrophobicContact CZ3-CB 3.94Å
63	Y	98.5	Very high	97	Very high	75 Å²	75	61.8 Å²	61.8	29%	0.294	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	148.7	174.9	-61.5	-94.8	0	0	0	110.6	P61 P71 A72 L73 Y115 F116 A118	P61-Y63 HydrophobicContact CB-CD2 4.49Å; P61-Y63 HydrophobicContact CB-CE2 3.8Å; P61-Y63 HydrophobicContact CG-CE2 3.72Å; Y63-P71 HydrophobicContact CD1-CB 4.35Å; Y63-P71 HydrophobicContact CG-CB 4.41Å; Y63-A72 CarbonylContact C-O 3.51Å; Y63-A72 WeakPolarHBondContact CA-O 3.36Å; Y63-A72 WeakPolarHBondContact CB-O 3.41Å; Y63-L73 HydrophobicContact CD1-CB 4.3Å; Y63-L73 HydrophobicContact CE1-CB 4.1Å; Y63-L73 HydrophobicContact CE1-CD1 4.22Å; Y63-Y115 CarbonylContact O-C 3.58Å; Y63-Y115 VanDerWaalsContact O-CA 3.31Å; Y63-Y115 WeakPolarHBondContact O-CA 3.38Å; Y63-F116 PolarHBondContact N-O 3.38Å; Y63-F116 PolarHBondContact O-N 3.38Å; Y63-A118 HydrophobicContact CE2-CB 4.19Å
64	Q	98.2	Very high	97.1	Very high	28 Å²	28	58.5 Å²	58.5	13%	0.131	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.6	171.1	-173.9	-176.6	47.8	0	0	108.7	F66 A72 L74 A113 T114 Y115	Q64-F66 HydrophobicContact CG-CE2 4.5Å; Q64-F66 HydrophobicContact CG-CZ 4.36Å; Q64-A72 PolarHBondContact N-O 2.8Å; Q64-A72 PolarHBondContact O-N 2.98Å; Q64-L74 HydrophobicContact CB-CB 4.34Å; Q64-A113 HydrophobicContact CG-CB 3.6Å; Q64-T114 CarbonylContact C-O 3.59Å; Q64-Y115 HydrophobicContact CB-CD1 4.3Å; Q64-Y115 HydrophobicContact CB-CE1 4.15Å; Q64-Y115 HydrophobicContact CG-CD1 4.32Å; Q64-Y115 HydrophobicContact CG-CE1 3.83Å; Q64-Y115 PolarHBondContact NE2-OH 3.33Å
65	Q	98.4	Very high	97.4	Very high	55 Å²	55	56.5 Å²	56.5	26%	0.257	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	114.2	176.4	-176.4	-177.8	29.5	0	0	110	E69 A113 T114 F116	Q65-E69 WeakPolarHBondContact CG-O 3.47Å; Q65-E69 PolarHBondContact NE2-O 2.84Å; Q65-A113 WeakPolarHBondContact O-CB 3.41Å; Q65-T114 PolarHBondContact N-O 3.08Å; Q65-T114 PolarHBondContact O-N 3.42Å; Q65-F116 HydrophobicContact CB-CD2 4.44Å; Q65-F116 HydrophobicContact CB-CE2 3.76Å
66	F	98	Very high	97.7	Very high	70 Å²	70	54 Å²	54	31%	0.307	33%	0.333	S	S	.	.			trans	-77.5	155.3	169.3	-67.5	-64.2	0	0	0	111.6	Q64 G68 E69 G110 A113	Q64-F66 HydrophobicContact CG-CE2 4.5Å; Q64-F66 HydrophobicContact CG-CZ 4.36Å; F66-G68 PolarHBondContact O-N 3.16Å; F66-E69 HydrophobicContact CB-CB 4.42Å; F66-E69 HydrophobicContact CB-CG 4.31Å; F66-E69 PolarHBondContact O-N 2.79Å; F66-G110 VanDerWaalsContact CE1-O 3.28Å; F66-G110 WeakPolarHBondContact CE1-O 3.21Å; F66-A113 HydrophobicContact CD1-CB 3.89Å; F66-A113 HydrophobicContact CE1-CB 3.93Å
67	P	96.6	Very high	97.9	Very high	120 Å²	120	50.7 Å²	50.7	78%	0.779	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	124.2	175.6	-25.5	35	0	0	0	112.1	E69	P67-E69 VanDerWaalsContact C-N 3.34Å
68	G	97.4	Very high	98	Very high	91 Å²	91	56.4 Å²	56.4	94%	0.938	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-2.5	179.7	0	0	0	0	0	115.3	F66	F66-G68 PolarHBondContact O-N 3.16Å
69	E	97.6	Very high	98	Very high	117 Å²	117	54 Å²	54	55%	0.547	31%	0.314	S	S	.	.	S	Bend	trans	-107.1	169.5	178.2	-63	-173.7	-170.3	0	0	112.5	Q65 F66 P67	Q65-E69 WeakPolarHBondContact CG-O 3.47Å; Q65-E69 PolarHBondContact NE2-O 2.84Å; F66-E69 HydrophobicContact CB-CB 4.42Å; F66-E69 HydrophobicContact CB-CG 4.31Å; F66-E69 PolarHBondContact O-N 2.79Å; P67-E69 VanDerWaalsContact C-N 3.34Å
70	G	97.7	Very high	98	Very high	49 Å²	49	56.8 Å²	56.8	51%	0.505	34%	0.338	S	S	.	.			trans	-84.9	160.5	168.8	0	0	0	0	0	112	A72	G70-A72 PolarHBondContact O-N 2.91Å
71	P	98	Very high	98	Very high	76 Å²	76	59.3 Å²	59.3	49%	0.494	36%	0.356	S	S	.	.			trans	-60.7	125.6	173.3	-21.7	33.1	0	0	0	111.8	Y63 F116	Y63-P71 HydrophobicContact CD1-CB 4.35Å; Y63-P71 HydrophobicContact CG-CB 4.41Å; P71-F116 HydrophobicContact CB-CD2 4.41Å; P71-F116 HydrophobicContact CG-CD2 4.43Å; P71-F116 HydrophobicContact CG-CE2 4.26Å
72	A	98.4	Very high	98	Very high	54 Å²	54	64.9 Å²	64.9	45%	0.446	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.4	175.3	0	0	0	0	0	110.4	Y63 Q64 G70 L74	Y63-A72 CarbonylContact C-O 3.51Å; Y63-A72 WeakPolarHBondContact CA-O 3.36Å; Y63-A72 WeakPolarHBondContact CB-O 3.41Å; Q64-A72 PolarHBondContact N-O 2.8Å; Q64-A72 PolarHBondContact O-N 2.98Å; G70-A72 PolarHBondContact O-N 2.91Å; A72-L74 PolarHBondContact O-N 2.85Å
73	L	98.5	Very high	98	Very high	100 Å²	100	69 Å²	69	52%	0.524	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	123.3	177.7	178.6	67.3	0	0	0	109.3	P61 Y63 A76	P61-L73 HydrophobicContact CB-CD1 3.62Å; Y63-L73 HydrophobicContact CD1-CB 4.3Å; Y63-L73 HydrophobicContact CE1-CB 4.1Å; Y63-L73 HydrophobicContact CE1-CD1 4.22Å; L73-A76 HydrophobicContact CD1-CB 4.42Å
74	L	98.4	Very high	98	Very high	31 Å²	31	70.3 Å²	70.3	16%	0.162	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-59	177.7	-178.4	67	0	0	0	110.8	W62 Q64 A72 F89 L102 Y115	W62-L74 WeakPolarHBondContact O-CB 3.31Å; W62-L74 PolarHBondContact O-N 2.78Å; Q64-L74 HydrophobicContact CB-CB 4.34Å; A72-L74 PolarHBondContact O-N 2.85Å; L74-F89 HydrophobicContact CD1-CD1 4.28Å; L74-F89 HydrophobicContact CD1-CD2 4.14Å; L74-F89 HydrophobicContact CD1-CE1 3.99Å; L74-F89 HydrophobicContact CD1-CE2 3.84Å; L74-F89 HydrophobicContact CD1-CG 4.36Å; L74-F89 HydrophobicContact CD1-CZ 3.77Å; L74-F89 HydrophobicContact CD2-CD1 3.81Å; L74-F89 HydrophobicContact CD2-CE1 3.91Å; L74-F89 HydrophobicContact CD2-CG 4.36Å; L74-F89 HydrophobicContact CG-CD1 4.28Å; L74-F89 HydrophobicContact CG-CE1 4.4Å; L74-F89 HydrophobicContact CG-CG 4.39Å; L74-L102 HydrophobicContact CD2-CD2 3.72Å; L74-Y115 HydrophobicContact CD2-CD1 4.08Å; L74-Y115 HydrophobicContact CD2-CE1 3.85Å
75	I	98.7	Very high	98	Very high	8 Å²	8	73.5 Å²	73.5	4%	0.041	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	151.3	-177.1	-173.4	171.3	0	0	0	109.2	W62 K84 D86 F89 I91 L102	W62-I75 HydrophobicContact CB-CG2 4.17Å; W62-I75 PolarHBondContact N-O 2.89Å; W62-I75 PolarHBondContact O-N 2.89Å; I75-K84 HydrophobicContact CD1-CG 3.93Å; I75-K84 HydrophobicContact CG1-CG 4.05Å; I75-D86 HydrophobicContact CD1-CB 3.71Å; I75-D86 HydrophobicContact CG1-CB 4.39Å; I75-F89 HydrophobicContact CD1-CB 4.23Å; I75-F89 HydrophobicContact CG2-CB 4.4Å; I75-I91 HydrophobicContact CB-CD1 4.29Å; I75-I91 HydrophobicContact CD1-CD1 4.43Å; I75-I91 HydrophobicContact CD1-CG1 4.29Å; I75-I91 HydrophobicContact CG1-CD1 3.92Å; I75-I91 HydrophobicContact CG1-CG1 4.29Å; I75-I91 HydrophobicContact CG2-CD1 3.82Å; I75-I91 HydrophobicContact CG2-CG1 3.83Å; I75-L102 HydrophobicContact CG2-CD1 3.85Å
76	A	98.4	Very high	98	Very high	24 Å²	24	75.5 Å²	75.5	20%	0.198	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	151.1	177.7	0	0	0	0	0	112.6	Y59 F60 P61 L73	Y59-A76 HydrophobicContact CD2-CB 4.43Å; Y59-A76 HydrophobicContact CE1-CB 4.48Å; Y59-A76 HydrophobicContact CE2-CB 3.45Å; Y59-A76 VanDerWaalsContact CE2-CB 3.45Å; Y59-A76 VanDerWaalsContact CZ-CB 3.48Å; Y59-A76 WeakPolarHBondContact OH-CB 3.01Å; F60-A76 WeakPolarHBondContact O-CA 3.27Å; P61-A76 HydrophobicContact CB-CB 3.98Å; L73-A76 HydrophobicContact CD1-CB 4.42Å
77	I	98.6	Very high	98	Very high	5 Å²	5	75.9 Å²	75.9	3%	0.026	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	150.6	176.2	-165.1	169.7	0	0	0	110.6	F60 S81 K83 K84 I91 F93	F60-I77 HydrophobicContact CB-CG2 3.97Å; F60-I77 PolarHBondContact N-O 2.97Å; F60-I77 PolarHBondContact O-N 3.21Å; F60-I77 VanDerWaalsContact O-N 3.16Å; I77-S81 WeakPolarHBondContact CD1-O 3.3Å; I77-K83 VanDerWaalsContact CD1-C 3.47Å; I77-K84 HydrophobicContact CB-CB 4.09Å; I77-K84 HydrophobicContact CD1-CB 3.88Å; I77-K84 HydrophobicContact CG1-CB 3.97Å; I77-I91 HydrophobicContact CB-CB 4.45Å; I77-I91 HydrophobicContact CB-CD1 3.96Å; I77-I91 HydrophobicContact CB-CG2 4.29Å; I77-I91 HydrophobicContact CD1-CG2 4.45Å; I77-I91 HydrophobicContact CG2-CB 4.33Å; I77-I91 HydrophobicContact CG2-CD1 4Å; I77-I91 HydrophobicContact CG2-CG2 3.66Å; I77-F93 HydrophobicContact CD1-CB 3.95Å; I77-F93 HydrophobicContact CG2-CB 4.33Å
78	R	98.1	Very high	98	Very high	138 Å²	138	72.8 Å²	72.8	52%	0.521	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	151.6	169.7	-73.8	-174.2	173.5	-91.2	-0.4	110.8	D58 Y59 V80 S81	D58-R78 CarbonylContact O-C 3.55Å; D58-R78 WeakPolarHBondContact O-CA 3.3Å; D58-R78 IonicContact OD1-NH1 2.77Å; D58-R78 IonicContact OD2-NH1 3.02Å; D58-R78 PolarHBondContact OD2-NH1 2.97Å; Y59-R78 HydrophobicContact CD2-CG 4.17Å; R78-V80 HydrophobicContact CB-CG2 4Å; R78-V80 PolarHBondContact O-N 2.84Å; R78-S81 PolarHBondContact O-N 2.87Å
79	S	95.9	Very high	98.1	Very high	18 Å²	18	70 Å²	70	13%	0.126	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-7.7	-176.3	78.2	0	0	0	0	115.9	D58 S81 K95	D58-S79 PolarHBondContact O-N 3.04Å; S79-S81 VanDerWaalsContact C-N 3.32Å; S79-K95 PolarHBondContact OG-NZ 3.39Å
80	V	96.7	Very high	98.2	Very high	129 Å²	129	64.5 Å²	64.5	78%	0.782	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.3	174.2	-61.9	0	0	0	0	113	R78	R78-V80 HydrophobicContact CB-CG2 4Å; R78-V80 PolarHBondContact O-N 2.84Å
81	S	98.1	Very high	98.2	Very high	54 Å²	54	62.2 Å²	62.2	38%	0.378	35%	0.347	S	S	.	.			trans	-117.9	144.2	178.6	-57.7	0	0	0	0	109.8	I77 R78 S79 F93	I77-S81 WeakPolarHBondContact CD1-O 3.3Å; R78-S81 PolarHBondContact O-N 2.87Å; S79-S81 VanDerWaalsContact C-N 3.32Å; S81-F93 VanDerWaalsContact O-CD1 3.3Å; S81-F93 WeakPolarHBondContact O-CD1 3.33Å
82	D	98.3	Very high	98.2	Very high	121 Å²	121	62.3 Å²	62.3	65%	0.647	34%	0.34	S	S	*	.	S	Bend	trans	-94.8	-17.1	176.5	60.9	-20.6	0	0	0	112.6	F93	D82-F93 PolarHBondContact O-N 2.04Å
83	K	98.5	Very high	98.2	Very high	86 Å²	86	60.4 Å²	60.4	37%	0.374	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	142.3	-178.5	-170	-174.3	-179.9	-153.7	0	112.3	I77 E85 T90 I91 F92	I77-K83 VanDerWaalsContact CD1-C 3.47Å; K83-E85 WeakPolarHBondContact CE-OE1 3.41Å; K83-E85 IonicContact NZ-OE1 3.97Å; K83-E85 PolarHBondContact NZ-OE1 2.95Å; K83-E85 IonicContact NZ-OE2 3.21Å; K83-E85 PolarHBondContact NZ-OE2 2.91Å; K83-T90 HydrophobicContact CG-CG2 4.08Å; K83-I91 VanDerWaalsContact CA-O 3.3Å; K83-I91 WeakPolarHBondContact CA-O 3.37Å; K83-F92 HydrophobicContact CD-CE1 4.06Å; K83-F92 HydrophobicContact CG-CD1 4.26Å; K83-F92 HydrophobicContact CG-CE1 4.12Å
84	K	98.6	Very high	98.2	Very high	102 Å²	102	58.3 Å²	58.3	44%	0.443	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	130.2	169.1	177.7	67.9	179.2	178.2	0	109.6	I75 I77 T90 I91	I75-K84 HydrophobicContact CD1-CG 3.93Å; I75-K84 HydrophobicContact CG1-CG 4.05Å; I77-K84 HydrophobicContact CB-CB 4.09Å; I77-K84 HydrophobicContact CD1-CB 3.88Å; I77-K84 HydrophobicContact CG1-CB 3.97Å; K84-T90 CarbonylContact O-C 3.51Å; K84-T90 VanDerWaalsContact O-CA 3.3Å; K84-T90 WeakPolarHBondContact O-CA 3.3Å; K84-I91 HydrophobicContact CB-CB 4.46Å; K84-I91 PolarHBondContact N-O 2.94Å; K84-I91 PolarHBondContact O-N 3.44Å
85	E	98.6	Very high	98	Very high	96 Å²	96	62.2 Å²	62.2	45%	0.449	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	140.8	177.1	-69.9	180	144.3	0	0	110.4	K83 F89 T90 K105	K83-E85 WeakPolarHBondContact CE-OE1 3.41Å; K83-E85 IonicContact NZ-OE1 3.97Å; K83-E85 PolarHBondContact NZ-OE1 2.95Å; K83-E85 IonicContact NZ-OE2 3.21Å; K83-E85 PolarHBondContact NZ-OE2 2.91Å; E85-F89 WeakPolarHBondContact CA-O 3.49Å; E85-T90 HydrophobicContact CG-CG2 3.65Å; E85-K105 IonicContact OE1-NZ 3.34Å
86	D	98.1	Very high	97.9	Very high	97 Å²	97	73 Å²	73	52%	0.519	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	106.5	168.2	-169.8	2.4	0	0	0	109.4	I75 R88 F89	I75-D86 HydrophobicContact CD1-CB 3.71Å; I75-D86 HydrophobicContact CG1-CB 4.39Å; D86-R88 PolarHBondContact O-N 2.93Å; D86-R88 VanDerWaalsContact O-N 3.14Å; D86-F89 PolarHBondContact N-O 2.85Å; D86-F89 WeakPolarHBondContact O-CB 2.97Å; D86-F89 PolarHBondContact O-N 2.86Å
87	G	97.9	Very high	97.8	Very high	77 Å²	77	77.6 Å²	77.6	79%	0.794	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	-118.3	-173.7	0	0	0	0	0	112.6	F89	G87-F89 VanDerWaalsContact C-N 3.35Å
88	R	98.3	Very high	97.6	Very high	55 Å²	55	80.6 Å²	80.6	21%	0.208	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.3	178.8	-63.7	-169.4	-59.9	106.5	-0.5	113.7	D86 K105 D106 D111	D86-R88 PolarHBondContact O-N 2.93Å; D86-R88 VanDerWaalsContact O-N 3.14Å; R88-K105 WeakPolarHBondContact CB-O 3.45Å; R88-K105 WeakPolarHBondContact CD-O 3.18Å; R88-K105 PolarHBondContact NH1-O 2.8Å; R88-K105 PolarHBondContact O-N 2.9Å; R88-D106 PolarHBondContact NH1-O 2.7Å; R88-D111 IonicContact CZ-OD1 3.06Å; R88-D111 IonicContact CZ-OD2 3.73Å; R88-D111 IonicContact NH1-OD1 2.66Å; R88-D111 IonicContact NH1-OD2 3.8Å; R88-D111 PolarHBondContact NH1-OD2 2.96Å; R88-D111 VanDerWaalsContact NH2-CG 3.28Å; R88-D111 IonicContact NH2-OD1 3.91Å; R88-D111 PolarHBondContact NH2-OD1 2.77Å; R88-D111 IonicContact NH2-OD2 2.74Å; R88-D111 PolarHBondContact NH2-OD2 3.23Å
89	F	98.7	Very high	97.6	Very high	34 Å²	34	77 Å²	77	15%	0.149	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.9	-176.4	-54.3	-74.2	0	0	0	110.8	L74 I75 E85 D86 G87 L102 H103 I104	L74-F89 HydrophobicContact CD1-CD1 4.28Å; L74-F89 HydrophobicContact CD1-CD2 4.14Å; L74-F89 HydrophobicContact CD1-CE1 3.99Å; L74-F89 HydrophobicContact CD1-CE2 3.84Å; L74-F89 HydrophobicContact CD1-CG 4.36Å; L74-F89 HydrophobicContact CD1-CZ 3.77Å; L74-F89 HydrophobicContact CD2-CD1 3.81Å; L74-F89 HydrophobicContact CD2-CE1 3.91Å; L74-F89 HydrophobicContact CD2-CG 4.36Å; L74-F89 HydrophobicContact CG-CD1 4.28Å; L74-F89 HydrophobicContact CG-CE1 4.4Å; L74-F89 HydrophobicContact CG-CG 4.39Å; I75-F89 HydrophobicContact CD1-CB 4.23Å; I75-F89 HydrophobicContact CG2-CB 4.4Å; E85-F89 WeakPolarHBondContact CA-O 3.49Å; D86-F89 PolarHBondContact N-O 2.85Å; D86-F89 WeakPolarHBondContact O-CB 2.97Å; D86-F89 PolarHBondContact O-N 2.86Å; G87-F89 VanDerWaalsContact C-N 3.35Å; F89-L102 HydrophobicContact CB-CD1 4.22Å; F89-L102 HydrophobicContact CD1-CD1 4.43Å; F89-H103 CarbonylContact C-O 3.46Å; F89-H103 WeakPolarHBondContact CA-O 3Å; F89-I104 HydrophobicContact CD1-CB 4.4Å; F89-I104 HydrophobicContact CD1-CD1 4.46Å; F89-I104 HydrophobicContact CD1-CG1 3.95Å; F89-I104 HydrophobicContact CD1-CG2 4.04Å; F89-I104 HydrophobicContact CE1-CB 4.42Å; F89-I104 HydrophobicContact CE1-CD1 4.17Å; F89-I104 HydrophobicContact CE1-CG1 4.07Å; F89-I104 HydrophobicContact CE1-CG2 3.69Å
90	T	98.8	Very high	97.6	Very high	1 Å²	1	76.4 Å²	76.4	1%	0.006	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	123.6	174.5	-51.8	0	0	0	0	110.1	K83 K84 E85 F92 H103	K83-T90 HydrophobicContact CG-CG2 4.08Å; K84-T90 CarbonylContact O-C 3.51Å; K84-T90 VanDerWaalsContact O-CA 3.3Å; K84-T90 WeakPolarHBondContact O-CA 3.3Å; E85-T90 HydrophobicContact CG-CG2 3.65Å; T90-F92 HydrophobicContact CG2-CD2 3.98Å; T90-F92 HydrophobicContact CG2-CE1 4.25Å; T90-F92 HydrophobicContact CG2-CE2 3.44Å; T90-F92 VanDerWaalsContact CG2-CE2 3.44Å; T90-F92 HydrophobicContact CG2-CZ 3.6Å; T90-H103 PolarHBondContact N-O 2.96Å; T90-H103 PolarHBondContact O-N 3.08Å
91	I	98.8	Very high	97.7	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.1	165.6	-55.1	169.6	0	0	0	108.6	I75 I77 K83 K84 L100 S101 L102	I75-I91 HydrophobicContact CB-CD1 4.29Å; I75-I91 HydrophobicContact CD1-CD1 4.43Å; I75-I91 HydrophobicContact CD1-CG1 4.29Å; I75-I91 HydrophobicContact CG1-CD1 3.92Å; I75-I91 HydrophobicContact CG1-CG1 4.29Å; I75-I91 HydrophobicContact CG2-CD1 3.82Å; I75-I91 HydrophobicContact CG2-CG1 3.83Å; I77-I91 HydrophobicContact CB-CB 4.45Å; I77-I91 HydrophobicContact CB-CD1 3.96Å; I77-I91 HydrophobicContact CB-CG2 4.29Å; I77-I91 HydrophobicContact CD1-CG2 4.45Å; I77-I91 HydrophobicContact CG2-CB 4.33Å; I77-I91 HydrophobicContact CG2-CD1 4Å; I77-I91 HydrophobicContact CG2-CG2 3.66Å; K83-I91 VanDerWaalsContact CA-O 3.3Å; K83-I91 WeakPolarHBondContact CA-O 3.37Å; K84-I91 HydrophobicContact CB-CB 4.46Å; K84-I91 PolarHBondContact N-O 2.94Å; K84-I91 PolarHBondContact O-N 3.44Å; I91-L100 HydrophobicContact CG2-CB 4.46Å; I91-L100 HydrophobicContact CG2-CD1 4.44Å; I91-S101 CarbonylContact C-O 3.56Å; I91-S101 VanDerWaalsContact CA-O 3.27Å; I91-S101 WeakPolarHBondContact CA-O 3.39Å; I91-L102 HydrophobicContact CG1-CD1 4.42Å
92	F	98.6	Very high	97.7	Very high	78 Å²	78	68.3 Å²	68.3	34%	0.342	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133.7	161.5	-64	-86.3	0	0	0	109	K83 T90 L100 S101 H103	K83-F92 HydrophobicContact CD-CE1 4.06Å; K83-F92 HydrophobicContact CG-CD1 4.26Å; K83-F92 HydrophobicContact CG-CE1 4.12Å; T90-F92 HydrophobicContact CG2-CD2 3.98Å; T90-F92 HydrophobicContact CG2-CE1 4.25Å; T90-F92 HydrophobicContact CG2-CE2 3.44Å; T90-F92 VanDerWaalsContact CG2-CE2 3.44Å; T90-F92 HydrophobicContact CG2-CZ 3.6Å; F92-L100 CarbonylContact O-C 3.56Å; F92-L100 WeakPolarHBondContact O-CA 3.47Å; F92-L100 WeakPolarHBondContact O-CB 3.14Å; F92-S101 PolarHBondContact N-O 3.33Å; F92-S101 PolarHBondContact O-N 3.06Å; F92-H103 AromaticContact CD2-CD2 3.57Å; F92-H103 AromaticContact CD2-CE1 3.84Å; F92-H103 AromaticContact CD2-CG 3.86Å; F92-H103 AromaticContact CD2-NE2 3.57Å; F92-H103 HydrophobicContact CE2-CB 4.26Å; F92-H103 AromaticContact CE2-CD2 3.9Å; F92-H103 AromaticContact CE2-CE1 3.75Å; F92-H103 AromaticContact CE2-CG 3.69Å; F92-H103 AromaticContact CE2-ND1 3.6Å; F92-H103 AromaticContact CE2-NE2 3.95Å
93	F	98.4	Very high	97.7	Very high	14 Å²	14	64.4 Å²	64.4	6%	0.061	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.4	-175.8	178.6	-102.3	0	0	0	110.5	Y52 F60 I77 S81 D82 K95 L100	Y52-F93 AromaticContact CE1-CE2 3.67Å; Y52-F93 HydrophobicContact CE1-CE2 3.67Å; Y52-F93 HydrophobicContact CE1-CZ 4.17Å; Y52-F93 WeakPolarHBondContact OH-CZ 3.32Å; F60-F93 HydrophobicContact CD1-CE2 4.15Å; F60-F93 HydrophobicContact CD2-CD2 4.2Å; F60-F93 AromaticContact CD2-CE2 3.65Å; F60-F93 HydrophobicContact CD2-CE2 3.65Å; F60-F93 HydrophobicContact CD2-CZ 4.15Å; F60-F93 AromaticContact CE1-CE2 3.93Å; F60-F93 HydrophobicContact CE1-CE2 3.93Å; F60-F93 HydrophobicContact CE2-CD2 4.39Å; F60-F93 AromaticContact CE2-CE2 3.43Å; F60-F93 HydrophobicContact CE2-CE2 3.43Å; F60-F93 VanDerWaalsContact CE2-CE2 3.43Å; F60-F93 AromaticContact CE2-CZ 3.59Å; F60-F93 HydrophobicContact CE2-CZ 3.59Å; F60-F93 HydrophobicContact CG-CD2 4.39Å; F60-F93 HydrophobicContact CG-CE2 4.02Å; F60-F93 AromaticContact CZ-CE2 3.57Å; F60-F93 HydrophobicContact CZ-CE2 3.57Å; F60-F93 AromaticContact CZ-CZ 3.85Å; F60-F93 HydrophobicContact CZ-CZ 3.85Å; I77-F93 HydrophobicContact CD1-CB 3.95Å; I77-F93 HydrophobicContact CG2-CB 4.33Å; S81-F93 VanDerWaalsContact O-CD1 3.3Å; S81-F93 WeakPolarHBondContact O-CD1 3.33Å; D82-F93 PolarHBondContact O-N 2.04Å; F93-K95 HydrophobicContact CD1-CB 4.4Å; F93-K95 HydrophobicContact CE1-CB 3.58Å; F93-K95 HydrophobicContact CE1-CD 4.45Å; F93-K95 HydrophobicContact CE1-CG 4.1Å; F93-K95 HydrophobicContact CZ-CB 4.08Å; F93-K95 HydrophobicContact CZ-CG 4.28Å; F93-L100 HydrophobicContact CD2-CB 4.03Å
94	N	97.4	Very high	97.7	Very high	56 Å²	56	60.5 Å²	60.5	30%	0.299	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	97.4	174.6	-173	-26.7	0	0	0	109.7	R96 E97 K98 N99	N94-R96 VanDerWaalsContact C-N 3.27Å; N94-R96 PolarHBondContact O-N 2.83Å; N94-R96 WeakPolarHBondContact OD1-CB 3.18Å; N94-R96 PolarHBondContact OD1-N 2.81Å; N94-E97 HydrophobicContact CB-CB 4.29Å; N94-E97 WeakPolarHBondContact ND2-CG 3.46Å; N94-E97 PolarHBondContact ND2-OE1 3.45Å; N94-E97 VanDerWaalsContact ND2-OE1 3.12Å; N94-E97 PolarHBondContact ND2-OE2 2.75Å; N94-E97 PolarHBondContact O-N 2.83Å; N94-E97 PolarHBondContact OD1-N 2.82Å; N94-K98 WeakPolarHBondContact O-CA 3.44Å; N94-K98 PolarHBondContact O-N 2.93Å; N94-N99 PolarHBondContact N-O 3.35Å; N94-N99 PolarHBondContact O-N 2.84Å; N94-N99 VanDerWaalsContact O-N 3.08Å
95	K	95.3	Very high	97.7	Very high	114 Å²	114	60 Å²	60	50%	0.496	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.4	178.9	-165.5	168.1	-176.8	161.7	0	113.3	S79 F93 K98	S79-K95 PolarHBondContact OG-NZ 3.39Å; F93-K95 HydrophobicContact CD1-CB 4.4Å; F93-K95 HydrophobicContact CE1-CB 3.58Å; F93-K95 HydrophobicContact CE1-CD 4.45Å; F93-K95 HydrophobicContact CE1-CG 4.1Å; F93-K95 HydrophobicContact CZ-CB 4.08Å; F93-K95 HydrophobicContact CZ-CG 4.28Å; K95-K98 PolarHBondContact O-N 3.3Å
96	R	95.1	Very high	97.7	Very high	233 Å²	233	59.6 Å²	59.6	88%	0.879	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-44.3	-176.3	-179.9	-175.3	-68.4	-150.3	-0.5	110.6	N94 K98	N94-R96 VanDerWaalsContact C-N 3.27Å; N94-R96 PolarHBondContact O-N 2.83Å; N94-R96 WeakPolarHBondContact OD1-CB 3.18Å; N94-R96 PolarHBondContact OD1-N 2.81Å; R96-K98 VanDerWaalsContact C-N 3.28Å
97	E	96.4	Very high	97.7	Very high	121 Å²	121	55.4 Å²	55.4	57%	0.565	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-6.3	179.3	-67	173.7	-161.2	0	0	112.9	N94 N99	N94-E97 HydrophobicContact CB-CB 4.29Å; N94-E97 WeakPolarHBondContact ND2-CG 3.46Å; N94-E97 PolarHBondContact ND2-OE1 3.45Å; N94-E97 VanDerWaalsContact ND2-OE1 3.12Å; N94-E97 PolarHBondContact ND2-OE2 2.75Å; N94-E97 PolarHBondContact O-N 2.83Å; N94-E97 PolarHBondContact OD1-N 2.82Å; E97-N99 HydrophobicContact CB-CB 4.31Å; E97-N99 PolarHBondContact O-N 3.22Å; E97-N99 PolarHBondContact O-OD1 2.8Å
98	K	96.2	Very high	97.7	Very high	68 Å²	68	55.9 Å²	55.9	30%	0.296	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	44.2	-173.1	-53.5	-177.5	177	-178	0	112.7	S51 Y52 E53 S55 N94 K95 R96	S51-K98 CarbonylContact C-O 3.59Å; S51-K98 VanDerWaalsContact CA-O 3.3Å; S51-K98 WeakPolarHBondContact CA-O 3.44Å; Y52-K98 VanDerWaalsContact CD1-C 3.5Å; Y52-K98 HydrophobicContact CD1-CB 4.05Å; Y52-K98 WeakPolarHBondContact CD1-O 3.43Å; Y52-K98 HydrophobicContact CD2-CB 4.28Å; Y52-K98 HydrophobicContact CE1-CB 3.79Å; Y52-K98 WeakPolarHBondContact CE1-O 3.36Å; Y52-K98 HydrophobicContact CE2-CB 4.04Å; Y52-K98 HydrophobicContact CE2-CD 4.47Å; Y52-K98 HydrophobicContact CE2-CG 4.17Å; Y52-K98 HydrophobicContact CG-CB 4.28Å; Y52-K98 PolarHBondContact N-O 2.65Å; Y52-K98 WeakPolarHBondContact O-CB 3.4Å; Y52-K98 WeakPolarHBondContact O-CD 3.43Å; E53-K98 PolarHBondContact O-NZ 2.76Å; S55-K98 WeakPolarHBondContact OG-CE 3.32Å; S55-K98 PolarHBondContact OG-NZ 3.42Å; S55-K98 VanDerWaalsContact OG-NZ 3.12Å; N94-K98 WeakPolarHBondContact O-CA 3.44Å; N94-K98 PolarHBondContact O-N 2.93Å; K95-K98 PolarHBondContact O-N 3.3Å; R96-K98 VanDerWaalsContact C-N 3.28Å
99	N	96.5	Very high	97.7	Very high	62 Å²	62	57.9 Å²	57.9	33%	0.332	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.7	-177.4	-70.5	-24.2	0	0	0	110.5	C50 S51 N94 E97	C50-N99 CarbonylContact O-C 3.5Å; C50-N99 WeakPolarHBondContact O-CA 3.31Å; S51-N99 WeakPolarHBondContact CB-OD1 3.37Å; N94-N99 PolarHBondContact N-O 3.35Å; N94-N99 PolarHBondContact O-N 2.84Å; N94-N99 VanDerWaalsContact O-N 3.08Å; E97-N99 HydrophobicContact CB-CB 4.31Å; E97-N99 PolarHBondContact O-N 3.22Å; E97-N99 PolarHBondContact O-OD1 2.8Å
100	L	96.8	Very high	97.6	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	150	166.7	68	165.2	0	0	0	110.9	C50 Y52 F60 I91 F92 F93	C50-L100 WeakPolarHBondContact CA-O 3.47Å; C50-L100 HydrophobicContact CB-CD2 3.66Å; C50-L100 HydrophobicContact CB-CG 3.9Å; C50-L100 PolarHBondContact N-O 2.93Å; C50-L100 PolarHBondContact O-N 3.01Å; C50-L100 VanDerWaalsContact SG-CD2 3.52Å; Y52-L100 HydrophobicContact CD1-CD2 4.19Å; F60-L100 HydrophobicContact CB-CD1 3.66Å; F60-L100 HydrophobicContact CD1-CD1 4.18Å; F60-L100 HydrophobicContact CD1-CD2 4.25Å; F60-L100 HydrophobicContact CG-CD1 4.21Å; I91-L100 HydrophobicContact CG2-CB 4.46Å; I91-L100 HydrophobicContact CG2-CD1 4.44Å; F92-L100 CarbonylContact O-C 3.56Å; F92-L100 WeakPolarHBondContact O-CA 3.47Å; F92-L100 WeakPolarHBondContact O-CB 3.14Å; F93-L100 HydrophobicContact CD2-CB 4.03Å
101	S	98.1	Very high	97.5	Very high	14 Å²	14	59.6 Å²	59.6	10%	0.098	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.6	174.8	62.5	0	0	0	0	111	L48 N49 I91 F92 H103	L48-S101 CarbonylContact O-C 3.48Å; L48-S101 WeakPolarHBondContact O-CA 3.27Å; N49-S101 WeakPolarHBondContact OD1-CB 3.14Å; I91-S101 CarbonylContact C-O 3.56Å; I91-S101 VanDerWaalsContact CA-O 3.27Å; I91-S101 WeakPolarHBondContact CA-O 3.39Å; F92-S101 PolarHBondContact N-O 3.33Å; F92-S101 PolarHBondContact O-N 3.06Å; S101-H103 PolarHBondContact OG-CD2 3.41Å; S101-H103 VanDerWaalsContact OG-CD2 3.23Å; S101-H103 PolarHBondContact OG-NE2 3.42Å
102	L	98.6	Very high	97.4	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.8	166.4	173.4	65.6	0	0	0	108.4	L48 W62 L74 I75 F89 I91 I104 Y115	L48-L102 HydrophobicContact CB-CB 4.32Å; L48-L102 HydrophobicContact CD1-CD2 4.02Å; L48-L102 PolarHBondContact N-O 3.4Å; L48-L102 PolarHBondContact O-N 3.45Å; W62-L102 HydrophobicContact CB-CD2 4.2Å; W62-L102 HydrophobicContact CD2-CB 3.66Å; W62-L102 HydrophobicContact CD2-CD2 3.88Å; W62-L102 HydrophobicContact CD2-CG 4.35Å; W62-L102 HydrophobicContact CE3-CB 4.03Å; W62-L102 HydrophobicContact CE3-CD2 3.8Å; W62-L102 HydrophobicContact CG-CB 4.12Å; W62-L102 HydrophobicContact CG-CD2 4.07Å; W62-L102 HydrophobicContact CH2-CB 4.15Å; W62-L102 HydrophobicContact CZ2-CB 3.81Å; W62-L102 HydrophobicContact CZ3-CB 4.26Å; W62-L102 HydrophobicContact CZ3-CD2 4.45Å; L74-L102 HydrophobicContact CD2-CD2 3.72Å; I75-L102 HydrophobicContact CG2-CD1 3.85Å; F89-L102 HydrophobicContact CB-CD1 4.22Å; F89-L102 HydrophobicContact CD1-CD1 4.43Å; I91-L102 HydrophobicContact CG1-CD1 4.42Å; L102-I104 HydrophobicContact CD2-CD1 4.46Å; L102-I104 HydrophobicContact CD2-CG1 4.42Å; L102-I104 HydrophobicContact CG-CG1 4.21Å; L102-Y115 HydrophobicContact CD2-CD1 3.93Å; L102-Y115 HydrophobicContact CD2-CE1 4.39Å
103	H	98.6	Very high	97.4	Very high	39 Å²	39	61.9 Å²	61.9	18%	0.181	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.2	174.2	-69.2	-142.3	0	0	0	108.4	T45 A46 F89 T90 F92 S101	T45-H103 HydrophobicContact CG2-CB 4.27Å; A46-H103 CarbonylContact O-C 3.57Å; A46-H103 WeakPolarHBondContact O-CA 3.4Å; F89-H103 CarbonylContact C-O 3.46Å; F89-H103 WeakPolarHBondContact CA-O 3Å; T90-H103 PolarHBondContact N-O 2.96Å; T90-H103 PolarHBondContact O-N 3.08Å; F92-H103 AromaticContact CD2-CD2 3.57Å; F92-H103 AromaticContact CD2-CE1 3.84Å; F92-H103 AromaticContact CD2-CG 3.86Å; F92-H103 AromaticContact CD2-NE2 3.57Å; F92-H103 HydrophobicContact CE2-CB 4.26Å; F92-H103 AromaticContact CE2-CD2 3.9Å; F92-H103 AromaticContact CE2-CE1 3.75Å; F92-H103 AromaticContact CE2-CG 3.69Å; F92-H103 AromaticContact CE2-ND1 3.6Å; F92-H103 AromaticContact CE2-NE2 3.95Å; S101-H103 PolarHBondContact OG-CD2 3.41Å; S101-H103 VanDerWaalsContact OG-CD2 3.23Å; S101-H103 PolarHBondContact OG-NE2 3.42Å
104	I	98.6	Very high	97.3	Very high	3 Å²	3	64.8 Å²	64.8	2%	0.015	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	102.4	174.9	-45.8	-179.9	0	0	0	106.2	T45 A46 L48 F89 L102 Y115	T45-I104 CarbonylContact C-O 3.59Å; T45-I104 VanDerWaalsContact CA-O 3.28Å; T45-I104 WeakPolarHBondContact CA-O 3.49Å; A46-I104 HydrophobicContact CB-CB 4.13Å; A46-I104 HydrophobicContact CB-CG1 4.45Å; A46-I104 PolarHBondContact N-O 3.25Å; A46-I104 PolarHBondContact O-N 3.01Å; L48-I104 HydrophobicContact CD1-CD1 4.28Å; F89-I104 HydrophobicContact CD1-CB 4.4Å; F89-I104 HydrophobicContact CD1-CD1 4.46Å; F89-I104 HydrophobicContact CD1-CG1 3.95Å; F89-I104 HydrophobicContact CD1-CG2 4.04Å; F89-I104 HydrophobicContact CE1-CB 4.42Å; F89-I104 HydrophobicContact CE1-CD1 4.17Å; F89-I104 HydrophobicContact CE1-CG1 4.07Å; F89-I104 HydrophobicContact CE1-CG2 3.69Å; L102-I104 HydrophobicContact CD2-CD1 4.46Å; L102-I104 HydrophobicContact CD2-CG1 4.42Å; L102-I104 HydrophobicContact CG-CG1 4.21Å; I104-Y115 HydrophobicContact CD1-CD1 4.39Å; I104-Y115 HydrophobicContact CD1-CE1 3.64Å; I104-Y115 HydrophobicContact CD1-CE2 4.22Å
105	K	98.4	Very high	97.3	Very high	93 Å²	93	63.3 Å²	63.3	40%	0.404	33%	0.331	S	S	.	.	S	Bend	trans	-77.4	154.6	178.6	-66	177.2	-176.3	166	0	110.1	T45 E85 R88 S107	T45-K105 HydrophobicContact CG2-CG 4.46Å; E85-K105 IonicContact OE1-NZ 3.34Å; R88-K105 WeakPolarHBondContact CB-O 3.45Å; R88-K105 WeakPolarHBondContact CD-O 3.18Å; R88-K105 PolarHBondContact NH1-O 2.8Å; R88-K105 PolarHBondContact O-N 2.9Å; K105-S107 PolarHBondContact O-N 3.12Å
106	D	98.3	Very high	97.4	Very high	86 Å²	86	61.5 Å²	61.5	46%	0.46	32%	0.324	S	S	.	.	S	Bend	trans	50.4	58	175.2	-178.8	48.8	0	0	0	110.7	R88 Q108	R88-D106 PolarHBondContact NH1-O 2.7Å; D106-Q108 VanDerWaalsContact O-CG 3.29Å; D106-Q108 WeakPolarHBondContact O-CG 3.37Å; D106-Q108 PolarHBondContact O-N 2.64Å
107	S	98.3	Very high	97.5	Very high	10 Å²	10	51 Å²	51	7%	0.07	29%	0.286	C	S	.	.			trans	-58.1	137.2	-172.8	-61	0	0	0	0	110.8	E42 G43 E44 A46 K105 D111	E42-S107 CarbonylContact C-O 3.56Å; E42-S107 VanDerWaalsContact CA-O 3.3Å; E42-S107 WeakPolarHBondContact CA-O 3.4Å; E42-S107 WeakPolarHBondContact CG-O 3.27Å; G43-S107 PolarHBondContact N-O 3.12Å; E44-S107 VanDerWaalsContact O-CB 3.26Å; E44-S107 WeakPolarHBondContact O-CB 3.35Å; E44-S107 PolarHBondContact O-N 2.75Å; E44-S107 PolarHBondContact O-OG 2.74Å; A46-S107 PolarHBondContact N-OG 2.74Å; K105-S107 PolarHBondContact O-N 3.12Å; S107-D111 WeakPolarHBondContact CA-OD2 3.33Å
108	Q	98	Very high	97.6	Very high	87 Å²	87	46.8 Å²	46.8	41%	0.407	27%	0.272	S	S	.	.			trans	-121.3	157.6	-176.5	-54.3	-178	2.8	0	0	110.1	D106 G110 D111	D106-Q108 VanDerWaalsContact O-CG 3.29Å; D106-Q108 WeakPolarHBondContact O-CG 3.37Å; D106-Q108 PolarHBondContact O-N 2.64Å; Q108-G110 PolarHBondContact O-N 2.78Å; Q108-G110 VanDerWaalsContact O-N 3.09Å; Q108-D111 PolarHBondContact N-OD2 2.7Å; Q108-D111 WeakPolarHBondContact O-CB 3.28Å; Q108-D111 PolarHBondContact O-N 2.86Å
109	P	96.9	Very high	97.6	Very high	97 Å²	97	44.5 Å²	44.5	63%	0.63	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-54.1	-32	174.5	-28	35.8	0	0	0	113.6	D111 S112	P109-D111 PolarHBondContact O-N 2.77Å; P109-S112 WeakPolarHBondContact O-CB 3.29Å; P109-S112 PolarHBondContact O-N 2.98Å
110	G	96.8	Very high	97.5	Very high	50 Å²	50	45.7 Å²	45.7	52%	0.515	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-69.1	-9.3	175.2	0	0	0	0	0	115.2	F66 Q108 S112	F66-G110 VanDerWaalsContact CE1-O 3.28Å; F66-G110 WeakPolarHBondContact CE1-O 3.21Å; Q108-G110 PolarHBondContact O-N 2.78Å; Q108-G110 VanDerWaalsContact O-N 3.09Å; G110-S112 VanDerWaalsContact C-N 3.28Å
111	D	97.4	Very high	97.5	Very high	21 Å²	21	47.7 Å²	47.7	11%	0.112	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-84.4	-3.4	174.5	-62.4	-34.5	0	0	0	112.4	R88 S107 Q108 P109 A113 Y115	R88-D111 IonicContact CZ-OD1 3.06Å; R88-D111 IonicContact CZ-OD2 3.73Å; R88-D111 IonicContact NH1-OD1 2.66Å; R88-D111 IonicContact NH1-OD2 3.8Å; R88-D111 PolarHBondContact NH1-OD2 2.96Å; R88-D111 VanDerWaalsContact NH2-CG 3.28Å; R88-D111 IonicContact NH2-OD1 3.91Å; R88-D111 PolarHBondContact NH2-OD1 2.77Å; R88-D111 IonicContact NH2-OD2 2.74Å; R88-D111 PolarHBondContact NH2-OD2 3.23Å; S107-D111 WeakPolarHBondContact CA-OD2 3.33Å; Q108-D111 PolarHBondContact N-OD2 2.7Å; Q108-D111 WeakPolarHBondContact O-CB 3.28Å; Q108-D111 PolarHBondContact O-N 2.86Å; P109-D111 PolarHBondContact O-N 2.77Å; D111-A113 PolarHBondContact O-N 2.78Å; D111-Y115 WeakPolarHBondContact O-CE2 3.46Å; D111-Y115 PolarHBondContact O-OH 2.85Å
112	S	97.3	Very high	97.5	Very high	96 Å²	96	49.4 Å²	49.4	67%	0.671	30%	0.301	S	S	*	.			trans	-68.7	102	178.4	-164	0	0	0	0	110.8	P109 G110	P109-S112 WeakPolarHBondContact O-CB 3.29Å; P109-S112 PolarHBondContact O-N 2.98Å; G110-S112 VanDerWaalsContact C-N 3.28Å
113	A	97.3	Very high	97.4	Very high	29 Å²	29	52.2 Å²	52.2	24%	0.24	32%	0.318	C	S	.	.	S	Bend	trans	-158.7	170.7	-174	0	0	0	0	0	111.1	Q64 Q65 F66 D111 Y115	Q64-A113 HydrophobicContact CG-CB 3.6Å; Q65-A113 WeakPolarHBondContact O-CB 3.41Å; F66-A113 HydrophobicContact CD1-CB 3.89Å; F66-A113 HydrophobicContact CE1-CB 3.93Å; D111-A113 PolarHBondContact O-N 2.78Å; A113-Y115 HydrophobicContact CB-CD2 4.5Å; A113-Y115 HydrophobicContact CB-CE2 3.91Å; A113-Y115 WeakPolarHBondContact O-CD2 3.13Å
114	T	97.7	Very high	97.3	Very high	75 Å²	75	52.9 Å²	52.9	46%	0.46	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133	165	-55.8	0	0	0	0	109.4	Q64 Q65 F116	Q64-T114 CarbonylContact C-O 3.59Å; Q65-T114 PolarHBondContact N-O 3.08Å; Q65-T114 PolarHBondContact O-N 3.42Å; T114-F116 HydrophobicContact CG2-CD2 4.36Å; T114-F116 HydrophobicContact CG2-CE1 3.85Å; T114-F116 HydrophobicContact CG2-CE2 3.63Å; T114-F116 HydrophobicContact CG2-CZ 3.34Å
115	Y	97.8	Very high	97.3	Very high	25 Å²	25	56.1 Å²	56.1	10%	0.098	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.3	180	-66.2	-96.7	0	0	0	110.7	Q33 L48 Y63 Q64 L74 L102 I104 D111 A113	Q33-Y115 PolarHBondContact NE2-O 3.47Å; L48-Y115 HydrophobicContact CD1-CD1 3.98Å; L48-Y115 HydrophobicContact CD1-CD2 3.82Å; L48-Y115 HydrophobicContact CD1-CE2 4.49Å; L48-Y115 HydrophobicContact CD1-CG 3.52Å; Y63-Y115 CarbonylContact O-C 3.58Å; Y63-Y115 VanDerWaalsContact O-CA 3.31Å; Y63-Y115 WeakPolarHBondContact O-CA 3.38Å; Q64-Y115 HydrophobicContact CB-CD1 4.3Å; Q64-Y115 HydrophobicContact CB-CE1 4.15Å; Q64-Y115 HydrophobicContact CG-CD1 4.32Å; Q64-Y115 HydrophobicContact CG-CE1 3.83Å; Q64-Y115 PolarHBondContact NE2-OH 3.33Å; L74-Y115 HydrophobicContact CD2-CD1 4.08Å; L74-Y115 HydrophobicContact CD2-CE1 3.85Å; L102-Y115 HydrophobicContact CD2-CD1 3.93Å; L102-Y115 HydrophobicContact CD2-CE1 4.39Å; I104-Y115 HydrophobicContact CD1-CD1 4.39Å; I104-Y115 HydrophobicContact CD1-CE1 3.64Å; I104-Y115 HydrophobicContact CD1-CE2 4.22Å; D111-Y115 WeakPolarHBondContact O-CE2 3.46Å; D111-Y115 PolarHBondContact O-OH 2.85Å; A113-Y115 HydrophobicContact CB-CD2 4.5Å; A113-Y115 HydrophobicContact CB-CE2 3.91Å; A113-Y115 WeakPolarHBondContact O-CD2 3.13Å
116	F	97.4	Very high	97.2	Very high	76 Å²	76	53.6 Å²	53.6	33%	0.333	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.5	-180	-56.6	-83.5	0	0	0	111.1	W62 Y63 Q65 P71 T114	W62-F116 CarbonylContact C-O 3.56Å; W62-F116 WeakPolarHBondContact CA-O 3.3Å; Y63-F116 PolarHBondContact N-O 3.38Å; Y63-F116 PolarHBondContact O-N 3.38Å; Q65-F116 HydrophobicContact CB-CD2 4.44Å; Q65-F116 HydrophobicContact CB-CE2 3.76Å; P71-F116 HydrophobicContact CB-CD2 4.41Å; P71-F116 HydrophobicContact CG-CD2 4.43Å; P71-F116 HydrophobicContact CG-CE2 4.26Å; T114-F116 HydrophobicContact CG2-CD2 4.36Å; T114-F116 HydrophobicContact CG2-CE1 3.85Å; T114-F116 HydrophobicContact CG2-CE2 3.63Å; T114-F116 HydrophobicContact CG2-CZ 3.34Å
117	C	97.3	Very high	97.1	Very high	12 Å²	12	51.3 Å²	51.3	8%	0.081	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.6	167.4	177.8	0	0	0	0	109.6	V31 Q33 C50 W62	V31-C117 HydrophobicContact CG1-CB 4.2Å; Q33-C117 HydrophobicContact CG-CB 4.01Å; C50-C117 HydrophobicContact CB-CB 3.55Å; C50-C117 WeakPolarHBondContact CB-SG 3.06Å; C50-C117 WeakPolarHBondContact SG-CB 3.45Å; C50-C117 CovalentContact SG-SG 2.04Å; C50-C117 PolarHBondContact SG-SG 3.43Å; W62-C117 HydrophobicContact CD2-CB 4.27Å; W62-C117 HydrophobicContact CE3-CB 4.16Å; W62-C117 HydrophobicContact CH2-CB 3.81Å; W62-C117 HydrophobicContact CZ2-CB 3.9Å; W62-C117 HydrophobicContact CZ3-CB 3.94Å
118	A	96.9	Very high	97	Very high	34 Å²	34	54.5 Å²	54.5	28%	0.281	35%	0.353	S	S	.	.			trans	-134.9	165.9	172.1	0	0	0	0	0	111.1	F60 P61 Y63	F60-A118 WeakPolarHBondContact CA-O 3.46Å; P61-A118 WeakPolarHBondContact CD-O 3.48Å; P61-A118 HydrophobicContact CG-CB 4.11Å; P61-A118 PolarHBondContact O-N 3.43Å; Y63-A118 HydrophobicContact CE2-CB 4.19Å
119	A	96.4	Very high	96.9	Very high	19 Å²	19	51.8 Å²	51.8	16%	0.157	35%	0.349	C	S	.	.			trans	-146.4	138.9	178.7	0	0	0	0	0	109.8	V31 F57 Y59 F60	V31-A119 HydrophobicContact CG2-CB 3.82Å; F57-A119 HydrophobicContact CB-CB 4.02Å; F57-A119 HydrophobicContact CD1-CB 4.39Å; F57-A119 HydrophobicContact CD2-CB 3.4Å; F57-A119 HydrophobicContact CE2-CB 3.77Å; F57-A119 HydrophobicContact CG-CB 3.73Å; F57-A119 HydrophobicContact CZ-CB 4.35Å; Y59-A119 WeakPolarHBondContact O-CA 3.26Å; F60-A119 HydrophobicContact CD1-CB 3.68Å; F60-A119 HydrophobicContact CE1-CB 3.63Å
120	S	94.1	Very high	96.9	Very high	87 Å²	87	47.6 Å²	47.6	61%	0.608	32%	0.323	S	S	*	.			trans	-143.8	0	177.5	61.2	0	0	0	0	111.9	F57 D58 Y59	F57-S120 CarbonylContact C-O 3.58Å; F57-S120 WeakPolarHBondContact CA-O 3.15Å; F57-S120 VanDerWaalsContact CD1-C 3.43Å; F57-S120 WeakPolarHBondContact CD1-OXT 3.25Å; D58-S120 PolarHBondContact N-O 3.34Å; Y59-S120 PolarHBondContact N-O 2.66Å; Y59-S120 PolarHBondContact O-N 2.92Å

Retrieved 120 of 120 residues in 112.2 ms (Link to these results)

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