A0A087Y8S5_POEFO Loading...

Si:ch211-173a9.6

AlphaFold DB , UniProt , Accession A0A087Y8S5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 401 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.9	Low	61.6	Low	207 Å²	207	119.3 Å²	119.3	100%	1.02	61%	0.606	S	S	*	*				0	-56.5	0	-96.6	-168.8	-81	0	0	113	Q3 V4 S5	M1-Q3 PolarHBondContact O-N 2.74Å; M1-V4 PolarHBondContact O-N 3.47Å; M1-S5 PolarHBondContact O-N 3.33Å
2	Q	52.3	Low	61.9	Low	169 Å²	169	116.8 Å²	116.8	79%	0.79	60%	0.6	S	S	*	*	H	α-helix	trans	-61.1	-38.6	178.5	-91.7	176.3	-19.2	0	0	114.2	S5 K6	Q2-S5 PolarHBondContact O-N 2.88Å; Q2-K6 WeakPolarHBondContact O-CG 3.5Å; Q2-K6 PolarHBondContact O-N 2.71Å; Q2-K6 VanDerWaalsContact O-N 3.16Å
3	Q	55.1	Low	62.3	Low	121 Å²	121	114.2 Å²	114.2	57%	0.565	58%	0.584	S	S	*	*	H	α-helix	trans	-65.9	-50.8	177.4	-170.4	59	33	0	0	111.7	M1 S5 K6 D7	M1-Q3 PolarHBondContact O-N 2.74Å; Q3-S5 VanDerWaalsContact C-N 3.25Å; Q3-S5 PolarHBondContact O-N 3.12Å; Q3-K6 PolarHBondContact O-N 3.28Å; Q3-D7 PolarHBondContact NE2-OD1 3.02Å; Q3-D7 PolarHBondContact O-N 3.47Å
4	V	60.3	Low	62.7	Low	104 Å²	104	110.9 Å²	110.9	63%	0.63	57%	0.567	S	S	*	*	H	α-helix	trans	-56	-38.1	176.2	-179.1	0	0	0	0	112.4	M1 L8	M1-V4 PolarHBondContact O-N 3.47Å; V4-L8 WeakPolarHBondContact O-CB 3.32Å; V4-L8 PolarHBondContact O-N 3.02Å
5	S	55.8	Low	62.8	Low	65 Å²	65	108 Å²	108	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-69.7	-34.6	176.7	-175.8	0	0	0	0	113.2	M1 Q2 Q3 I9	M1-S5 PolarHBondContact O-N 3.33Å; Q2-S5 PolarHBondContact O-N 2.88Å; Q3-S5 VanDerWaalsContact C-N 3.25Å; Q3-S5 PolarHBondContact O-N 3.12Å; S5-I9 WeakPolarHBondContact O-CD1 3.37Å; S5-I9 VanDerWaalsContact O-CG1 3.29Å; S5-I9 WeakPolarHBondContact O-CG1 3.25Å; S5-I9 PolarHBondContact O-N 3.12Å; S5-I9 VanDerWaalsContact O-N 3.16Å
6	K	69.8	Low	62.8	Low	140 Å²	140	108.3 Å²	108.3	61%	0.609	55%	0.547	S	S	*	.	H	α-helix	trans	-72.2	-41.3	176.1	-75.7	-179.3	177.9	-178.1	0	111.3	Q2 Q3 L8 I9 L10	Q2-K6 WeakPolarHBondContact O-CG 3.5Å; Q2-K6 PolarHBondContact O-N 2.71Å; Q2-K6 VanDerWaalsContact O-N 3.16Å; Q3-K6 PolarHBondContact O-N 3.28Å; K6-L8 VanDerWaalsContact C-N 3.29Å; K6-L8 PolarHBondContact O-N 2.93Å; K6-I9 PolarHBondContact O-N 2.88Å; K6-L10 PolarHBondContact O-N 3.44Å
7	D	65.9	Low	63.2	Low	82 Å²	82	107.6 Å²	107.6	44%	0.439	55%	0.545	S	S	.	.	H	α-helix	trans	-62.3	-39.8	176.6	-59.2	-23	0	0	0	110.4	Q3 L10 E11	Q3-D7 PolarHBondContact NE2-OD1 3.02Å; Q3-D7 PolarHBondContact O-N 3.47Å; D7-L10 PolarHBondContact O-N 2.96Å; D7-E11 WeakPolarHBondContact O-CB 3.46Å; D7-E11 PolarHBondContact O-N 3.19Å
8	L	59.3	Low	63.3	Low	116 Å²	116	106.3 Å²	106.3	61%	0.607	54%	0.535	S	S	*	.	H	α-helix	trans	-67	-40.9	176.2	-168.5	69.5	0	0	0	113.1	V4 K6 E11 V12	V4-L8 WeakPolarHBondContact O-CB 3.32Å; V4-L8 PolarHBondContact O-N 3.02Å; K6-L8 VanDerWaalsContact C-N 3.29Å; K6-L8 PolarHBondContact O-N 2.93Å; L8-E11 PolarHBondContact O-N 2.97Å; L8-V12 VanDerWaalsContact O-CG2 3.3Å; L8-V12 WeakPolarHBondContact O-CG2 3.38Å; L8-V12 PolarHBondContact O-N 3.29Å
9	I	67.1	Low	63.2	Low	108 Å²	108	106 Å²	106	55%	0.554	53%	0.533	S	S	*	.	H	α-helix	trans	-64.9	-42.4	176.8	-70.6	166.4	0	0	0	110.6	S5 K6 E11 V12 E13	S5-I9 WeakPolarHBondContact O-CD1 3.37Å; S5-I9 VanDerWaalsContact O-CG1 3.29Å; S5-I9 WeakPolarHBondContact O-CG1 3.25Å; S5-I9 PolarHBondContact O-N 3.12Å; S5-I9 VanDerWaalsContact O-N 3.16Å; K6-I9 PolarHBondContact O-N 2.88Å; I9-E11 VanDerWaalsContact C-N 3.33Å; I9-V12 PolarHBondContact O-N 2.91Å; I9-E13 PolarHBondContact O-N 2.98Å
10	L	73.6	Confident	63.5	Low	109 Å²	109	105.2 Å²	105.2	57%	0.571	53%	0.533	S	S	*	.	H	α-helix	trans	-61.9	-43.6	176.2	-176.9	65.5	0	0	0	111	K6 D7 E13 I14	K6-L10 PolarHBondContact O-N 3.44Å; D7-L10 PolarHBondContact O-N 2.96Å; L10-E13 PolarHBondContact O-N 2.83Å; L10-I14 HydrophobicContact CD1-CD1 4.46Å; L10-I14 HydrophobicContact CG-CD1 4.03Å; L10-I14 VanDerWaalsContact O-CG1 3.26Å; L10-I14 WeakPolarHBondContact O-CG1 3.28Å; L10-I14 PolarHBondContact O-N 3.18Å
11	E	65.1	Low	63.7	Low	91 Å²	91	106.8 Å²	106.8	43%	0.425	54%	0.537	S	S	.	.	H	α-helix	trans	-62.4	-44.1	177	-169.2	57.2	-140.5	0	0	111.3	D7 L8 I9 E13 I14 Q15	D7-E11 WeakPolarHBondContact O-CB 3.46Å; D7-E11 PolarHBondContact O-N 3.19Å; L8-E11 PolarHBondContact O-N 2.97Å; I9-E11 VanDerWaalsContact C-N 3.33Å; E11-E13 PolarHBondContact O-N 2.72Å; E11-I14 PolarHBondContact O-N 3.32Å; E11-Q15 VanDerWaalsContact O-CG 3.31Å; E11-Q15 WeakPolarHBondContact O-CG 3.42Å; E11-Q15 PolarHBondContact O-N 2.93Å; E11-Q15 PolarHBondContact OE1-NE2 2.84Å
12	V	65.4	Low	64.1	Low	89 Å²	89	99 Å²	99	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-42.1	176.2	171.2	0	0	0	0	111.8	L8 I9 I14 Q15 K16	L8-V12 VanDerWaalsContact O-CG2 3.3Å; L8-V12 WeakPolarHBondContact O-CG2 3.38Å; L8-V12 PolarHBondContact O-N 3.29Å; I9-V12 PolarHBondContact O-N 2.91Å; V12-I14 VanDerWaalsContact C-N 3.35Å; V12-I14 PolarHBondContact O-N 2.84Å; V12-Q15 PolarHBondContact O-N 3.17Å; V12-K16 WeakPolarHBondContact O-CB 3.43Å; V12-K16 PolarHBondContact O-N 3.49Å
13	E	66.7	Low	64.7	Low	84 Å²	84	96.2 Å²	96.2	39%	0.393	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-36.8	177.9	-159.7	70.8	-137.7	0	0	111.6	I9 L10 E11 K16 N17	I9-E13 PolarHBondContact O-N 2.98Å; L10-E13 PolarHBondContact O-N 2.83Å; E11-E13 PolarHBondContact O-N 2.72Å; E13-K16 PolarHBondContact O-N 3.12Å; E13-K16 IonicContact OE1-NZ 2.78Å; E13-K16 PolarHBondContact OE1-NZ 2.96Å; E13-N17 WeakPolarHBondContact O-CB 3.36Å; E13-N17 PolarHBondContact O-N 3.22Å; E13-N17 PolarHBondContact O-ND2 2.75Å; E13-N17 VanDerWaalsContact O-ND2 3.12Å
14	I	68.9	Low	65.5	Low	68 Å²	68	92.3 Å²	92.3	35%	0.349	48%	0.479	S	S	.	.	H	α-helix	trans	-62.2	-46.4	173.3	-71.6	166.4	0	0	0	110.4	L10 E11 V12 N17 K18	L10-I14 HydrophobicContact CD1-CD1 4.46Å; L10-I14 HydrophobicContact CG-CD1 4.03Å; L10-I14 VanDerWaalsContact O-CG1 3.26Å; L10-I14 WeakPolarHBondContact O-CG1 3.28Å; L10-I14 PolarHBondContact O-N 3.18Å; E11-I14 PolarHBondContact O-N 3.32Å; V12-I14 VanDerWaalsContact C-N 3.35Å; V12-I14 PolarHBondContact O-N 2.84Å; I14-N17 PolarHBondContact O-N 3.27Å; I14-K18 HydrophobicContact CG2-CD 4.35Å; I14-K18 WeakPolarHBondContact O-CG 3.38Å; I14-K18 PolarHBondContact O-N 2.9Å
15	Q	63.3	Low	65.7	Low	67 Å²	67	91.6 Å²	91.6	31%	0.313	47%	0.467	S	S	.	.	H	α-helix	trans	-66.8	-38.8	179.4	-63	-55.3	-30.6	0	0	112	E11 V12 K18 M19	E11-Q15 VanDerWaalsContact O-CG 3.31Å; E11-Q15 WeakPolarHBondContact O-CG 3.42Å; E11-Q15 PolarHBondContact O-N 2.93Å; E11-Q15 PolarHBondContact OE1-NE2 2.84Å; V12-Q15 PolarHBondContact O-N 3.17Å; Q15-K18 PolarHBondContact O-N 3.39Å; Q15-M19 PolarHBondContact O-N 3.09Å
16	K	62.9	Low	65.9	Low	113 Å²	113	90.6 Å²	90.6	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-61.3	-46	174	-178	-174.9	167.3	-159.3	0	111.9	V12 E13 K18 M19 V20	V12-K16 WeakPolarHBondContact O-CB 3.43Å; V12-K16 PolarHBondContact O-N 3.49Å; E13-K16 PolarHBondContact O-N 3.12Å; E13-K16 IonicContact OE1-NZ 2.78Å; E13-K16 PolarHBondContact OE1-NZ 2.96Å; K16-K18 VanDerWaalsContact C-N 3.33Å; K16-K18 PolarHBondContact O-N 2.68Å; K16-M19 PolarHBondContact O-N 2.83Å; K16-V20 WeakPolarHBondContact O-CG2 3.38Å; K16-V20 PolarHBondContact O-N 2.66Å
17	N	69.8	Low	66.1	Low	97 Å²	97	88.3 Å²	88.3	52%	0.519	45%	0.454	S	S	.	.	H	α-helix	trans	-66.2	-34.8	178.5	-74.9	-36.1	0	0	0	112.6	E13 I14 K21	E13-N17 WeakPolarHBondContact O-CB 3.36Å; E13-N17 PolarHBondContact O-N 3.22Å; E13-N17 PolarHBondContact O-ND2 2.75Å; E13-N17 VanDerWaalsContact O-ND2 3.12Å; I14-N17 PolarHBondContact O-N 3.27Å; N17-K21 WeakPolarHBondContact O-CB 3.37Å; N17-K21 PolarHBondContact O-N 3.35Å; N17-K21 VanDerWaalsContact O-N 3.09Å
18	K	65.6	Low	66.2	Low	84 Å²	84	89.3 Å²	89.3	37%	0.365	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-47	170.8	-73	172.7	-176.4	170.8	0	111.4	I14 Q15 K16 V20 K21 Y22	I14-K18 HydrophobicContact CG2-CD 4.35Å; I14-K18 WeakPolarHBondContact O-CG 3.38Å; I14-K18 PolarHBondContact O-N 2.9Å; Q15-K18 PolarHBondContact O-N 3.39Å; K16-K18 VanDerWaalsContact C-N 3.33Å; K16-K18 PolarHBondContact O-N 2.68Å; K18-V20 PolarHBondContact O-N 2.89Å; K18-K21 PolarHBondContact O-N 3.32Å; K18-Y22 HydrophobicContact CB-CE2 4.27Å; K18-Y22 WeakPolarHBondContact O-CD2 3.45Å; K18-Y22 PolarHBondContact O-N 2.96Å
19	M	60.1	Low	66.3	Low	100 Å²	100	85.5 Å²	85.5	49%	0.493	44%	0.436	S	S	.	.	H	α-helix	trans	-59.8	-45.6	177.1	-82.3	-177.1	169.4	0	0	112.6	Q15 K16 K21 Y22 L23 L76	Q15-M19 PolarHBondContact O-N 3.09Å; K16-M19 PolarHBondContact O-N 2.83Å; M19-K21 VanDerWaalsContact C-N 3.31Å; M19-K21 PolarHBondContact O-N 2.76Å; M19-Y22 PolarHBondContact O-N 3Å; M19-L23 PolarHBondContact O-N 2.81Å; M19-L76 HydrophobicContact CE-CD2 3.18Å
20	V	69.1	Low	66.2	Low	89 Å²	89	85 Å²	85	54%	0.539	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-40.7	178.4	173.1	0	0	0	0	111.1	K16 K18 Y22 L23 G24	K16-V20 WeakPolarHBondContact O-CG2 3.38Å; K16-V20 PolarHBondContact O-N 2.66Å; K18-V20 PolarHBondContact O-N 2.89Å; V20-Y22 PolarHBondContact O-N 3.22Å; V20-L23 PolarHBondContact O-N 3.41Å; V20-G24 PolarHBondContact O-N 2.77Å
21	K	68.2	Low	66.1	Low	140 Å²	140	84.5 Å²	84.5	61%	0.609	43%	0.429	S	S	*	.	H	α-helix	trans	-63.1	-41.3	176.4	-174.1	179.3	-179.7	-179.8	0	112.2	N17 K18 M19 G24 K25	N17-K21 WeakPolarHBondContact O-CB 3.37Å; N17-K21 PolarHBondContact O-N 3.35Å; N17-K21 VanDerWaalsContact O-N 3.09Å; K18-K21 PolarHBondContact O-N 3.32Å; M19-K21 VanDerWaalsContact C-N 3.31Å; M19-K21 PolarHBondContact O-N 2.76Å; K21-G24 PolarHBondContact O-N 2.81Å; K21-K25 PolarHBondContact O-N 2.99Å
22	Y	61.2	Low	65.8	Low	43 Å²	43	83 Å²	83	17%	0.169	42%	0.424	C	S	.	.	H	α-helix	trans	-68.3	-40.5	177.5	-64.5	-42.5	0	0	0	112.6	K18 M19 V20 G24 K25 L26 L68 L72	K18-Y22 HydrophobicContact CB-CE2 4.27Å; K18-Y22 WeakPolarHBondContact O-CD2 3.45Å; K18-Y22 PolarHBondContact O-N 2.96Å; M19-Y22 PolarHBondContact O-N 3Å; V20-Y22 PolarHBondContact O-N 3.22Å; Y22-G24 VanDerWaalsContact C-N 3.33Å; Y22-G24 PolarHBondContact O-N 3.29Å; Y22-K25 PolarHBondContact O-N 2.87Å; Y22-L26 WeakPolarHBondContact O-CG 3.44Å; Y22-L26 PolarHBondContact O-N 3.05Å; Y22-L68 HydrophobicContact CD1-CD1 3.62Å; Y22-L68 HydrophobicContact CE1-CD1 4.05Å; Y22-L72 HydrophobicContact CD1-CG 4.39Å; Y22-L72 HydrophobicContact CD2-CD2 3.51Å; Y22-L72 HydrophobicContact CD2-CG 3.98Å; Y22-L72 HydrophobicContact CE2-CD2 4.31Å; Y22-L72 HydrophobicContact CG-CD1 4.47Å; Y22-L72 HydrophobicContact CG-CD2 3.73Å; Y22-L72 HydrophobicContact CG-CG 3.89Å
23	L	66.2	Low	65.6	Low	111 Å²	111	81.5 Å²	81.5	58%	0.581	41%	0.412	S	S	*	.	H	α-helix	trans	-58.1	-44.3	172.8	-101.4	143.8	0	0	0	111.9	M19 V20 K25 L26 V27	M19-L23 PolarHBondContact O-N 2.81Å; V20-L23 PolarHBondContact O-N 3.41Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 3.35Å; L23-L26 PolarHBondContact O-N 3.44Å; L23-V27 WeakPolarHBondContact O-CG2 3.24Å; L23-V27 PolarHBondContact O-N 3.37Å; L23-V27 VanDerWaalsContact O-N 3.1Å
24	G	71.6	Confident	65.7	Low	39 Å²	39	83.1 Å²	83.1	40%	0.402	42%	0.418	S	S	.	.	H	α-helix	trans	-59.6	-41.5	176.4	0	0	0	0	0	113.3	V20 K21 Y22 I28	V20-G24 PolarHBondContact O-N 2.77Å; K21-G24 PolarHBondContact O-N 2.81Å; Y22-G24 VanDerWaalsContact C-N 3.33Å; Y22-G24 PolarHBondContact O-N 3.29Å; G24-I28 PolarHBondContact O-N 3.29Å
25	K	63.5	Low	65.3	Low	89 Å²	89	84.5 Å²	84.5	39%	0.387	42%	0.423	S	S	.	.	H	α-helix	trans	-68.9	-40.5	176.5	-71.8	-171.7	169.3	-159.3	0	112.9	K21 Y22 L23 V27 I28 Y29 L68	K21-K25 PolarHBondContact O-N 2.99Å; Y22-K25 PolarHBondContact O-N 2.87Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 3.35Å; K25-V27 VanDerWaalsContact C-N 3.29Å; K25-V27 PolarHBondContact O-N 3.43Å; K25-I28 PolarHBondContact O-N 3.33Å; K25-Y29 HydrophobicContact CB-CE2 4.35Å; K25-Y29 VanDerWaalsContact O-CD2 3.22Å; K25-Y29 WeakPolarHBondContact O-CD2 3.17Å; K25-Y29 PolarHBondContact O-N 2.73Å; K25-Y29 VanDerWaalsContact O-N 3.08Å; K25-L68 HydrophobicContact CB-CD2 3.72Å; K25-L68 HydrophobicContact CD-CD1 4.05Å; K25-L68 HydrophobicContact CD-CD2 4.38Å
26	L	61.5	Low	65.2	Low	43 Å²	43	83 Å²	83	23%	0.225	42%	0.417	C	S	.	.	H	α-helix	trans	-60.5	-38.5	177.3	-81.6	164.4	0	0	0	112.1	Y22 L23 L30 F65 L68 L72	Y22-L26 WeakPolarHBondContact O-CG 3.44Å; Y22-L26 PolarHBondContact O-N 3.05Å; L23-L26 PolarHBondContact O-N 3.44Å; L26-L30 WeakPolarHBondContact O-CB 3.46Å; L26-L30 WeakPolarHBondContact O-CG 3.32Å; L26-L30 PolarHBondContact O-N 3.05Å; L26-F65 HydrophobicContact CD2-CE2 3.94Å; L26-L68 HydrophobicContact CG-CD2 4.38Å; L26-L72 HydrophobicContact CD1-CD1 3.8Å; L26-L72 HydrophobicContact CG-CD1 4.29Å
27	V	72.6	Confident	65.1	Low	93 Å²	93	83.7 Å²	83.7	56%	0.564	42%	0.422	S	S	*	.	H	α-helix	trans	-65.3	-40	177.3	172.1	0	0	0	0	111.8	L23 K25 E31	L23-V27 WeakPolarHBondContact O-CG2 3.24Å; L23-V27 PolarHBondContact O-N 3.37Å; L23-V27 VanDerWaalsContact O-N 3.1Å; K25-V27 VanDerWaalsContact C-N 3.29Å; K25-V27 PolarHBondContact O-N 3.43Å; V27-E31 PolarHBondContact O-N 2.93Å
28	I	68.4	Low	64.9	Low	103 Å²	103	81.6 Å²	81.6	53%	0.528	42%	0.418	S	S	.	.	H	α-helix	trans	-64.4	-50.9	177	-65.4	167.7	0	0	0	110	G24 K25 L30 E31 D32	G24-I28 PolarHBondContact O-N 3.29Å; K25-I28 PolarHBondContact O-N 3.33Å; I28-L30 VanDerWaalsContact C-N 3.28Å; I28-L30 PolarHBondContact O-N 2.87Å; I28-E31 WeakPolarHBondContact O-CB 3.29Å; I28-E31 PolarHBondContact O-N 2.77Å; I28-D32 PolarHBondContact O-N 3.38Å
29	Y	61.3	Low	64.5	Low	35 Å²	35	83.9 Å²	83.9	14%	0.137	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-31.7	-179.9	-67.6	-48.9	0	0	0	113.4	K25 E31 D32 L33 E64 F65 L68	K25-Y29 HydrophobicContact CB-CE2 4.35Å; K25-Y29 VanDerWaalsContact O-CD2 3.22Å; K25-Y29 WeakPolarHBondContact O-CD2 3.17Å; K25-Y29 PolarHBondContact O-N 2.73Å; K25-Y29 VanDerWaalsContact O-N 3.08Å; Y29-E31 VanDerWaalsContact C-N 3.29Å; Y29-E31 PolarHBondContact O-N 3.3Å; Y29-D32 PolarHBondContact O-N 2.96Å; Y29-L33 WeakPolarHBondContact O-CB 3.45Å; Y29-L33 VanDerWaalsContact O-CG 3.31Å; Y29-L33 WeakPolarHBondContact O-CG 3.47Å; Y29-L33 PolarHBondContact O-N 3.28Å; Y29-E64 PolarHBondContact OH-OE2 3.13Å; Y29-E64 VanDerWaalsContact OH-OE2 3.07Å; Y29-F65 AromaticContact CD2-CD2 3.69Å; Y29-F65 HydrophobicContact CD2-CD2 3.69Å; Y29-F65 HydrophobicContact CD2-CE2 4.27Å; Y29-F65 HydrophobicContact CE2-CD2 4.45Å; Y29-F65 AromaticContact CG-CD2 3.89Å; Y29-F65 HydrophobicContact CG-CD2 3.89Å; Y29-F65 HydrophobicContact CG-CE2 4.41Å; Y29-L68 HydrophobicContact CD2-CD2 3.86Å; Y29-L68 HydrophobicContact CE2-CD2 3.72Å
30	L	66.2	Low	64.4	Low	98 Å²	98	82.3 Å²	82.3	51%	0.513	42%	0.418	S	S	.	.	H	α-helix	trans	-64.6	-34.1	172.3	-83	167.8	0	0	0	112.6	L26 I28 K34	L26-L30 WeakPolarHBondContact O-CB 3.46Å; L26-L30 WeakPolarHBondContact O-CG 3.32Å; L26-L30 PolarHBondContact O-N 3.05Å; I28-L30 VanDerWaalsContact C-N 3.28Å; I28-L30 PolarHBondContact O-N 2.87Å; L30-K34 WeakPolarHBondContact O-CG 3.28Å; L30-K34 PolarHBondContact O-N 3.42Å
31	E	70	Confident	64	Low	99 Å²	99	81.7 Å²	81.7	46%	0.463	41%	0.414	S	S	.	.	H	α-helix	trans	-74.6	-37.9	176.6	-162.5	62.2	-163.7	0	0	111.5	V27 I28 Y29 K34 Q35	V27-E31 PolarHBondContact O-N 2.93Å; I28-E31 WeakPolarHBondContact O-CB 3.29Å; I28-E31 PolarHBondContact O-N 2.77Å; Y29-E31 VanDerWaalsContact C-N 3.29Å; Y29-E31 PolarHBondContact O-N 3.3Å; E31-K34 PolarHBondContact O-N 2.94Å; E31-K34 IonicContact OE2-NZ 3.87Å; E31-K34 PolarHBondContact OE2-NZ 2.79Å; E31-Q35 PolarHBondContact O-N 3.23Å
32	D	60.2	Low	63.5	Low	59 Å²	59	79 Å²	79	32%	0.316	41%	0.405	S	S	.	.	H	α-helix	trans	-63.2	-40.9	173.6	-63.2	-28.1	0	0	0	111.4	I28 Y29 K34 Q35 L36	I28-D32 PolarHBondContact O-N 3.38Å; Y29-D32 PolarHBondContact O-N 2.96Å; D32-K34 PolarHBondContact O-N 3.03Å; D32-Q35 PolarHBondContact O-N 3Å; D32-L36 PolarHBondContact O-N 2.85Å
33	L	60.8	Low	63.1	Low	58 Å²	58	80 Å²	80	30%	0.304	41%	0.413	S	S	.	.	H	α-helix	trans	-63	-37.6	174.8	-76.7	172	0	0	0	112.8	Y29 L36 E37 F65	Y29-L33 WeakPolarHBondContact O-CB 3.45Å; Y29-L33 VanDerWaalsContact O-CG 3.31Å; Y29-L33 WeakPolarHBondContact O-CG 3.47Å; Y29-L33 PolarHBondContact O-N 3.28Å; L33-L36 HydrophobicContact CD2-CD2 4.37Å; L33-L36 WeakPolarHBondContact O-CB 3.49Å; L33-L36 PolarHBondContact O-N 2.87Å; L33-E37 WeakPolarHBondContact O-CB 3.23Å; L33-E37 PolarHBondContact O-N 2.69Å; L33-F65 HydrophobicContact CD1-CE1 4.25Å; L33-F65 HydrophobicContact CD1-CZ 4.39Å
34	K	69	Low	62.3	Low	117 Å²	117	82.7 Å²	82.7	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-67.2	-38.5	174.2	-74.4	175	-172.6	167.7	0	112.4	L30 E31 D32 L36 E37 A38	L30-K34 WeakPolarHBondContact O-CG 3.28Å; L30-K34 PolarHBondContact O-N 3.42Å; E31-K34 PolarHBondContact O-N 2.94Å; E31-K34 IonicContact OE2-NZ 3.87Å; E31-K34 PolarHBondContact OE2-NZ 2.79Å; D32-K34 PolarHBondContact O-N 3.03Å; K34-L36 VanDerWaalsContact C-N 3.31Å; K34-E37 PolarHBondContact O-N 2.99Å; K34-A38 PolarHBondContact O-N 3.34Å
35	Q	60.4	Low	61.4	Low	97 Å²	97	85 Å²	85	45%	0.453	43%	0.433	S	S	.	.	H	α-helix	trans	-65.6	-38.2	173.9	-73.2	-169.8	21.3	0	0	111.7	E31 D32 A38 R39	E31-Q35 PolarHBondContact O-N 3.23Å; D32-Q35 PolarHBondContact O-N 3Å; Q35-A38 PolarHBondContact O-N 3.21Å; Q35-R39 WeakPolarHBondContact O-CG 3.14Å; Q35-R39 PolarHBondContact O-N 2.96Å; Q35-R39 VanDerWaalsContact O-N 3.08Å
36	L	60.7	Low	60.7	Low	36 Å²	36	82.9 Å²	82.9	19%	0.188	43%	0.429	C	S	.	.	H	α-helix	trans	-63.4	-46.7	174.4	178.4	63.7	0	0	0	111.5	D32 L33 K34 A38 R39 L40 L58	D32-L36 PolarHBondContact O-N 2.85Å; L33-L36 HydrophobicContact CD2-CD2 4.37Å; L33-L36 WeakPolarHBondContact O-CB 3.49Å; L33-L36 PolarHBondContact O-N 2.87Å; K34-L36 VanDerWaalsContact C-N 3.31Å; L36-A38 VanDerWaalsContact C-N 3.31Å; L36-A38 PolarHBondContact O-N 2.94Å; L36-R39 PolarHBondContact O-N 2.87Å; L36-R39 VanDerWaalsContact O-N 3.09Å; L36-L40 HydrophobicContact CD1-CD1 4.26Å; L36-L40 HydrophobicContact CD1-CG 4.27Å; L36-L40 HydrophobicContact CG-CD1 3.97Å; L36-L40 HydrophobicContact CG-CG 4.41Å; L36-L40 WeakPolarHBondContact O-CG 3.05Å; L36-L40 PolarHBondContact O-N 3Å; L36-L58 HydrophobicContact CD1-CD1 3.39Å; L36-L58 HydrophobicContact CD2-CD1 3.68Å; L36-L58 HydrophobicContact CG-CD1 4.12Å
37	E	61.5	Low	60.1	Low	127 Å²	127	85.9 Å²	85.9	59%	0.593	45%	0.452	S	S	*	.	H	α-helix	trans	-54.8	-48.5	175.1	-174	179.2	-173.7	0	0	110.5	L33 K34 R39 L40 T41	L33-E37 WeakPolarHBondContact O-CB 3.23Å; L33-E37 PolarHBondContact O-N 2.69Å; K34-E37 PolarHBondContact O-N 2.99Å; E37-R39 VanDerWaalsContact C-N 3.31Å; E37-R39 PolarHBondContact O-N 2.96Å; E37-L40 PolarHBondContact O-N 2.94Å; E37-L40 VanDerWaalsContact O-N 3.14Å; E37-T41 PolarHBondContact O-N 3.44Å; E37-T41 PolarHBondContact O-OG1 3.35Å
38	A	64.9	Low	58.9	Low	53 Å²	53	87.6 Å²	87.6	44%	0.438	46%	0.458	S	S	.	.	H	α-helix	trans	-58.3	-39.8	176.2	0	0	0	0	0	113	K34 Q35 L36 I42	K34-A38 PolarHBondContact O-N 3.34Å; Q35-A38 PolarHBondContact O-N 3.21Å; L36-A38 VanDerWaalsContact C-N 3.31Å; L36-A38 PolarHBondContact O-N 2.94Å; A38-I42 WeakPolarHBondContact O-CD1 3.42Å; A38-I42 VanDerWaalsContact O-CG1 3.26Å; A38-I42 WeakPolarHBondContact O-CG1 3.38Å; A38-I42 PolarHBondContact O-N 3.3Å
39	R	57.3	Low	57.6	Low	133 Å²	133	87 Å²	87	50%	0.502	46%	0.455	S	S	.	.	H	α-helix	trans	-69.3	-37.6	176.6	-69	175	-167	178.6	9.1	112.3	Q35 L36 E37 I42 L43	Q35-R39 WeakPolarHBondContact O-CG 3.14Å; Q35-R39 PolarHBondContact O-N 2.96Å; Q35-R39 VanDerWaalsContact O-N 3.08Å; L36-R39 PolarHBondContact O-N 2.87Å; L36-R39 VanDerWaalsContact O-N 3.09Å; E37-R39 VanDerWaalsContact C-N 3.31Å; E37-R39 PolarHBondContact O-N 2.96Å; R39-I42 PolarHBondContact O-N 3.24Å; R39-L43 PolarHBondContact O-N 3.27Å
40	L	57.2	Low	57	Low	67 Å²	67	94.9 Å²	94.9	35%	0.351	49%	0.486	S	S	.	.	H	α-helix	trans	-69.6	-36.5	176.1	-70.3	172.1	0	0	0	111.9	L36 E37 I42 L43 E44	L36-L40 HydrophobicContact CD1-CD1 4.26Å; L36-L40 HydrophobicContact CD1-CG 4.27Å; L36-L40 HydrophobicContact CG-CD1 3.97Å; L36-L40 HydrophobicContact CG-CG 4.41Å; L36-L40 WeakPolarHBondContact O-CG 3.05Å; L36-L40 PolarHBondContact O-N 3Å; E37-L40 PolarHBondContact O-N 2.94Å; E37-L40 VanDerWaalsContact O-N 3.14Å; L40-I42 VanDerWaalsContact C-N 3.32Å; L40-I42 PolarHBondContact O-N 3.45Å; L40-L43 WeakPolarHBondContact O-CA 3.46Å; L40-L43 VanDerWaalsContact O-CB 3.23Å; L40-L43 WeakPolarHBondContact O-CB 3.38Å; L40-L43 PolarHBondContact O-N 2.88Å; L40-L43 VanDerWaalsContact O-N 3.11Å; L40-E44 PolarHBondContact O-N 2.79Å
41	T	60.6	Low	56.1	Low	76 Å²	76	92.5 Å²	92.5	47%	0.466	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-33.9	174.3	-50.2	0	0	0	0	112.2	E37 L43 E44 S45	E37-T41 PolarHBondContact O-N 3.44Å; E37-T41 PolarHBondContact O-OG1 3.35Å; T41-L43 VanDerWaalsContact C-N 3.32Å; T41-E44 PolarHBondContact O-N 2.81Å; T41-S45 WeakPolarHBondContact O-CB 3.23Å; T41-S45 PolarHBondContact O-N 2.85Å; T41-S45 VanDerWaalsContact O-N 3.12Å; T41-S45 PolarHBondContact O-OG 3.04Å
42	I	58.2	Low	54.9	Low	83 Å²	83	95.2 Å²	95.2	43%	0.426	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-39.6	171.1	-61.9	163	0	0	0	110.1	A38 R39 L40 E44 S45 S46 I51	A38-I42 WeakPolarHBondContact O-CD1 3.42Å; A38-I42 VanDerWaalsContact O-CG1 3.26Å; A38-I42 WeakPolarHBondContact O-CG1 3.38Å; A38-I42 PolarHBondContact O-N 3.3Å; R39-I42 PolarHBondContact O-N 3.24Å; L40-I42 VanDerWaalsContact C-N 3.32Å; L40-I42 PolarHBondContact O-N 3.45Å; I42-E44 PolarHBondContact O-N 3.14Å; I42-S45 WeakPolarHBondContact CA-OG 3.36Å; I42-S45 PolarHBondContact O-N 3.15Å; I42-S45 PolarHBondContact O-OG 3.39Å; I42-S46 PolarHBondContact O-N 2.82Å; I42-I51 HydrophobicContact CB-CD1 3.9Å; I42-I51 HydrophobicContact CG2-CD1 3.63Å
43	L	53.1	Low	54.5	Low	64 Å²	64	94 Å²	94	34%	0.335	48%	0.477	S	S	.	.	H	α-helix	trans	-62.7	-38.5	176.4	-155.1	92.7	0	0	0	112.9	R39 L40 T41 I51 L53	R39-L43 PolarHBondContact O-N 3.27Å; L40-L43 WeakPolarHBondContact O-CA 3.46Å; L40-L43 VanDerWaalsContact O-CB 3.23Å; L40-L43 WeakPolarHBondContact O-CB 3.38Å; L40-L43 PolarHBondContact O-N 2.88Å; L40-L43 VanDerWaalsContact O-N 3.11Å; T41-L43 VanDerWaalsContact C-N 3.32Å; L43-I51 HydrophobicContact CD1-CD1 4.34Å; L43-L53 HydrophobicContact CD1-CD1 3.95Å; L43-L53 HydrophobicContact CD2-CD1 4.42Å
44	E	50.4	Low	54.1	Low	168 Å²	168	94.9 Å²	94.9	79%	0.785	48%	0.482	S	S	*	.	H	α-helix	trans	-73.3	-29.1	177	-75.4	-172.8	155	0	0	113.4	L40 T41 I42	L40-E44 PolarHBondContact O-N 2.79Å; T41-E44 PolarHBondContact O-N 2.81Å; I42-E44 PolarHBondContact O-N 3.14Å
45	S	52.4	Low	53.3	Low	88 Å²	88	90.9 Å²	90.9	62%	0.615	47%	0.465	S	S	*	.	H	α-helix	trans	-91.5	-25.8	-177.2	50.8	0	0	0	0	114.1	T41 I42	T41-S45 WeakPolarHBondContact O-CB 3.23Å; T41-S45 PolarHBondContact O-N 2.85Å; T41-S45 VanDerWaalsContact O-N 3.12Å; T41-S45 PolarHBondContact O-OG 3.04Å; I42-S45 WeakPolarHBondContact CA-OG 3.36Å; I42-S45 PolarHBondContact O-N 3.15Å; I42-S45 PolarHBondContact O-OG 3.39Å
46	S	49.1	Very low	52.8	Low	44 Å²	44	90.8 Å²	90.8	31%	0.308	46%	0.464	S	S	.	.			trans	-136.6	83.1	174.7	-74.1	0	0	0	0	111	I42 D48 D49	I42-S46 PolarHBondContact O-N 2.82Å; S46-D48 PolarHBondContact O-N 2.86Å; S46-D48 VanDerWaalsContact O-N 3.08Å; S46-D49 WeakPolarHBondContact CB-OD2 3.24Å; S46-D49 PolarHBondContact O-N 2.66Å; S46-D49 PolarHBondContact OG-OD2 2.81Å
47	P	48.8	Very low	52.3	Low	106 Å²	106	94 Å²	94	69%	0.688	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.8	-179.8	-20.9	32.4	0	0	0	114.5
48	D	45.7	Very low	51.9	Low	129 Å²	129	89 Å²	89	69%	0.69	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-7.4	-177	-66.7	-44.6	0	0	0	113.6	S46	S46-D48 PolarHBondContact O-N 2.86Å; S46-D48 VanDerWaalsContact O-N 3.08Å
49	D	43	Very low	51.5	Low	89 Å²	89	88.2 Å²	88.2	48%	0.476	44%	0.442	S	S	.	.	S	Bend	trans	-84.9	117.8	177.4	-78.4	-33	0	0	0	110.3	S46 I51	S46-D49 WeakPolarHBondContact CB-OD2 3.24Å; S46-D49 PolarHBondContact O-N 2.66Å; S46-D49 PolarHBondContact OG-OD2 2.81Å; D49-I51 PolarHBondContact O-N 3.06Å
50	Y	46.7	Very low	51.3	Low	201 Å²	201	86.2 Å²	86.2	79%	0.788	44%	0.441	S	S	*	.			trans	-62.4	102.5	178.6	177	-99.3	0	0	0	111.2	K52	Y50-K52 HydrophobicContact CE1-CB 4.04Å
51	I	47.6	Very low	51.2	Low	48 Å²	48	86.5 Å²	86.5	25%	0.246	44%	0.44	C	S	.	.			trans	-104.7	113.6	164.7	-53.6	176.7	0	0	0	107.3	I42 L43 D49 L53	I42-I51 HydrophobicContact CB-CD1 3.9Å; I42-I51 HydrophobicContact CG2-CD1 3.63Å; L43-I51 HydrophobicContact CD1-CD1 4.34Å; D49-I51 PolarHBondContact O-N 3.06Å; I51-L53 VanDerWaalsContact C-N 3.32Å; I51-L53 HydrophobicContact CG2-CG 4.42Å; I51-L53 PolarHBondContact O-N 3.49Å
52	K	45.2	Very low	51.1	Low	157 Å²	157	83.4 Å²	83.4	68%	0.683	42%	0.421	S	S	*	.			trans	-68.7	92.3	169.4	-173	-175.8	175.7	-169.2	0	108.7	Y50 D54	Y50-K52 HydrophobicContact CE1-CB 4.04Å; K52-D54 PolarHBondContact O-N 2.89Å
53	L	51.6	Low	51.1	Low	33 Å²	33	86.8 Å²	86.8	17%	0.173	43%	0.428	C	S	.	.			trans	-73.6	118	167.8	-77.8	157	0	0	0	108.6	L43 I51 F55	L43-L53 HydrophobicContact CD1-CD1 3.95Å; L43-L53 HydrophobicContact CD2-CD1 4.42Å; I51-L53 VanDerWaalsContact C-N 3.32Å; I51-L53 HydrophobicContact CG2-CG 4.42Å; I51-L53 PolarHBondContact O-N 3.49Å; L53-F55 VanDerWaalsContact C-N 3.34Å; L53-F55 HydrophobicContact CB-CD1 4.45Å; L53-F55 HydrophobicContact CB-CD2 4.18Å; L53-F55 HydrophobicContact CB-CE1 4.02Å; L53-F55 HydrophobicContact CB-CE2 3.7Å; L53-F55 HydrophobicContact CB-CZ 3.62Å; L53-F55 HydrophobicContact CD1-CE1 4.23Å; L53-F55 HydrophobicContact CD1-CZ 3.82Å; L53-F55 HydrophobicContact CG-CZ 4.34Å; L53-F55 WeakPolarHBondContact O-CD2 3.33Å; L53-F55 PolarHBondContact O-N 2.82Å
54	D	52.4	Low	51.3	Low	76 Å²	76	88.5 Å²	88.5	41%	0.406	44%	0.435	S	S	.	.			trans	-86.3	78.4	174.9	-160.9	-26.4	0	0	0	109.1	K52 E56 M57 L58	K52-D54 PolarHBondContact O-N 2.89Å; D54-E56 PolarHBondContact O-N 2.89Å; D54-E56 VanDerWaalsContact O-N 3.15Å; D54-M57 HydrophobicContact CB-CB 3.91Å; D54-M57 WeakPolarHBondContact O-CB 3.32Å; D54-M57 PolarHBondContact O-N 2.94Å; D54-M57 VanDerWaalsContact O-N 3.07Å; D54-M57 PolarHBondContact OD1-N 2.77Å; D54-L58 PolarHBondContact O-N 2.89Å
55	F	53.6	Low	51.6	Low	33 Å²	33	81.3 Å²	81.3	15%	0.145	40%	0.401	C	S	.	.	H	α-helix	trans	-58.4	-25.8	-175.6	-65.7	-74.4	0	0	0	113.2	L53 R59 V97 E101	L53-F55 VanDerWaalsContact C-N 3.34Å; L53-F55 HydrophobicContact CB-CD1 4.45Å; L53-F55 HydrophobicContact CB-CD2 4.18Å; L53-F55 HydrophobicContact CB-CE1 4.02Å; L53-F55 HydrophobicContact CB-CE2 3.7Å; L53-F55 HydrophobicContact CB-CZ 3.62Å; L53-F55 HydrophobicContact CD1-CE1 4.23Å; L53-F55 HydrophobicContact CD1-CZ 3.82Å; L53-F55 HydrophobicContact CG-CZ 4.34Å; L53-F55 WeakPolarHBondContact O-CD2 3.33Å; L53-F55 PolarHBondContact O-N 2.82Å; F55-R59 WeakPolarHBondContact O-CB 3.11Å; F55-R59 PolarHBondContact O-N 2.91Å; F55-V97 HydrophobicContact CD1-CG1 4.1Å; F55-E101 HydrophobicContact CD2-CG 4.47Å; F55-E101 HydrophobicContact CG-CB 4.48Å
56	E	49.2	Very low	51.9	Low	96 Å²	96	78.8 Å²	78.8	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-73.7	-41.7	174.6	-72.3	-64.7	172.1	0	0	112.1	D54 L58 R59 I60	D54-E56 PolarHBondContact O-N 2.89Å; D54-E56 VanDerWaalsContact O-N 3.15Å; E56-L58 VanDerWaalsContact C-N 3.32Å; E56-L58 PolarHBondContact O-N 3.22Å; E56-R59 PolarHBondContact O-N 3.31Å; E56-R59 IonicContact OE1-CZ 3.63Å; E56-R59 IonicContact OE1-NH1 3.45Å; E56-R59 PolarHBondContact OE1-NH1 3.47Å; E56-R59 IonicContact OE2-CZ 2.74Å; E56-R59 IonicContact OE2-NH1 3.57Å; E56-R59 PolarHBondContact OE2-NH1 3.27Å; E56-I60 VanDerWaalsContact O-CG1 3.32Å; E56-I60 WeakPolarHBondContact O-CG1 3.28Å; E56-I60 PolarHBondContact O-N 2.86Å
57	M	49.3	Very low	52.6	Low	102 Å²	102	78.8 Å²	78.8	50%	0.502	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-43.8	173.4	-166.2	175.7	-64.5	0	0	110.9	D54 R59 I60 E61	D54-M57 HydrophobicContact CB-CB 3.91Å; D54-M57 WeakPolarHBondContact O-CB 3.32Å; D54-M57 PolarHBondContact O-N 2.94Å; D54-M57 VanDerWaalsContact O-N 3.07Å; D54-M57 PolarHBondContact OD1-N 2.77Å; M57-R59 VanDerWaalsContact C-N 3.33Å; M57-R59 PolarHBondContact O-N 3.38Å; M57-I60 WeakPolarHBondContact O-CB 3.45Å; M57-I60 PolarHBondContact O-N 3.16Å; M57-E61 WeakPolarHBondContact O-CG 3.35Å; M57-E61 PolarHBondContact O-N 2.96Å
58	L	53.5	Low	53.1	Low	22 Å²	22	74 Å²	74	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-40.1	176.5	-157.8	91.8	0	0	0	112.8	L36 D54 E56 I60 E61 L62 V97	L36-L58 HydrophobicContact CD1-CD1 3.39Å; L36-L58 HydrophobicContact CD2-CD1 3.68Å; L36-L58 HydrophobicContact CG-CD1 4.12Å; D54-L58 PolarHBondContact O-N 2.89Å; E56-L58 VanDerWaalsContact C-N 3.32Å; E56-L58 PolarHBondContact O-N 3.22Å; L58-I60 VanDerWaalsContact C-N 3.34Å; L58-E61 PolarHBondContact O-N 2.99Å; L58-L62 HydrophobicContact CD2-CD1 4.23Å; L58-L62 HydrophobicContact CG-CD1 4.37Å; L58-L62 WeakPolarHBondContact O-CB 3.41Å; L58-L62 VanDerWaalsContact O-CG 3.3Å; L58-L62 WeakPolarHBondContact O-CG 3.14Å; L58-L62 PolarHBondContact O-N 3.39Å; L58-V97 HydrophobicContact CD2-CB 4.22Å; L58-V97 HydrophobicContact CD2-CG1 3.7Å; L58-V97 HydrophobicContact CD2-CG2 3.41Å; L58-V97 VanDerWaalsContact CD2-CG2 3.41Å
59	R	57.2	Low	54	Low	38 Å²	38	68 Å²	68	14%	0.143	32%	0.319	C	S	.	.	H	α-helix	trans	-67.3	-36.7	177.6	-173.8	-176.8	-70.5	144.7	-0.1	111.6	F55 E56 M57 R63 N98 E101	F55-R59 WeakPolarHBondContact O-CB 3.11Å; F55-R59 PolarHBondContact O-N 2.91Å; E56-R59 PolarHBondContact O-N 3.31Å; E56-R59 IonicContact OE1-CZ 3.63Å; E56-R59 IonicContact OE1-NH1 3.45Å; E56-R59 PolarHBondContact OE1-NH1 3.47Å; E56-R59 IonicContact OE2-CZ 2.74Å; E56-R59 IonicContact OE2-NH1 3.57Å; E56-R59 PolarHBondContact OE2-NH1 3.27Å; M57-R59 VanDerWaalsContact C-N 3.33Å; M57-R59 PolarHBondContact O-N 3.38Å; R59-R63 WeakPolarHBondContact O-CB 3.02Å; R59-R63 WeakPolarHBondContact O-CG 3.39Å; R59-R63 PolarHBondContact O-N 2.77Å; R59-R63 VanDerWaalsContact O-N 3.09Å; R59-N98 PolarHBondContact NE-OD1 2.82Å; R59-N98 PolarHBondContact NH2-OD1 3.01Å; R59-E101 IonicContact CZ-OE2 3.98Å; R59-E101 IonicContact NH2-OE2 3.34Å; R59-E101 PolarHBondContact NH2-OE2 3.43Å
60	I	53.5	Low	55	Low	90 Å²	90	66 Å²	66	46%	0.462	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-48.8	174.5	-68.5	165.5	0	0	0	109.5	E56 M57 L58 L62 R63 E64	E56-I60 VanDerWaalsContact O-CG1 3.32Å; E56-I60 WeakPolarHBondContact O-CG1 3.28Å; E56-I60 PolarHBondContact O-N 2.86Å; M57-I60 WeakPolarHBondContact O-CB 3.45Å; M57-I60 PolarHBondContact O-N 3.16Å; L58-I60 VanDerWaalsContact C-N 3.34Å; I60-L62 PolarHBondContact O-N 2.82Å; I60-R63 PolarHBondContact O-N 3.41Å; I60-E64 WeakPolarHBondContact O-CG 3.43Å; I60-E64 PolarHBondContact O-N 2.58Å
61	E	55.4	Low	55.7	Low	73 Å²	73	61.4 Å²	61.4	34%	0.341	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-45.5	179	-71.2	168.9	-178.5	0	0	112.5	M57 L58 R63 E64 F65	M57-E61 WeakPolarHBondContact O-CG 3.35Å; M57-E61 PolarHBondContact O-N 2.96Å; L58-E61 PolarHBondContact O-N 2.99Å; E61-R63 PolarHBondContact O-N 3.4Å; E61-E64 PolarHBondContact O-N 2.79Å; E61-F65 WeakPolarHBondContact O-CB 3.19Å; E61-F65 PolarHBondContact O-N 3.5Å
62	L	57.4	Low	56.4	Low	12 Å²	12	59.7 Å²	59.7	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-38.8	176.8	-73.3	171.3	0	0	0	112.5	L58 I60 F65 E66 I90 V97	L58-L62 HydrophobicContact CD2-CD1 4.23Å; L58-L62 HydrophobicContact CG-CD1 4.37Å; L58-L62 WeakPolarHBondContact O-CB 3.41Å; L58-L62 VanDerWaalsContact O-CG 3.3Å; L58-L62 WeakPolarHBondContact O-CG 3.14Å; L58-L62 PolarHBondContact O-N 3.39Å; I60-L62 PolarHBondContact O-N 2.82Å; L62-F65 PolarHBondContact O-N 2.76Å; L62-E66 WeakPolarHBondContact O-CB 3.36Å; L62-E66 PolarHBondContact O-N 2.94Å; L62-I90 HydrophobicContact CD2-CG2 4.39Å; L62-V97 HydrophobicContact CD1-CG2 4.13Å
63	R	57.7	Low	57.2	Low	154 Å²	154	55.4 Å²	55.4	58%	0.581	27%	0.27	S	S	*	.	H	α-helix	trans	-67.1	-40.1	175.2	-78.1	174.5	176.5	174.4	1.5	112.3	R59 I60 E61 F65 A67	R59-R63 WeakPolarHBondContact O-CB 3.02Å; R59-R63 WeakPolarHBondContact O-CG 3.39Å; R59-R63 PolarHBondContact O-N 2.77Å; R59-R63 VanDerWaalsContact O-N 3.09Å; I60-R63 PolarHBondContact O-N 3.41Å; E61-R63 PolarHBondContact O-N 3.4Å; R63-F65 VanDerWaalsContact C-N 3.32Å; R63-A67 WeakPolarHBondContact O-CB 3.47Å; R63-A67 PolarHBondContact O-N 2.84Å
64	E	57.5	Low	57.8	Low	100 Å²	100	59 Å²	59	47%	0.467	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-38.9	175.4	-72.9	-172.8	174.6	0	0	111.6	Y29 I60 E61 A67 L68	Y29-E64 PolarHBondContact OH-OE2 3.13Å; Y29-E64 VanDerWaalsContact OH-OE2 3.07Å; I60-E64 WeakPolarHBondContact O-CG 3.43Å; I60-E64 PolarHBondContact O-N 2.58Å; E61-E64 PolarHBondContact O-N 2.79Å; E64-A67 PolarHBondContact O-N 2.86Å; E64-L68 WeakPolarHBondContact O-CB 3.5Å; E64-L68 PolarHBondContact O-N 3.39Å
65	F	57	Low	58.1	Low	17 Å²	17	57.7 Å²	57.7	8%	0.075	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-44.5	176.3	-168.1	-127.7	0	0	0	112.1	L26 Y29 L33 E61 L62 R63 A67 L68 V69 I90	L26-F65 HydrophobicContact CD2-CE2 3.94Å; Y29-F65 AromaticContact CD2-CD2 3.69Å; Y29-F65 HydrophobicContact CD2-CD2 3.69Å; Y29-F65 HydrophobicContact CD2-CE2 4.27Å; Y29-F65 HydrophobicContact CE2-CD2 4.45Å; Y29-F65 AromaticContact CG-CD2 3.89Å; Y29-F65 HydrophobicContact CG-CD2 3.89Å; Y29-F65 HydrophobicContact CG-CE2 4.41Å; L33-F65 HydrophobicContact CD1-CE1 4.25Å; L33-F65 HydrophobicContact CD1-CZ 4.39Å; E61-F65 WeakPolarHBondContact O-CB 3.19Å; E61-F65 PolarHBondContact O-N 3.5Å; L62-F65 PolarHBondContact O-N 2.76Å; R63-F65 VanDerWaalsContact C-N 3.32Å; F65-A67 PolarHBondContact O-N 2.65Å; F65-L68 PolarHBondContact O-N 3.23Å; F65-V69 HydrophobicContact CE2-CG2 4.49Å; F65-V69 HydrophobicContact CZ-CG2 4.47Å; F65-V69 WeakPolarHBondContact O-CG2 3.42Å; F65-V69 PolarHBondContact O-N 2.93Å; F65-I90 HydrophobicContact CD1-CD1 3.29Å; F65-I90 HydrophobicContact CD1-CG1 3.66Å; F65-I90 HydrophobicContact CD1-CG2 4.3Å; F65-I90 HydrophobicContact CE1-CD1 3.31Å; F65-I90 HydrophobicContact CE1-CG1 3.7Å; F65-I90 HydrophobicContact CG-CD1 4.27Å; F65-I90 HydrophobicContact CZ-CD1 4.29Å
66	E	59.7	Low	58.4	Low	34 Å²	34	59 Å²	59	16%	0.159	29%	0.294	C	S	.	.	H	α-helix	trans	-58.3	-46.3	173.8	-172.8	-178.2	173.9	0	0	111.4	L62 L68 V69 S70 Y87 I90	L62-E66 WeakPolarHBondContact O-CB 3.36Å; L62-E66 PolarHBondContact O-N 2.94Å; E66-L68 VanDerWaalsContact C-N 3.34Å; E66-L68 PolarHBondContact O-N 2.9Å; E66-V69 PolarHBondContact O-N 2.86Å; E66-S70 PolarHBondContact O-N 2.85Å; E66-Y87 HydrophobicContact CG-CD2 3.93Å; E66-Y87 HydrophobicContact CG-CE2 3.38Å; E66-Y87 VanDerWaalsContact OE1-CE2 3.25Å; E66-Y87 WeakPolarHBondContact OE1-CE2 3.47Å; E66-Y87 PolarHBondContact OE1-OH 2.95Å; E66-I90 HydrophobicContact CB-CG2 4.11Å
67	A	62.3	Low	58.8	Low	45 Å²	45	61.9 Å²	61.9	37%	0.372	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-39.7	177.8	0	0	0	0	0	112.3	R63 E64 F65 S70 Q71	R63-A67 WeakPolarHBondContact O-CB 3.47Å; R63-A67 PolarHBondContact O-N 2.84Å; E64-A67 PolarHBondContact O-N 2.86Å; F65-A67 PolarHBondContact O-N 2.65Å; A67-S70 PolarHBondContact O-N 2.95Å; A67-Q71 WeakPolarHBondContact O-CB 3.1Å; A67-Q71 VanDerWaalsContact O-CG 3.29Å; A67-Q71 WeakPolarHBondContact O-CG 3.39Å; A67-Q71 PolarHBondContact O-N 2.9Å
68	L	60.4	Low	59.1	Low	6 Å²	6	58.7 Å²	58.7	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-44.8	177.2	-177.7	67.6	0	0	0	111.8	Y22 K25 L26 Y29 E64 F65 E66 S70 Q71 L72	Y22-L68 HydrophobicContact CD1-CD1 3.62Å; Y22-L68 HydrophobicContact CE1-CD1 4.05Å; K25-L68 HydrophobicContact CB-CD2 3.72Å; K25-L68 HydrophobicContact CD-CD1 4.05Å; K25-L68 HydrophobicContact CD-CD2 4.38Å; L26-L68 HydrophobicContact CG-CD2 4.38Å; Y29-L68 HydrophobicContact CD2-CD2 3.86Å; Y29-L68 HydrophobicContact CE2-CD2 3.72Å; E64-L68 WeakPolarHBondContact O-CB 3.5Å; E64-L68 PolarHBondContact O-N 3.39Å; F65-L68 PolarHBondContact O-N 3.23Å; E66-L68 VanDerWaalsContact C-N 3.34Å; E66-L68 PolarHBondContact O-N 2.9Å; L68-S70 VanDerWaalsContact C-N 3.33Å; L68-S70 PolarHBondContact O-N 3.45Å; L68-Q71 PolarHBondContact O-N 3.32Å; L68-L72 HydrophobicContact CG-CD1 4.1Å; L68-L72 WeakPolarHBondContact O-CB 3.48Å; L68-L72 PolarHBondContact O-N 3.08Å
69	V	63.3	Low	59.1	Low	3 Å²	3	63 Å²	63	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-40.1	178.2	172.2	0	0	0	0	110.9	F65 E66 L72 K73 L86 I90	F65-V69 HydrophobicContact CE2-CG2 4.49Å; F65-V69 HydrophobicContact CZ-CG2 4.47Å; F65-V69 WeakPolarHBondContact O-CG2 3.42Å; F65-V69 PolarHBondContact O-N 2.93Å; E66-V69 PolarHBondContact O-N 2.86Å; V69-L72 PolarHBondContact O-N 2.99Å; V69-K73 WeakPolarHBondContact O-CB 3.48Å; V69-K73 PolarHBondContact O-N 2.77Å; V69-L86 HydrophobicContact CG1-CD2 4.29Å; V69-L86 HydrophobicContact CG2-CD2 3.97Å; V69-I90 HydrophobicContact CG2-CD1 3.9Å
70	S	63.9	Low	59.1	Low	45 Å²	45	63 Å²	63	32%	0.315	34%	0.338	S	S	.	.	H	α-helix	trans	-63.9	-45.9	174.3	-164.6	0	0	0	0	112	E66 A67 L68 L72 K73 D74	E66-S70 PolarHBondContact O-N 2.85Å; A67-S70 PolarHBondContact O-N 2.95Å; L68-S70 VanDerWaalsContact C-N 3.33Å; L68-S70 PolarHBondContact O-N 3.45Å; S70-L72 VanDerWaalsContact C-N 3.34Å; S70-L72 PolarHBondContact O-N 2.8Å; S70-K73 WeakPolarHBondContact O-CB 3.15Å; S70-K73 PolarHBondContact O-N 3.36Å; S70-D74 VanDerWaalsContact O-CG 3.3Å; S70-D74 PolarHBondContact O-N 3.37Å
71	Q	62.8	Low	59.4	Low	106 Å²	106	63.7 Å²	63.7	50%	0.495	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-37.1	177.9	-74.8	175.6	11.4	0	0	112.9	A67 L68 S75	A67-Q71 WeakPolarHBondContact O-CB 3.1Å; A67-Q71 VanDerWaalsContact O-CG 3.29Å; A67-Q71 WeakPolarHBondContact O-CG 3.39Å; A67-Q71 PolarHBondContact O-N 2.9Å; L68-Q71 PolarHBondContact O-N 3.32Å; Q71-S75 WeakPolarHBondContact O-CB 3.44Å; Q71-S75 PolarHBondContact O-N 3.36Å
72	L	61.5	Low	59.5	Low	12 Å²	12	66.3 Å²	66.3	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-45.6	173.6	-93.5	159.1	0	0	0	111.7	Y22 L26 L68 V69 S70 D74 S75 L76	Y22-L72 HydrophobicContact CD1-CG 4.39Å; Y22-L72 HydrophobicContact CD2-CD2 3.51Å; Y22-L72 HydrophobicContact CD2-CG 3.98Å; Y22-L72 HydrophobicContact CE2-CD2 4.31Å; Y22-L72 HydrophobicContact CG-CD1 4.47Å; Y22-L72 HydrophobicContact CG-CD2 3.73Å; Y22-L72 HydrophobicContact CG-CG 3.89Å; L26-L72 HydrophobicContact CD1-CD1 3.8Å; L26-L72 HydrophobicContact CG-CD1 4.29Å; L68-L72 HydrophobicContact CG-CD1 4.1Å; L68-L72 WeakPolarHBondContact O-CB 3.48Å; L68-L72 PolarHBondContact O-N 3.08Å; V69-L72 PolarHBondContact O-N 2.99Å; S70-L72 VanDerWaalsContact C-N 3.34Å; S70-L72 PolarHBondContact O-N 2.8Å; L72-D74 PolarHBondContact O-N 3.35Å; L72-S75 PolarHBondContact O-N 2.85Å; L72-L76 HydrophobicContact CD2-CD1 4.22Å; L72-L76 WeakPolarHBondContact O-CB 3.44Å; L72-L76 WeakPolarHBondContact O-CD1 3.4Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3.28Å
73	K	62.9	Low	59.5	Low	67 Å²	67	67.9 Å²	67.9	29%	0.291	37%	0.371	S	S	.	.	H	α-helix	trans	-59.2	-46.7	177.1	-179.3	-177.2	166.4	-174.8	0	111.5	V69 S70 N77 N84	V69-K73 WeakPolarHBondContact O-CB 3.48Å; V69-K73 PolarHBondContact O-N 2.77Å; S70-K73 WeakPolarHBondContact O-CB 3.15Å; S70-K73 PolarHBondContact O-N 3.36Å; K73-N77 PolarHBondContact O-N 3.2Å; K73-N84 WeakPolarHBondContact CE-OD1 3.38Å; K73-N84 PolarHBondContact NZ-OD1 2.94Å
74	D	64.1	Low	59.6	Low	108 Å²	108	63.5 Å²	63.5	58%	0.578	36%	0.359	S	S	*	.	H	α-helix	trans	-68.2	-41.6	179.4	-65.2	-22.5	0	0	0	111.7	S70 L72 L76 N77	S70-D74 VanDerWaalsContact O-CG 3.3Å; S70-D74 PolarHBondContact O-N 3.37Å; L72-D74 PolarHBondContact O-N 3.35Å; D74-L76 VanDerWaalsContact C-N 3.32Å; D74-L76 PolarHBondContact O-N 2.87Å; D74-N77 PolarHBondContact O-N 3.1Å
75	S	59	Low	59.9	Low	49 Å²	49	61.3 Å²	61.3	34%	0.343	35%	0.354	S	S	.	.	H	α-helix	trans	-68.5	-27.8	179.8	-174.6	0	0	0	0	113.5	Q71 L72	Q71-S75 WeakPolarHBondContact O-CB 3.44Å; Q71-S75 PolarHBondContact O-N 3.36Å; L72-S75 PolarHBondContact O-N 2.85Å
76	L	58.8	Low	60	Low	60 Å²	60	63.1 Å²	63.1	31%	0.314	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.6	179.7	-67.4	170.3	0	0	0	112.7	M19 L72 D74 S78 F83	M19-L76 HydrophobicContact CE-CD2 3.18Å; L72-L76 HydrophobicContact CD2-CD1 4.22Å; L72-L76 WeakPolarHBondContact O-CB 3.44Å; L72-L76 WeakPolarHBondContact O-CD1 3.4Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3.28Å; D74-L76 VanDerWaalsContact C-N 3.32Å; D74-L76 PolarHBondContact O-N 2.87Å; L76-S78 PolarHBondContact O-N 2.95Å; L76-F83 HydrophobicContact CD1-CE2 3.95Å; L76-F83 HydrophobicContact CD1-CZ 4.06Å
77	N	58.1	Low	60	Low	156 Å²	156	65.7 Å²	65.7	83%	0.834	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	46	28.5	-173.2	-116.5	-0.3	0	0	0	112.5	K73 D74	K73-N77 PolarHBondContact O-N 3.2Å; D74-N77 PolarHBondContact O-N 3.1Å
78	S	54.4	Low	60.2	Low	35 Å²	35	68.2 Å²	68.2	25%	0.245	38%	0.38	C	S	.	.			trans	-102.4	116.1	-169	85	0	0	0	0	108.9	L76 S80	L76-S78 PolarHBondContact O-N 2.95Å; S78-S80 PolarHBondContact O-N 2.86Å
79	S	55.2	Low	60.4	Low	113 Å²	113	72.3 Å²	72.3	79%	0.79	40%	0.399	S	S	*	.			trans	-75.4	42.4	163.6	36.4	0	0	0	0	110.6	P81	S79-P81 WeakPolarHBondContact O-CD 3.19Å
80	S	56.7	Low	60	Low	38 Å²	38	72.3 Å²	72.3	27%	0.266	40%	0.399	S	S	.	.			trans	-67.8	121.1	179	178.3	0	0	0	0	108.7	S78 L82 F83	S78-S80 PolarHBondContact O-N 2.86Å; S80-L82 PolarHBondContact O-N 2.9Å; S80-L82 VanDerWaalsContact O-N 3.1Å; S80-L82 PolarHBondContact OG-N 2.77Å; S80-F83 PolarHBondContact O-N 2.94Å
81	P	59.3	Low	59.7	Low	105 Å²	105	74.2 Å²	74.2	68%	0.682	40%	0.402	S	S	*	.	H	α-helix	trans	-59.5	-23.2	178.4	21.1	-29.7	0	0	0	112.3	S79 N84 S85	S79-P81 WeakPolarHBondContact O-CD 3.19Å; P81-N84 PolarHBondContact O-N 3.33Å; P81-S85 PolarHBondContact O-N 3.47Å
82	L	57.9	Low	59.7	Low	127 Å²	127	73 Å²	73	67%	0.665	40%	0.399	S	S	*	.	H	α-helix	trans	-65.1	-43.7	177.3	-167.4	73.5	0	0	0	112.9	S80 N84 S85 L86	S80-L82 PolarHBondContact O-N 2.9Å; S80-L82 VanDerWaalsContact O-N 3.1Å; S80-L82 PolarHBondContact OG-N 2.77Å; L82-N84 VanDerWaalsContact C-N 3.34Å; L82-S85 PolarHBondContact O-N 2.81Å; L82-L86 PolarHBondContact O-N 3.08Å
83	F	57.3	Low	59.4	Low	46 Å²	46	77 Å²	77	20%	0.202	42%	0.419	C	S	.	.	H	α-helix	trans	-71.4	-31.5	179.2	-72.8	-60.7	0	0	0	112.2	L76 S80 Y87	L76-F83 HydrophobicContact CD1-CE2 3.95Å; L76-F83 HydrophobicContact CD1-CZ 4.06Å; S80-F83 PolarHBondContact O-N 2.94Å; F83-Y87 WeakPolarHBondContact O-CB 3.38Å; F83-Y87 PolarHBondContact O-N 3.35Å
84	N	60.7	Low	59.1	Low	61 Å²	61	74.8 Å²	74.8	33%	0.326	41%	0.411	S	S	.	.	H	α-helix	trans	-66.9	-41.3	172.6	-74	-21.9	0	0	0	111.6	K73 P81 L82 I88	K73-N84 WeakPolarHBondContact CE-OD1 3.38Å; K73-N84 PolarHBondContact NZ-OD1 2.94Å; P81-N84 PolarHBondContact O-N 3.33Å; L82-N84 VanDerWaalsContact C-N 3.34Å; N84-I88 WeakPolarHBondContact O-CD1 3.25Å; N84-I88 VanDerWaalsContact O-CG1 3.28Å; N84-I88 WeakPolarHBondContact O-CG1 3.47Å; N84-I88 PolarHBondContact O-N 3.41Å
85	S	63.8	Low	58.9	Low	54 Å²	54	73.7 Å²	73.7	38%	0.378	40%	0.404	S	S	.	.	H	α-helix	trans	-59.7	-50.3	173.8	-159.7	0	0	0	0	110.9	P81 L82 Y87 I88 E89	P81-S85 PolarHBondContact O-N 3.47Å; L82-S85 PolarHBondContact O-N 2.81Å; S85-Y87 PolarHBondContact O-N 3.27Å; S85-I88 PolarHBondContact O-N 3.24Å; S85-I88 VanDerWaalsContact O-N 3.15Å; S85-E89 WeakPolarHBondContact O-CG 3.44Å; S85-E89 PolarHBondContact O-N 2.92Å; S85-E89 PolarHBondContact OG-OE1 3.3Å
86	L	57.5	Low	58.9	Low	56 Å²	56	76 Å²	76	29%	0.293	41%	0.413	S	S	.	.	H	α-helix	trans	-60.7	-42.2	-178.3	-174.1	64.2	0	0	0	112.6	V69 L82 E89 I90	V69-L86 HydrophobicContact CG1-CD2 4.29Å; V69-L86 HydrophobicContact CG2-CD2 3.97Å; L82-L86 PolarHBondContact O-N 3.08Å; L86-E89 PolarHBondContact O-N 3.26Å; L86-I90 HydrophobicContact CD1-CD1 4.4Å; L86-I90 HydrophobicContact CG-CD1 4.02Å; L86-I90 WeakPolarHBondContact O-CD1 3.43Å; L86-I90 VanDerWaalsContact O-CG1 3.25Å; L86-I90 WeakPolarHBondContact O-CG1 3.22Å; L86-I90 PolarHBondContact O-N 3.12Å
87	Y	60.8	Low	58.9	Low	87 Å²	87	74 Å²	74	34%	0.341	40%	0.403	S	S	.	.	H	α-helix	trans	-61	-44.3	175.8	-179.3	-94.3	0	0	0	112.2	E66 F83 S85 E89 I90 H91	E66-Y87 HydrophobicContact CG-CD2 3.93Å; E66-Y87 HydrophobicContact CG-CE2 3.38Å; E66-Y87 VanDerWaalsContact OE1-CE2 3.25Å; E66-Y87 WeakPolarHBondContact OE1-CE2 3.47Å; E66-Y87 PolarHBondContact OE1-OH 2.95Å; F83-Y87 WeakPolarHBondContact O-CB 3.38Å; F83-Y87 PolarHBondContact O-N 3.35Å; S85-Y87 PolarHBondContact O-N 3.27Å; Y87-E89 VanDerWaalsContact C-N 3.35Å; Y87-I90 PolarHBondContact O-N 3.02Å; Y87-H91 WeakPolarHBondContact O-CB 3.33Å; Y87-H91 PolarHBondContact O-N 3.47Å
88	I	65.4	Low	58.7	Low	98 Å²	98	69.4 Å²	69.4	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-40.7	177.4	-68	167.4	0	0	0	110.9	N84 S85 H91 N92	N84-I88 WeakPolarHBondContact O-CD1 3.25Å; N84-I88 VanDerWaalsContact O-CG1 3.28Å; N84-I88 WeakPolarHBondContact O-CG1 3.47Å; N84-I88 PolarHBondContact O-N 3.41Å; S85-I88 PolarHBondContact O-N 3.24Å; S85-I88 VanDerWaalsContact O-N 3.15Å; I88-H91 PolarHBondContact O-N 3.44Å; I88-N92 WeakPolarHBondContact O-CB 3.47Å; I88-N92 VanDerWaalsContact O-CG 3.25Å; I88-N92 PolarHBondContact O-N 2.92Å; I88-N92 PolarHBondContact O-ND2 3.44Å
89	E	64.4	Low	58.9	Low	92 Å²	92	72.9 Å²	72.9	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-44.4	178	-73.6	163.8	-144.2	0	0	112.1	S85 L86 Y87 H91 N92 M93	S85-E89 WeakPolarHBondContact O-CG 3.44Å; S85-E89 PolarHBondContact O-N 2.92Å; S85-E89 PolarHBondContact OG-OE1 3.3Å; L86-E89 PolarHBondContact O-N 3.26Å; Y87-E89 VanDerWaalsContact C-N 3.35Å; E89-H91 PolarHBondContact O-N 2.76Å; E89-N92 PolarHBondContact O-N 3.46Å; E89-M93 WeakPolarHBondContact O-CG 3.36Å; E89-M93 PolarHBondContact O-N 2.68Å
90	I	55.1	Low	59	Low	4 Å²	4	71.8 Å²	71.8	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-40.5	176.8	-63.8	159.7	0	0	0	111.2	L62 F65 E66 V69 L86 Y87 N92 M93 T94	L62-I90 HydrophobicContact CD2-CG2 4.39Å; F65-I90 HydrophobicContact CD1-CD1 3.29Å; F65-I90 HydrophobicContact CD1-CG1 3.66Å; F65-I90 HydrophobicContact CD1-CG2 4.3Å; F65-I90 HydrophobicContact CE1-CD1 3.31Å; F65-I90 HydrophobicContact CE1-CG1 3.7Å; F65-I90 HydrophobicContact CG-CD1 4.27Å; F65-I90 HydrophobicContact CZ-CD1 4.29Å; E66-I90 HydrophobicContact CB-CG2 4.11Å; V69-I90 HydrophobicContact CG2-CD1 3.9Å; L86-I90 HydrophobicContact CD1-CD1 4.4Å; L86-I90 HydrophobicContact CG-CD1 4.02Å; L86-I90 WeakPolarHBondContact O-CD1 3.43Å; L86-I90 VanDerWaalsContact O-CG1 3.25Å; L86-I90 WeakPolarHBondContact O-CG1 3.22Å; L86-I90 PolarHBondContact O-N 3.12Å; Y87-I90 PolarHBondContact O-N 3.02Å; I90-N92 VanDerWaalsContact C-N 3.34Å; I90-N92 PolarHBondContact O-N 2.89Å; I90-M93 PolarHBondContact O-N 2.04Å; I90-T94 PolarHBondContact O-N 3.35Å; I90-T94 PolarHBondContact O-OG1 2.69Å
91	H	58.8	Low	58.8	Low	85 Å²	85	73.6 Å²	73.6	39%	0.394	38%	0.38	S	S	.	.	H	α-helix	trans	-62.9	-42	176.1	-169.6	75.7	0	0	0	111.5	Y87 I88 E89 T94 L95	Y87-H91 WeakPolarHBondContact O-CB 3.33Å; Y87-H91 PolarHBondContact O-N 3.47Å; I88-H91 PolarHBondContact O-N 3.44Å; E89-H91 PolarHBondContact O-N 2.76Å; H91-T94 WeakPolarHBondContact O-CB 3.39Å; H91-T94 PolarHBondContact O-N 2.88Å; H91-L95 WeakPolarHBondContact O-CG 3.32Å; H91-L95 PolarHBondContact O-N 3.07Å; H91-L95 VanDerWaalsContact O-N 3.1Å
92	N	61.6	Low	58.5	Low	80 Å²	80	72.9 Å²	72.9	43%	0.428	37%	0.373	S	S	.	.	H	α-helix	trans	-64.9	-39.8	175.3	-72.2	-20.6	0	0	0	112.3	I88 E89 I90 T94 L95 L96	I88-N92 WeakPolarHBondContact O-CB 3.47Å; I88-N92 VanDerWaalsContact O-CG 3.25Å; I88-N92 PolarHBondContact O-N 2.92Å; I88-N92 PolarHBondContact O-ND2 3.44Å; E89-N92 PolarHBondContact O-N 3.46Å; I90-N92 VanDerWaalsContact C-N 3.34Å; I90-N92 PolarHBondContact O-N 2.89Å; N92-T94 VanDerWaalsContact C-N 3.31Å; N92-T94 PolarHBondContact O-N 2.71Å; N92-L95 PolarHBondContact O-N 3.13Å; N92-L96 WeakPolarHBondContact O-CG 3.42Å; N92-L96 PolarHBondContact O-N 3.24Å
93	M	55.7	Low	58.3	Low	96 Å²	96	74.3 Å²	74.3	47%	0.473	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-40.5	173.1	-71.3	177.2	-178.4	0	0	111.6	E89 I90 L95 L96 V97	E89-M93 WeakPolarHBondContact O-CG 3.36Å; E89-M93 PolarHBondContact O-N 2.68Å; I90-M93 PolarHBondContact O-N 2.04Å; M93-L95 VanDerWaalsContact C-N 3.31Å; M93-L95 PolarHBondContact O-N 3.37Å; M93-L96 PolarHBondContact O-N 2.85Å; M93-V97 VanDerWaalsContact O-CG2 3.26Å; M93-V97 WeakPolarHBondContact O-CG2 3.41Å; M93-V97 PolarHBondContact O-N 2.83Å
94	T	56.5	Low	58.2	Low	21 Å²	21	76.5 Å²	76.5	13%	0.129	39%	0.385	C	S	.	.	H	α-helix	trans	-61.6	-39.1	176	-57.4	0	0	0	0	111.8	I90 H91 N92 N98	I90-T94 PolarHBondContact O-N 3.35Å; I90-T94 PolarHBondContact O-OG1 2.69Å; H91-T94 WeakPolarHBondContact O-CB 3.39Å; H91-T94 PolarHBondContact O-N 2.88Å; N92-T94 VanDerWaalsContact C-N 3.31Å; N92-T94 PolarHBondContact O-N 2.71Å; T94-N98 VanDerWaalsContact O-CG 3.26Å; T94-N98 PolarHBondContact O-N 3.37Å; T94-N98 PolarHBondContact O-ND2 3.07Å
95	L	59.5	Low	57.7	Low	84 Å²	84	81 Å²	81	44%	0.44	40%	0.402	S	S	.	.	H	α-helix	trans	-67.5	-40.8	175.5	-68.2	171.3	0	0	0	112.4	H91 N92 M93 N98 Q99	H91-L95 WeakPolarHBondContact O-CG 3.32Å; H91-L95 PolarHBondContact O-N 3.07Å; H91-L95 VanDerWaalsContact O-N 3.1Å; N92-L95 PolarHBondContact O-N 3.13Å; M93-L95 VanDerWaalsContact C-N 3.31Å; M93-L95 PolarHBondContact O-N 3.37Å; L95-N98 PolarHBondContact O-N 3.28Å; L95-Q99 WeakPolarHBondContact O-CG 3.22Å; L95-Q99 PolarHBondContact O-N 3Å; L95-Q99 VanDerWaalsContact O-N 3.1Å
96	L	59.9	Low	56.9	Low	99 Å²	99	82 Å²	82	52%	0.518	41%	0.408	S	S	.	.	H	α-helix	trans	-66.3	-39.7	177.9	-72.4	170	0	0	0	112.5	N92 M93 N98 Q99 L100	N92-L96 WeakPolarHBondContact O-CG 3.42Å; N92-L96 PolarHBondContact O-N 3.24Å; M93-L96 PolarHBondContact O-N 2.85Å; L96-N98 VanDerWaalsContact C-N 3.35Å; L96-N98 PolarHBondContact O-N 2.86Å; L96-Q99 PolarHBondContact O-N 3.36Å; L96-L100 WeakPolarHBondContact O-CG 3.32Å; L96-L100 PolarHBondContact O-N 3.13Å
97	V	57.5	Low	56.7	Low	18 Å²	18	82.2 Å²	82.2	11%	0.109	41%	0.41	C	S	.	.	H	α-helix	trans	-60.7	-44.5	174.5	168.3	0	0	0	0	111.1	F55 L58 L62 M93 Q99 L100 E101	F55-V97 HydrophobicContact CD1-CG1 4.1Å; L58-V97 HydrophobicContact CD2-CB 4.22Å; L58-V97 HydrophobicContact CD2-CG1 3.7Å; L58-V97 HydrophobicContact CD2-CG2 3.41Å; L58-V97 VanDerWaalsContact CD2-CG2 3.41Å; L62-V97 HydrophobicContact CD1-CG2 4.13Å; M93-V97 VanDerWaalsContact O-CG2 3.26Å; M93-V97 WeakPolarHBondContact O-CG2 3.41Å; M93-V97 PolarHBondContact O-N 2.83Å; V97-Q99 VanDerWaalsContact C-N 3.27Å; V97-Q99 PolarHBondContact O-N 3Å; V97-L100 PolarHBondContact O-N 3.23Å; V97-E101 PolarHBondContact O-N 3.02Å; V97-E101 VanDerWaalsContact O-N 3.1Å
98	N	55.6	Low	56.3	Low	58 Å²	58	81.7 Å²	81.7	31%	0.31	41%	0.412	S	S	.	.	H	α-helix	trans	-65.3	-30.7	177.2	-68.1	-33.5	0	0	0	112.5	R59 T94 L95 L96 T102	R59-N98 PolarHBondContact NE-OD1 2.82Å; R59-N98 PolarHBondContact NH2-OD1 3.01Å; T94-N98 VanDerWaalsContact O-CG 3.26Å; T94-N98 PolarHBondContact O-N 3.37Å; T94-N98 PolarHBondContact O-ND2 3.07Å; L95-N98 PolarHBondContact O-N 3.28Å; L96-N98 VanDerWaalsContact C-N 3.35Å; L96-N98 PolarHBondContact O-N 2.86Å; N98-T102 PolarHBondContact O-OG1 3.34Å
99	Q	58.2	Low	55.8	Low	109 Å²	109	83.4 Å²	83.4	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-72.2	-46	172.8	-74.2	179.6	-20.4	0	0	111.6	L95 L96 V97 E101 T102 Y103	L95-Q99 WeakPolarHBondContact O-CG 3.22Å; L95-Q99 PolarHBondContact O-N 3Å; L95-Q99 VanDerWaalsContact O-N 3.1Å; L96-Q99 PolarHBondContact O-N 3.36Å; V97-Q99 VanDerWaalsContact C-N 3.27Å; V97-Q99 PolarHBondContact O-N 3Å; Q99-E101 VanDerWaalsContact C-N 3.3Å; Q99-E101 PolarHBondContact O-N 2.56Å; Q99-T102 PolarHBondContact O-N 3.21Å; Q99-T102 VanDerWaalsContact O-N 3.1Å; Q99-T102 PolarHBondContact O-OG1 3.12Å; Q99-Y103 HydrophobicContact CB-CE2 4.47Å; Q99-Y103 WeakPolarHBondContact O-CD2 3.36Å; Q99-Y103 PolarHBondContact O-N 2.87Å
100	L	56	Low	55.6	Low	90 Å²	90	82.1 Å²	82.1	47%	0.471	42%	0.417	S	S	.	.	H	α-helix	trans	-57.8	-40.2	178.1	-76.5	164	0	0	0	112.6	L96 V97 T102 Y103 D104	L96-L100 WeakPolarHBondContact O-CG 3.32Å; L96-L100 PolarHBondContact O-N 3.13Å; V97-L100 PolarHBondContact O-N 3.23Å; L100-T102 VanDerWaalsContact C-N 3.3Å; L100-T102 PolarHBondContact O-N 2.78Å; L100-Y103 PolarHBondContact O-N 3.3Å; L100-Y103 VanDerWaalsContact O-N 3.15Å; L100-D104 PolarHBondContact O-N 2.92Å
101	E	52.8	Low	55.8	Low	75 Å²	75	86.9 Å²	86.9	35%	0.35	44%	0.441	S	S	.	.	H	α-helix	trans	-62.3	-34	176.9	-175.5	175.4	-153.9	0	0	113	F55 R59 V97 Q99	F55-E101 HydrophobicContact CD2-CG 4.47Å; F55-E101 HydrophobicContact CG-CB 4.48Å; R59-E101 IonicContact CZ-OE2 3.98Å; R59-E101 IonicContact NH2-OE2 3.34Å; R59-E101 PolarHBondContact NH2-OE2 3.43Å; V97-E101 PolarHBondContact O-N 3.02Å; V97-E101 VanDerWaalsContact O-N 3.1Å; Q99-E101 VanDerWaalsContact C-N 3.3Å; Q99-E101 PolarHBondContact O-N 2.56Å
102	T	53.7	Low	55.9	Low	90 Å²	90	85.6 Å²	85.6	55%	0.552	43%	0.433	S	S	*	.	H	α-helix	trans	-75.4	-25.4	177.3	17.4	0	0	0	0	112.6	N98 Q99 L100	N98-T102 PolarHBondContact O-OG1 3.34Å; Q99-T102 PolarHBondContact O-N 3.21Å; Q99-T102 VanDerWaalsContact O-N 3.1Å; Q99-T102 PolarHBondContact O-OG1 3.12Å; L100-T102 VanDerWaalsContact C-N 3.3Å; L100-T102 PolarHBondContact O-N 2.78Å
103	Y	53.9	Low	56	Low	157 Å²	157	85 Å²	85	62%	0.616	43%	0.427	S	S	*	.	H	α-helix	trans	-83.7	-29.8	179	-74.5	-74.5	0	0	0	114.4	Q99 L100 N107	Q99-Y103 HydrophobicContact CB-CE2 4.47Å; Q99-Y103 WeakPolarHBondContact O-CD2 3.36Å; Q99-Y103 PolarHBondContact O-N 2.87Å; L100-Y103 PolarHBondContact O-N 3.3Å; L100-Y103 VanDerWaalsContact O-N 3.15Å; Y103-N107 WeakPolarHBondContact CD1-ND2 3.37Å; Y103-N107 WeakPolarHBondContact O-CB 3.49Å
104	D	55.4	Low	56.4	Low	92 Å²	92	85.8 Å²	85.8	49%	0.492	43%	0.43	S	S	.	.	H	α-helix	trans	-84	-33.9	-162.1	-166.3	34.7	0	0	0	115.4	L100	L100-D104 PolarHBondContact O-N 2.92Å
105	K	50.7	Low	56.7	Low	157 Å²	157	90.6 Å²	90.6	68%	0.683	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-46.5	178.2	-89.3	179.5	176.9	171.6	0	115	L108 E109	K105-L108 PolarHBondContact O-N 3.35Å; K105-E109 WeakPolarHBondContact O-CG 3.4Å; K105-E109 PolarHBondContact O-N 2.69Å; K105-E109 VanDerWaalsContact O-N 3.07Å
106	S	46.5	Very low	57.1	Low	73 Å²	73	86.6 Å²	86.6	51%	0.51	43%	0.428	S	S	.	.	H	α-helix	trans	-72.9	-40.8	-172.1	-165.2	0	0	0	0	111.9	V110	S106-V110 VanDerWaalsContact O-CB 3.24Å; S106-V110 WeakPolarHBondContact O-CB 3.49Å; S106-V110 WeakPolarHBondContact O-CG2 2.98Å; S106-V110 PolarHBondContact O-N 2.88Å
107	N	52.5	Low	57.5	Low	61 Å²	61	86.9 Å²	86.9	33%	0.326	43%	0.425	S	S	.	.	H	α-helix	trans	-71.1	-34.1	175.2	-71	-36.6	0	0	0	112.1	Y103 V110 I111	Y103-N107 WeakPolarHBondContact CD1-ND2 3.37Å; Y103-N107 WeakPolarHBondContact O-CB 3.49Å; N107-V110 PolarHBondContact O-N 2.84Å; N107-I111 HydrophobicContact CB-CD1 4.25Å; N107-I111 WeakPolarHBondContact O-CA 3.41Å; N107-I111 WeakPolarHBondContact O-CB 3.48Å; N107-I111 VanDerWaalsContact O-CD1 3.32Å; N107-I111 WeakPolarHBondContact O-CD1 2.87Å; N107-I111 WeakPolarHBondContact O-CG1 3.48Å; N107-I111 PolarHBondContact O-N 3.23Å
108	L	53	Low	57.9	Low	76 Å²	76	91.4 Å²	91.4	40%	0.398	45%	0.448	S	S	.	.	H	α-helix	trans	-69.8	-39.2	179.3	-166	128.1	0	0	0	111.9	K105 R112	K105-L108 PolarHBondContact O-N 3.35Å; L108-R112 WeakPolarHBondContact O-CB 3.34Å; L108-R112 WeakPolarHBondContact O-CG 3.47Å; L108-R112 PolarHBondContact O-N 3.43Å
109	E	54.2	Low	58.3	Low	135 Å²	135	89.4 Å²	89.4	63%	0.631	44%	0.437	S	S	*	.	H	α-helix	trans	-67.4	-42.3	171	-72	-174.2	169	0	0	112.2	K105 R112 H113	K105-E109 WeakPolarHBondContact O-CG 3.4Å; K105-E109 PolarHBondContact O-N 2.69Å; K105-E109 VanDerWaalsContact O-N 3.07Å; E109-R112 PolarHBondContact O-N 3.16Å; E109-H113 WeakPolarHBondContact O-CB 3.39Å; E109-H113 PolarHBondContact O-N 3.12Å
110	V	60.5	Low	58.7	Low	65 Å²	65	87.2 Å²	87.2	39%	0.394	43%	0.428	S	S	.	.	H	α-helix	trans	-66.6	-41.4	177	170.6	0	0	0	0	111.7	S106 N107 H113 Q114	S106-V110 VanDerWaalsContact O-CB 3.24Å; S106-V110 WeakPolarHBondContact O-CB 3.49Å; S106-V110 WeakPolarHBondContact O-CG2 2.98Å; S106-V110 PolarHBondContact O-N 2.88Å; N107-V110 PolarHBondContact O-N 2.84Å; V110-H113 WeakPolarHBondContact O-CB 3.08Å; V110-H113 PolarHBondContact O-N 2.55Å; V110-Q114 WeakPolarHBondContact O-CB 3.4Å; V110-Q114 WeakPolarHBondContact O-CG 3.17Å; V110-Q114 PolarHBondContact O-N 2.96Å
111	I	59	Low	59.1	Low	104 Å²	104	89.2 Å²	89.2	53%	0.533	43%	0.433	S	S	.	.	H	α-helix	trans	-65.9	-44.9	175.2	-71.9	164	0	0	0	109.4	N107 H113 Q114 F115	N107-I111 HydrophobicContact CB-CD1 4.25Å; N107-I111 WeakPolarHBondContact O-CA 3.41Å; N107-I111 WeakPolarHBondContact O-CB 3.48Å; N107-I111 VanDerWaalsContact O-CD1 3.32Å; N107-I111 WeakPolarHBondContact O-CD1 2.87Å; N107-I111 WeakPolarHBondContact O-CG1 3.48Å; N107-I111 PolarHBondContact O-N 3.23Å; I111-H113 VanDerWaalsContact C-N 3.27Å; I111-H113 PolarHBondContact O-N 3.26Å; I111-Q114 PolarHBondContact O-N 2.91Å; I111-F115 WeakPolarHBondContact O-CB 3.36Å; I111-F115 PolarHBondContact O-N 3.43Å
112	R	60.8	Low	59.6	Low	58 Å²	58	90.1 Å²	90.1	22%	0.219	44%	0.439	C	S	.	.	H	α-helix	trans	-58.6	-41.3	173.3	-79.4	174.3	178.4	178	5.2	111.4	L108 E109 A116 L207	L108-R112 WeakPolarHBondContact O-CB 3.34Å; L108-R112 WeakPolarHBondContact O-CG 3.47Å; L108-R112 PolarHBondContact O-N 3.43Å; E109-R112 PolarHBondContact O-N 3.16Å; R112-A116 WeakPolarHBondContact O-CB 3.29Å; R112-A116 PolarHBondContact O-N 2.93Å; R112-L207 HydrophobicContact CB-CD2 3.89Å
113	H	64.1	Low	60.1	Low	67 Å²	67	87.2 Å²	87.2	31%	0.31	42%	0.42	S	S	.	.	H	α-helix	trans	-65.1	-44.2	176.1	-168.9	52.9	0	0	0	112.8	E109 V110 I111 K117 E203 L207	E109-H113 WeakPolarHBondContact O-CB 3.39Å; E109-H113 PolarHBondContact O-N 3.12Å; V110-H113 WeakPolarHBondContact O-CB 3.08Å; V110-H113 PolarHBondContact O-N 2.55Å; I111-H113 VanDerWaalsContact C-N 3.27Å; I111-H113 PolarHBondContact O-N 3.26Å; H113-K117 WeakPolarHBondContact NE2-CE 3.33Å; H113-K117 PolarHBondContact NE2-NZ 3.24Å; H113-K117 WeakPolarHBondContact O-CB 3.46Å; H113-K117 VanDerWaalsContact O-CG 3.31Å; H113-K117 WeakPolarHBondContact O-CG 3.2Å; H113-K117 PolarHBondContact O-N 2.92Å; H113-E203 IonicContact CE1-OE1 3.91Å; H113-E203 IonicContact ND1-OE1 2.79Å; H113-L207 HydrophobicContact CB-CD2 4.15Å
114	Q	63.5	Low	60.5	Low	113 Å²	113	85.3 Å²	85.3	53%	0.528	42%	0.416	S	S	.	.	H	α-helix	trans	-67.4	-41.7	176.5	-72.7	-177.5	2.6	0	0	111.9	V110 I111 K117 L118	V110-Q114 WeakPolarHBondContact O-CB 3.4Å; V110-Q114 WeakPolarHBondContact O-CG 3.17Å; V110-Q114 PolarHBondContact O-N 2.96Å; I111-Q114 PolarHBondContact O-N 2.91Å; Q114-K117 WeakPolarHBondContact O-CB 3.46Å; Q114-K117 PolarHBondContact O-N 2.84Å; Q114-L118 WeakPolarHBondContact O-CG 3.24Å; Q114-L118 PolarHBondContact O-N 3.49Å
115	F	62.8	Low	60.4	Low	121 Å²	121	84.7 Å²	84.7	53%	0.531	42%	0.418	S	S	.	.	H	α-helix	trans	-65.3	-43.8	176.2	-168.1	-93.6	0	0	0	111	I111 K117 L118 Q119	I111-F115 WeakPolarHBondContact O-CB 3.36Å; I111-F115 PolarHBondContact O-N 3.43Å; F115-K117 VanDerWaalsContact C-N 3.34Å; F115-K117 PolarHBondContact O-N 3.32Å; F115-L118 PolarHBondContact O-N 2.9Å; F115-L118 VanDerWaalsContact O-N 3.16Å; F115-Q119 VanDerWaalsContact O-CB 3.28Å; F115-Q119 WeakPolarHBondContact O-CB 3.28Å; F115-Q119 PolarHBondContact O-N 2.81Å
116	A	67.7	Low	60.5	Low	0 Å²	0	81.3 Å²	81.3	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-58.8	-45	174	0	0	0	0	0	111.5	R112 L118 Q119 M120 L206 L207	R112-A116 WeakPolarHBondContact O-CB 3.29Å; R112-A116 PolarHBondContact O-N 2.93Å; A116-L118 PolarHBondContact O-N 2.97Å; A116-Q119 PolarHBondContact O-N 2.76Å; A116-M120 VanDerWaalsContact O-CG 3.31Å; A116-M120 WeakPolarHBondContact O-CG 3.39Å; A116-M120 PolarHBondContact O-N 3.1Å; A116-L206 HydrophobicContact CB-CB 3.77Å; A116-L206 HydrophobicContact CB-CD1 3.85Å; A116-L206 HydrophobicContact CB-CG 4.48Å; A116-L207 HydrophobicContact CB-CD2 4.32Å
117	K	68.4	Low	60.8	Low	106 Å²	106	84.1 Å²	84.1	46%	0.461	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-43	173.7	-77	174.8	176.6	176.8	0	112.8	H113 Q114 F115 K121	H113-K117 WeakPolarHBondContact NE2-CE 3.33Å; H113-K117 PolarHBondContact NE2-NZ 3.24Å; H113-K117 WeakPolarHBondContact O-CB 3.46Å; H113-K117 VanDerWaalsContact O-CG 3.31Å; H113-K117 WeakPolarHBondContact O-CG 3.2Å; H113-K117 PolarHBondContact O-N 2.92Å; Q114-K117 WeakPolarHBondContact O-CB 3.46Å; Q114-K117 PolarHBondContact O-N 2.84Å; F115-K117 VanDerWaalsContact C-N 3.34Å; F115-K117 PolarHBondContact O-N 3.32Å; K117-K121 WeakPolarHBondContact O-CG 3.31Å; K117-K121 PolarHBondContact O-N 3.18Å; K117-K121 VanDerWaalsContact O-N 3.11Å
118	L	67.6	Low	60.6	Low	113 Å²	113	87.3 Å²	87.3	59%	0.592	43%	0.425	S	S	*	.	H	α-helix	trans	-66.7	-40	177.9	-74.5	170.7	0	0	0	111.6	Q114 F115 A116 K121 L122	Q114-L118 WeakPolarHBondContact O-CG 3.24Å; Q114-L118 PolarHBondContact O-N 3.49Å; F115-L118 PolarHBondContact O-N 2.9Å; F115-L118 VanDerWaalsContact O-N 3.16Å; A116-L118 PolarHBondContact O-N 2.97Å; L118-K121 PolarHBondContact O-N 2.71Å; L118-L122 WeakPolarHBondContact O-CB 3.48Å; L118-L122 PolarHBondContact O-N 2.88Å
119	Q	62.8	Low	60.3	Low	15 Å²	15	91.3 Å²	91.3	7%	0.07	44%	0.441	C	S	.	.	H	α-helix	trans	-68	-41.9	178.8	-177.2	168.8	-6.2	0	0	112.3	F115 A116 K121 L122 E123 V153 Y202 L206	F115-Q119 VanDerWaalsContact O-CB 3.28Å; F115-Q119 WeakPolarHBondContact O-CB 3.28Å; F115-Q119 PolarHBondContact O-N 2.81Å; A116-Q119 PolarHBondContact O-N 2.76Å; Q119-K121 VanDerWaalsContact C-N 3.34Å; Q119-K121 PolarHBondContact O-N 3.35Å; Q119-L122 PolarHBondContact O-N 3.11Å; Q119-E123 PolarHBondContact O-N 2.71Å; Q119-V153 VanDerWaalsContact NE2-CA 3.28Å; Q119-V153 PolarHBondContact NE2-O 3.43Å; Q119-V153 PolarHBondContact OE1-O 3.09Å; Q119-Y202 PolarHBondContact NE2-OH 2.85Å; Q119-L206 HydrophobicContact CB-CD1 4.07Å; Q119-L206 HydrophobicContact CG-CD1 4.02Å
120	M	67.2	Low	60.1	Low	64 Å²	64	92 Å²	92	32%	0.315	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-44	172	-72.4	176.9	66.2	0	0	111.6	A116 L122 E123 E124 Y202 E203	A116-M120 VanDerWaalsContact O-CG 3.31Å; A116-M120 WeakPolarHBondContact O-CG 3.39Å; A116-M120 PolarHBondContact O-N 3.1Å; M120-L122 VanDerWaalsContact C-N 3.34Å; M120-E123 PolarHBondContact O-N 3.29Å; M120-E124 WeakPolarHBondContact O-CG 3.45Å; M120-E124 PolarHBondContact O-N 3.08Å; M120-Y202 HydrophobicContact CG-CD1 4.16Å; M120-Y202 HydrophobicContact CG-CE1 4.43Å; M120-E203 HydrophobicContact SD-CB 3.98Å; M120-E203 HydrophobicContact SD-CG 4.25Å
121	K	64.6	Low	59.7	Low	132 Å²	132	93.7 Å²	93.7	57%	0.574	46%	0.455	S	S	*	.	H	α-helix	trans	-63.7	-39.6	174.7	-75.1	179.6	177.2	-172.6	0	112.3	K117 L118 Q119 E123 E124 C125	K117-K121 WeakPolarHBondContact O-CG 3.31Å; K117-K121 PolarHBondContact O-N 3.18Å; K117-K121 VanDerWaalsContact O-N 3.11Å; L118-K121 PolarHBondContact O-N 2.71Å; Q119-K121 VanDerWaalsContact C-N 3.34Å; Q119-K121 PolarHBondContact O-N 3.35Å; K121-E123 VanDerWaalsContact C-N 3.33Å; K121-E124 PolarHBondContact O-N 3.24Å; K121-C125 WeakPolarHBondContact O-CB 3.28Å; K121-C125 PolarHBondContact O-N 2.8Å; K121-C125 PolarHBondContact O-SG 3.43Å
122	L	62.8	Low	59.7	Low	94 Å²	94	91 Å²	91	49%	0.492	44%	0.442	S	S	.	.	H	α-helix	trans	-62.9	-42.3	176.4	-177.6	64.3	0	0	0	110.6	L118 Q119 M120 C125 Q126	L118-L122 WeakPolarHBondContact O-CB 3.48Å; L118-L122 PolarHBondContact O-N 2.88Å; Q119-L122 PolarHBondContact O-N 3.11Å; M120-L122 VanDerWaalsContact C-N 3.34Å; L122-C125 PolarHBondContact O-N 2.78Å; L122-Q126 HydrophobicContact CD1-CG 4.44Å; L122-Q126 HydrophobicContact CG-CG 4.47Å; L122-Q126 VanDerWaalsContact O-CB 3.31Å; L122-Q126 WeakPolarHBondContact O-CB 3.19Å; L122-Q126 VanDerWaalsContact O-CG 3.24Å; L122-Q126 WeakPolarHBondContact O-CG 3.26Å; L122-Q126 PolarHBondContact O-N 3.16Å
123	E	63.1	Low	59.8	Low	29 Å²	29	96.4 Å²	96.4	14%	0.136	47%	0.467	C	S	.	.	H	α-helix	trans	-62.8	-41.1	173	-78.1	-169.6	-176.8	0	0	112.5	Q119 M120 K121 Q126 K127 L151 Y202	Q119-E123 PolarHBondContact O-N 2.71Å; M120-E123 PolarHBondContact O-N 3.29Å; K121-E123 VanDerWaalsContact C-N 3.33Å; E123-Q126 PolarHBondContact O-N 2.9Å; E123-K127 WeakPolarHBondContact O-CG 3.46Å; E123-K127 PolarHBondContact O-N 3.35Å; E123-L151 HydrophobicContact CG-CD2 3.98Å; E123-L151 WeakPolarHBondContact OE1-CD2 3.36Å; E123-Y202 WeakPolarHBondContact OE1-CE1 3.4Å; E123-Y202 PolarHBondContact OE1-OH 2.77Å
124	E	63.2	Low	60	Low	116 Å²	116	95.9 Å²	95.9	54%	0.542	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-44.2	174.2	-74.6	176.7	175.5	0	0	111.7	M120 K121 K127	M120-E124 WeakPolarHBondContact O-CG 3.45Å; M120-E124 PolarHBondContact O-N 3.08Å; K121-E124 PolarHBondContact O-N 3.24Å; E124-K127 WeakPolarHBondContact O-CB 3.29Å; E124-K127 PolarHBondContact O-N 3.42Å
125	C	53.9	Low	60.7	Low	79 Å²	79	95.2 Å²	95.2	53%	0.534	47%	0.469	S	S	.	.	H	α-helix	trans	-67.3	-35.1	175.4	-67.2	0	0	0	0	112.8	K121 L122 K127 D128 Q129	K121-C125 WeakPolarHBondContact O-CB 3.28Å; K121-C125 PolarHBondContact O-N 2.8Å; K121-C125 PolarHBondContact O-SG 3.43Å; L122-C125 PolarHBondContact O-N 2.78Å; C125-K127 VanDerWaalsContact C-N 3.29Å; C125-D128 WeakPolarHBondContact O-CB 3.37Å; C125-D128 PolarHBondContact O-N 2.78Å; C125-D128 VanDerWaalsContact O-N 3.13Å; C125-Q129 PolarHBondContact O-N 3.18Å
126	Q	51.2	Low	61.6	Low	86 Å²	86	94.2 Å²	94.2	40%	0.402	47%	0.468	S	S	.	.	H	α-helix	trans	-70.7	-25.3	174.5	-77.1	176.4	-11.7	0	0	112.2	L122 E123 D128 Q129	L122-Q126 HydrophobicContact CD1-CG 4.44Å; L122-Q126 HydrophobicContact CG-CG 4.47Å; L122-Q126 VanDerWaalsContact O-CB 3.31Å; L122-Q126 WeakPolarHBondContact O-CB 3.19Å; L122-Q126 VanDerWaalsContact O-CG 3.24Å; L122-Q126 WeakPolarHBondContact O-CG 3.26Å; L122-Q126 PolarHBondContact O-N 3.16Å; E123-Q126 PolarHBondContact O-N 2.9Å; Q126-D128 PolarHBondContact O-N 3.23Å; Q126-Q129 PolarHBondContact O-N 3.07Å
127	K	52.9	Low	62.2	Low	132 Å²	132	96.7 Å²	96.7	57%	0.574	49%	0.494	S	S	*	.	H	α-helix	trans	-65.3	-25.6	168.8	-72.7	168.1	-172.4	171.4	0	112.1	E123 E124 C125 I131	E123-K127 WeakPolarHBondContact O-CG 3.46Å; E123-K127 PolarHBondContact O-N 3.35Å; E124-K127 WeakPolarHBondContact O-CB 3.29Å; E124-K127 PolarHBondContact O-N 3.42Å; C125-K127 VanDerWaalsContact C-N 3.29Å; K127-I131 WeakPolarHBondContact O-CG1 3.44Å
128	D	48.5	Very low	63	Low	128 Å²	128	93.8 Å²	93.8	68%	0.684	48%	0.484	S	S	*	.	H	α-helix	trans	-86.1	-20.7	178.9	-72.2	-23.8	0	0	0	113.6	C125 Q126	C125-D128 WeakPolarHBondContact O-CB 3.37Å; C125-D128 PolarHBondContact O-N 2.78Å; C125-D128 VanDerWaalsContact O-N 3.13Å; Q126-D128 PolarHBondContact O-N 3.23Å
129	Q	46.9	Very low	64.2	Low	160 Å²	160	90.6 Å²	90.6	75%	0.748	47%	0.47	S	S	*	.	S	Bend	trans	-99.1	112.1	171.3	-75.3	-173.5	-13.9	0	0	110.1	C125 Q126	C125-Q129 PolarHBondContact O-N 3.18Å; Q126-Q129 PolarHBondContact O-N 3.07Å
130	D	50.4	Low	65.5	Low	149 Å²	149	95.1 Å²	95.1	80%	0.797	50%	0.495	S	S	*	.	S	Bend	trans	59.2	73.9	-171.1	-74.8	-34.1	0	0	0	113.3	I132	D130-I132 PolarHBondContact O-N 3.02Å
131	I	51.4	Low	66.6	Low	102 Å²	102	93.3 Å²	93.3	52%	0.523	49%	0.485	S	S	.	.			trans	-59.4	81.5	175.3	-53.5	175	0	0	0	110.5	K127 K133	K127-I131 WeakPolarHBondContact O-CG1 3.44Å; I131-K133 VanDerWaalsContact C-N 3.26Å; I131-K133 HydrophobicContact CG2-CB 4.19Å; I131-K133 HydrophobicContact CG2-CD 3.57Å; I131-K133 HydrophobicContact CG2-CG 3.45Å; I131-K133 VanDerWaalsContact CG2-CG 3.45Å; I131-K133 PolarHBondContact O-N 3.25Å; I131-K133 VanDerWaalsContact O-N 3.16Å
132	I	59.2	Low	67.8	Low	47 Å²	47	90.7 Å²	90.7	24%	0.241	48%	0.481	C	S	.	.			trans	-75.8	90.6	153.4	-57.6	168.6	0	0	0	104.3	D130 P134 N395 V396 K397	D130-I132 PolarHBondContact O-N 3.02Å; I132-P134 WeakPolarHBondContact O-CD 3.24Å; I132-N395 HydrophobicContact CD1-CB 4.18Å; I132-V396 WeakPolarHBondContact CG2-O 3.38Å; I132-K397 HydrophobicContact CD1-CB 3.85Å; I132-K397 HydrophobicContact CD1-CD 4.26Å; I132-K397 HydrophobicContact CD1-CG 4.27Å; I132-K397 HydrophobicContact CG1-CB 4.29Å; I132-K397 HydrophobicContact CG1-CD 4.19Å; I132-K397 HydrophobicContact CG1-CG 4.2Å
133	K	64.1	Low	69.2	Low	171 Å²	171	86.4 Å²	86.4	74%	0.743	46%	0.459	S	S	*	.			trans	-76.8	107.7	164.5	-90.9	163.9	-175.7	-177.5	0	106.4	I131 D135	I131-K133 VanDerWaalsContact C-N 3.26Å; I131-K133 HydrophobicContact CG2-CB 4.19Å; I131-K133 HydrophobicContact CG2-CD 3.57Å; I131-K133 HydrophobicContact CG2-CG 3.45Å; I131-K133 VanDerWaalsContact CG2-CG 3.45Å; I131-K133 PolarHBondContact O-N 3.25Å; I131-K133 VanDerWaalsContact O-N 3.16Å; K133-D135 PolarHBondContact O-N 3.21Å
134	P	67	Low	70.7	Confident	56 Å²	56	85.3 Å²	85.3	36%	0.364	45%	0.454	S	S	.	.			trans	-63.3	128.2	175.8	27.3	-32.7	0	0	0	107.9	I132 I136 Q381	I132-P134 WeakPolarHBondContact O-CD 3.24Å; P134-I136 HydrophobicContact CB-CG1 4.04Å; P134-I136 HydrophobicContact CG-CD1 4.45Å; P134-I136 HydrophobicContact CG-CG1 4.12Å; P134-I136 PolarHBondContact O-N 2.74Å; P134-I136 VanDerWaalsContact O-N 3.12Å; P134-Q381 VanDerWaalsContact CA-OE1 3.29Å; P134-Q381 HydrophobicContact CB-CB 3.92Å; P134-Q381 HydrophobicContact CB-CG 4.15Å
135	D	78.1	Confident	72.1	Confident	99 Å²	99	83.6 Å²	83.6	53%	0.529	45%	0.448	S	S	.	.			trans	-87.7	73.8	173	-165.2	0.9	0	0	0	107	K133 G137 N138 Q381	K133-D135 PolarHBondContact O-N 3.21Å; D135-G137 PolarHBondContact O-N 2.75Å; D135-N138 HydrophobicContact CB-CB 3.91Å; D135-N138 VanDerWaalsContact CG-CB 3.4Å; D135-N138 VanDerWaalsContact O-CB 3.28Å; D135-N138 WeakPolarHBondContact O-CB 3.31Å; D135-N138 PolarHBondContact O-N 2.95Å; D135-N138 WeakPolarHBondContact OD2-CB 3.49Å; D135-N138 PolarHBondContact OD2-ND2 3.22Å; D135-Q381 VanDerWaalsContact N-OE1 3.12Å; D135-Q381 PolarHBondContact O-NE2 3.39Å
136	I	83.1	Confident	74	Confident	100 Å²	100	81.8 Å²	81.8	51%	0.513	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	123	-167.4	-61.2	170.9	0	0	0	109.8	P134 N138	P134-I136 HydrophobicContact CB-CG1 4.04Å; P134-I136 HydrophobicContact CG-CD1 4.45Å; P134-I136 HydrophobicContact CG-CG1 4.12Å; P134-I136 PolarHBondContact O-N 2.74Å; P134-I136 VanDerWaalsContact O-N 3.12Å; I136-N138 VanDerWaalsContact C-N 3.31Å
137	G	79.3	Confident	75.9	Confident	52 Å²	52	78.8 Å²	78.8	54%	0.536	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	0.1	-179.2	0	0	0	0	0	115.1	D135	D135-G137 PolarHBondContact O-N 2.75Å
138	N	86.7	Confident	77.5	Confident	46 Å²	46	74 Å²	74	25%	0.246	41%	0.405	C	S	.	.			trans	-91.5	130.6	174.9	-168.3	-1	0	0	0	111.5	D135 I136 N140	D135-N138 HydrophobicContact CB-CB 3.91Å; D135-N138 VanDerWaalsContact CG-CB 3.4Å; D135-N138 VanDerWaalsContact O-CB 3.28Å; D135-N138 WeakPolarHBondContact O-CB 3.31Å; D135-N138 PolarHBondContact O-N 2.95Å; D135-N138 WeakPolarHBondContact OD2-CB 3.49Å; D135-N138 PolarHBondContact OD2-ND2 3.22Å; I136-N138 VanDerWaalsContact C-N 3.31Å; N138-N140 WeakPolarHBondContact OD1-CB 3.32Å; N138-N140 PolarHBondContact OD1-N 3.08Å; N138-N140 PolarHBondContact OD1-ND2 3.18Å
139	C	91.6	Very high	79.2	Confident	45 Å²	45	73.2 Å²	73.2	30%	0.304	40%	0.401	S	S	.	.			trans	-112.6	14.6	176.1	-68.5	0	0	0	0	113.8	H141 E282 C330	C139-H141 PolarHBondContact O-N 3.11Å; C139-E282 WeakPolarHBondContact SG-CB 3.43Å; C139-C330 WeakPolarHBondContact CA-SG 3.44Å; C139-C330 HydrophobicContact CB-CB 3.59Å; C139-C330 WeakPolarHBondContact CB-SG 3.2Å; C139-C330 VanDerWaalsContact SG-CA 3.56Å; C139-C330 WeakPolarHBondContact SG-CB 3.37Å; C139-C330 CovalentContact SG-SG 2.04Å; C139-C330 PolarHBondContact SG-SG 3.15Å
140	N	89.6	Confident	81	Confident	110 Å²	110	67.2 Å²	67.2	59%	0.588	38%	0.376	S	S	*	.			trans	-78.1	61.2	175.6	-62.2	-10.2	0	0	0	110.5	N138	N138-N140 WeakPolarHBondContact OD1-CB 3.32Å; N138-N140 PolarHBondContact OD1-N 3.08Å; N138-N140 PolarHBondContact OD1-ND2 3.18Å
141	H	90.1	Very high	82.6	Confident	27 Å²	27	61.4 Å²	61.4	13%	0.125	35%	0.345	C	S	.	.	S	Bend	trans	-144.8	153.3	178	58.8	57.2	0	0	0	110.4	C139 G143 C330 F398 N399	C139-H141 PolarHBondContact O-N 3.11Å; H141-G143 VanDerWaalsContact C-N 3.3Å; H141-G143 PolarHBondContact O-N 3.43Å; H141-C330 PolarHBondContact NE2-SG 3.04Å; H141-F398 HydrophobicContact CB-CB 3.77Å; H141-F398 AromaticContact CD2-CD1 3.67Å; H141-F398 AromaticContact CD2-CD2 3.99Å; H141-F398 AromaticContact CD2-CG 3.49Å; H141-F398 VanDerWaalsContact CD2-CG 3.49Å; H141-F398 WeakPolarHBondContact CD2-CG 3.49Å; H141-F398 AromaticContact CE1-CD1 3.74Å; H141-F398 AromaticContact CG-CD1 3.99Å; H141-F398 AromaticContact CG-CG 3.95Å; H141-F398 AromaticContact NE2-CD1 3.5Å; H141-F398 AromaticContact NE2-CE1 3.73Å; H141-F398 AromaticContact NE2-CG 3.78Å; H141-N399 WeakPolarHBondContact CA-O 3.29Å; H141-N399 WeakPolarHBondContact CB-O 3.38Å
142	T	89.9	Confident	84.1	Confident	77 Å²	77	59 Å²	59	47%	0.472	34%	0.335	S	S	.	.	S	Bend	trans	-86.9	-0.4	-178.2	57.9	0	0	0	0	114.3	R358 N399 E401	T142-R358 PolarHBondContact O-NH1 3.02Å; T142-N399 WeakPolarHBondContact OG1-CB 3.49Å; T142-E401 HydrophobicContact CG2-CG 4.41Å
143	G	92.4	Very high	85.1	Confident	4 Å²	4	57 Å²	57	4%	0.041	32%	0.324	C	S	.	.	S	Bend	trans	140.7	-176.9	176.1	0	0	0	0	0	112.6	H141 Y334 F398 N399	H141-G143 VanDerWaalsContact C-N 3.3Å; H141-G143 PolarHBondContact O-N 3.43Å; G143-Y334 WeakPolarHBondContact CA-OH 3.35Å; G143-F398 WeakPolarHBondContact O-CA 3.45Å; G143-N399 PolarHBondContact O-N 3.02Å
144	I	95.4	Very high	85.6	Confident	6 Å²	6	49.6 Å²	49.6	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	132.9	174.7	-61	169.2	0	0	0	109.1	F147 F327 V329 Y334 I346 I362 V396 F398	I144-F147 HydrophobicContact CD1-CZ 4.17Å; I144-F147 HydrophobicContact CG2-CE2 3.89Å; I144-F147 HydrophobicContact CG2-CZ 3.9Å; I144-F327 HydrophobicContact CD1-CE2 3.78Å; I144-F327 HydrophobicContact CD1-CZ 4.14Å; I144-V329 HydrophobicContact CD1-CG2 4.21Å; I144-Y334 HydrophobicContact CD1-CD1 4.14Å; I144-Y334 HydrophobicContact CD1-CD2 3.82Å; I144-Y334 HydrophobicContact CD1-CE1 4.1Å; I144-Y334 HydrophobicContact CD1-CE2 3.83Å; I144-Y334 HydrophobicContact CD1-CG 3.97Å; I144-Y334 HydrophobicContact CG1-CE1 4.31Å; I144-Y334 HydrophobicContact CG1-CE2 4.23Å; I144-I346 HydrophobicContact CD1-CD1 3.81Å; I144-I346 HydrophobicContact CG2-CD1 4.35Å; I144-I362 HydrophobicContact CB-CD1 4.21Å; I144-I362 HydrophobicContact CG2-CD1 4.31Å; I144-I362 HydrophobicContact CG2-CG2 4.45Å; I144-I362 WeakPolarHBondContact O-CD1 3.24Å; I144-V396 HydrophobicContact CD1-CG1 4.28Å; I144-V396 HydrophobicContact CG1-CG1 3.93Å; I144-V396 HydrophobicContact CG2-CG1 4.01Å; I144-F398 HydrophobicContact CG1-CD1 4.09Å; I144-F398 HydrophobicContact CG1-CE1 3.76Å
145	L	93.2	Very high	86.1	Confident	80 Å²	80	49 Å²	49	42%	0.419	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-51.6	173.4	173.5	58.9	0	0	0	110.7	K397 N399	L145-K397 WeakPolarHBondContact CB-O 3.35Å; L145-K397 HydrophobicContact CD2-CD 4.03Å; L145-K397 HydrophobicContact CD2-CG 4.25Å; L145-K397 PolarHBondContact N-O 3.01Å; L145-N399 WeakPolarHBondContact CB-OD1 3.26Å; L145-N399 WeakPolarHBondContact CD1-OD1 3.5Å
146	S	93.1	Very high	86.3	Confident	41 Å²	41	44.2 Å²	44.2	29%	0.287	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	171.1	-175.1	67	0	0	0	0	111.6	K397	S146-K397 PolarHBondContact N-O 3.43Å; S146-K397 WeakPolarHBondContact O-CB 3.49Å; S146-K397 PolarHBondContact O-N 3.19Å
147	F	91.3	Very high	86	Confident	22 Å²	22	40.5 Å²	40.5	10%	0.096	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	156.5	170.8	-64.1	-86.8	0	0	0	110.7	I144 F327 I346 I362 F364 L383 Y394 N395 V396	I144-F147 HydrophobicContact CD1-CZ 4.17Å; I144-F147 HydrophobicContact CG2-CE2 3.89Å; I144-F147 HydrophobicContact CG2-CZ 3.9Å; F147-F327 HydrophobicContact CZ-CZ 4.15Å; F147-I346 HydrophobicContact CE2-CD1 3.56Å; F147-I346 HydrophobicContact CE2-CG1 4.19Å; F147-I346 HydrophobicContact CZ-CD1 3.69Å; F147-I362 HydrophobicContact CD2-CG2 4.32Å; F147-I362 HydrophobicContact CE2-CG2 4.21Å; F147-F364 HydrophobicContact CB-CB 3.87Å; F147-F364 HydrophobicContact CD2-CB 3.79Å; F147-F364 AromaticContact CD2-CD1 3.89Å; F147-F364 HydrophobicContact CD2-CD1 3.89Å; F147-F364 HydrophobicContact CD2-CG 4.03Å; F147-F364 AromaticContact CE2-CD1 3.99Å; F147-F364 HydrophobicContact CE2-CD1 3.99Å; F147-F364 HydrophobicContact CG-CB 4.05Å; F147-F364 HydrophobicContact CG-CG 4.38Å; F147-L383 HydrophobicContact CD1-CD2 4.29Å; F147-L383 HydrophobicContact CE1-CB 4.18Å; F147-L383 HydrophobicContact CE1-CD2 3.71Å; F147-L383 HydrophobicContact CZ-CD2 4.17Å; F147-Y394 HydrophobicContact CB-CD1 4.45Å; F147-N395 WeakPolarHBondContact CA-O 3.37Å; F147-V396 HydrophobicContact CD1-CG2 4.07Å; F147-V396 HydrophobicContact CE1-CB 4.37Å; F147-V396 HydrophobicContact CE1-CG1 4.07Å; F147-V396 HydrophobicContact CE1-CG2 3.73Å
148	S	87.3	Confident	86	Confident	32 Å²	32	40.5 Å²	40.5	22%	0.224	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-64.3	170.5	164.1	67.1	0	0	0	0	111.3	N395	S148-N395 PolarHBondContact N-O 3.4Å; S148-N395 PolarHBondContact OG-N 3.47Å
149	N	83.1	Confident	85.5	Confident	112 Å²	112	41.2 Å²	41.2	60%	0.599	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-58.7	153.3	160.8	-73.4	-52.6	0	0	0	110.2	L151	N149-L151 PolarHBondContact O-N 2.86Å
150	P	85.8	Confident	84.7	Confident	33 Å²	33	40.6 Å²	40.6	21%	0.214	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-59.7	124	177.1	21.8	-32.1	0	0	0	110.8	K365 V392 Y394	P150-K365 HydrophobicContact CG-CB 4.3Å; P150-V392 HydrophobicContact CB-CG1 3.73Å; P150-Y394 VanDerWaalsContact CA-CE1 3.45Å; P150-Y394 HydrophobicContact CB-CD1 4.34Å; P150-Y394 HydrophobicContact CB-CE1 3.5Å; P150-Y394 HydrophobicContact CG-CE1 4.26Å
151	L	84.1	Confident	83.8	Confident	28 Å²	28	39.4 Å²	39.4	15%	0.147	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	103.1	169	-179.2	61.4	0	0	0	108.7	E123 N149 V153 V392 S393	E123-L151 HydrophobicContact CG-CD2 3.98Å; E123-L151 WeakPolarHBondContact OE1-CD2 3.36Å; N149-L151 PolarHBondContact O-N 2.86Å; L151-V153 HydrophobicContact CG-CG2 4.46Å; L151-V153 PolarHBondContact O-N 3.14Å; L151-V392 CarbonylContact O-C 3.51Å; L151-V392 WeakPolarHBondContact O-CA 3.3Å; L151-S393 WeakPolarHBondContact CB-O 3.26Å; L151-S393 PolarHBondContact N-O 2.88Å; L151-S393 PolarHBondContact O-N 3.22Å
152	V	82.4	Confident	83.3	Confident	52 Å²	52	40.7 Å²	40.7	32%	0.315	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	109.9	174.7	-173.6	0	0	0	0	108.1	F367 Y390 V392	V152-F367 HydrophobicContact CB-CE2 4.41Å; V152-F367 HydrophobicContact CG1-CE1 4.25Å; V152-F367 HydrophobicContact CG1-CE2 4.24Å; V152-F367 HydrophobicContact CG1-CZ 4.01Å; V152-F367 HydrophobicContact CG2-CD1 4.34Å; V152-F367 HydrophobicContact CG2-CD2 3.26Å; V152-F367 HydrophobicContact CG2-CE1 4.44Å; V152-F367 HydrophobicContact CG2-CE2 3.39Å; V152-F367 HydrophobicContact CG2-CG 3.79Å; V152-F367 HydrophobicContact CG2-CZ 4Å; V152-Y390 HydrophobicContact CG1-CD1 4.02Å; V152-V392 HydrophobicContact CG2-CG2 4.49Å
153	V	78.7	Confident	83.1	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-60.8	-174.5	172.5	0	0	0	0	110.2	Q119 L151 W168 Y202 L206 Y391	Q119-V153 VanDerWaalsContact NE2-CA 3.28Å; Q119-V153 PolarHBondContact NE2-O 3.43Å; Q119-V153 PolarHBondContact OE1-O 3.09Å; L151-V153 HydrophobicContact CG-CG2 4.46Å; L151-V153 PolarHBondContact O-N 3.14Å; V153-W168 HydrophobicContact CB-CH2 4.28Å; V153-W168 HydrophobicContact CG1-CH2 4.48Å; V153-W168 HydrophobicContact CG2-CH2 3.64Å; V153-W168 HydrophobicContact CG2-CZ2 4Å; V153-Y202 HydrophobicContact CG1-CE2 3.64Å; V153-Y202 WeakPolarHBondContact CG1-OH 3.48Å; V153-Y202 HydrophobicContact CG2-CE2 4.37Å; V153-L206 HydrophobicContact CG1-CD2 3.54Å; V153-Y391 WeakPolarHBondContact CB-O 3.35Å; V153-Y391 HydrophobicContact CG1-CD2 4.47Å; V153-Y391 PolarHBondContact N-O 3.44Å
154	Q	76.3	Confident	82.8	Confident	16 Å²	16	41.1 Å²	41.1	8%	0.075	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	170.6	177.2	61	177.9	-10.4	0	0	111.2	L205 L206 R208 Y391	Q154-L205 PolarHBondContact NE2-O 3.4Å; Q154-L206 HydrophobicContact CG-CD2 4.4Å; Q154-L206 PolarHBondContact OE1-O 3.08Å; Q154-L206 VanDerWaalsContact OE1-O 3.08Å; Q154-R208 VanDerWaalsContact OE1-CZ 3.25Å; Q154-R208 VanDerWaalsContact OE1-NH1 3.08Å; Q154-Y391 HydrophobicContact CG-CD2 3.54Å; Q154-Y391 HydrophobicContact CG-CE2 3.87Å; Q154-Y391 HydrophobicContact CG-CG 4.25Å; Q154-Y391 VanDerWaalsContact NE2-CE2 3.29Å; Q154-Y391 PolarHBondContact O-N 2.95Å
155	F	77.3	Confident	82.7	Confident	43 Å²	43	44.2 Å²	44.2	19%	0.189	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	154.1	162.7	-162.2	-130.3	0	0	0	111.6	S160 S161 R208 G389 Y390	F155-S160 VanDerWaalsContact CZ-C 3.42Å; F155-S161 VanDerWaalsContact CZ-N 3.33Å; F155-R208 PolarHBondContact O-NH2 3.3Å; F155-G389 CarbonylContact C-O 3.57Å; F155-G389 VanDerWaalsContact CD2-O 3.23Å; F155-G389 WeakPolarHBondContact CD2-O 3.29Å; F155-Y390 HydrophobicContact CB-CE1 4.27Å; F155-Y390 HydrophobicContact CD2-CD1 4.11Å; F155-Y390 HydrophobicContact CD2-CD2 4.08Å; F155-Y390 AromaticContact CD2-CE1 3.8Å; F155-Y390 HydrophobicContact CD2-CE1 3.8Å; F155-Y390 AromaticContact CD2-CE2 3.77Å; F155-Y390 HydrophobicContact CD2-CE2 3.77Å; F155-Y390 HydrophobicContact CD2-CG 4.24Å; F155-Y390 AromaticContact CD2-CZ 3.63Å; F155-Y390 HydrophobicContact CE2-CD2 4.32Å; F155-Y390 AromaticContact CE2-CE2 3.85Å; F155-Y390 HydrophobicContact CE2-CE2 3.85Å; F155-Y390 HydrophobicContact CG-CE1 4.47Å
156	N	82.3	Confident	82.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.232	C	C	.	.			trans	-59.8	164.5	-167.7	68.5	81	0	0	0	114.5	H158 L159 S160 Y184 R208 Y386 G389 Y391	N156-H158 PolarHBondContact O-N 3.03Å; N156-H158 WeakPolarHBondContact OD1-CA 3.43Å; N156-H158 WeakPolarHBondContact OD1-CB 3.16Å; N156-H158 PolarHBondContact OD1-N 3.45Å; N156-L159 PolarHBondContact O-N 3.45Å; N156-L159 VanDerWaalsContact O-N 3.07Å; N156-L159 PolarHBondContact OD1-N 2.76Å; N156-S160 PolarHBondContact ND2-O 2.77Å; N156-Y184 HydrophobicContact CB-CE2 4.13Å; N156-Y184 WeakPolarHBondContact CB-OH 3.38Å; N156-Y184 PolarHBondContact OD1-OH 2.88Å; N156-R208 PolarHBondContact O-NE 3.41Å; N156-Y386 HydrophobicContact CB-CE2 4.24Å; N156-Y386 VanDerWaalsContact CB-OH 3.31Å; N156-Y386 WeakPolarHBondContact CB-OH 3.44Å; N156-G389 WeakPolarHBondContact CA-O 3.47Å; N156-G389 WeakPolarHBondContact CB-O 3.17Å; N156-G389 PolarHBondContact N-O 3.31Å; N156-G389 WeakPolarHBondContact ND2-CA 3.4Å; N156-G389 PolarHBondContact ND2-O 2.97Å; N156-Y391 HydrophobicContact CB-CE1 4.12Å
157	G	76.9	Confident	82.7	Confident	22 Å²	22	38.5 Å²	38.5	23%	0.227	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.8	-176.6	0	0	0	0	0	114.5	Y391	G157-Y391 PolarHBondContact N-OH 3.01Å
158	H	78.9	Confident	83	Confident	52 Å²	52	37.6 Å²	37.6	24%	0.241	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.2	178	-61.3	91.4	0	0	0	113.5	N156 S160 Y163 Y184 Y197	N156-H158 PolarHBondContact O-N 3.03Å; N156-H158 WeakPolarHBondContact OD1-CA 3.43Å; N156-H158 WeakPolarHBondContact OD1-CB 3.16Å; N156-H158 PolarHBondContact OD1-N 3.45Å; H158-S160 PolarHBondContact O-N 2.85Å; H158-Y163 HydrophobicContact CB-CD1 4.27Å; H158-Y163 HydrophobicContact CB-CD2 3.69Å; H158-Y163 HydrophobicContact CB-CE1 4.18Å; H158-Y163 HydrophobicContact CB-CE2 3.56Å; H158-Y163 HydrophobicContact CB-CG 4.05Å; H158-Y163 AromaticContact CD2-CE1 3.59Å; H158-Y163 AromaticContact CD2-CZ 3.46Å; H158-Y163 VanDerWaalsContact CD2-CZ 3.46Å; H158-Y163 PolarHBondContact CD2-OH 3.34Å; H158-Y163 AromaticContact CE1-CD1 3.79Å; H158-Y163 AromaticContact CE1-CE1 3.47Å; H158-Y163 VanDerWaalsContact CE1-CE1 3.47Å; H158-Y163 WeakPolarHBondContact CE1-CE1 3.49Å; H158-Y163 AromaticContact CG-CD1 3.79Å; H158-Y163 AromaticContact CG-CE1 3.49Å; H158-Y163 VanDerWaalsContact CG-CE1 3.49Å; H158-Y163 AromaticContact CG-CE2 3.78Å; H158-Y163 AromaticContact CG-CZ 3.47Å; H158-Y163 VanDerWaalsContact CG-CZ 3.47Å; H158-Y163 AromaticContact ND1-CD1 3.42Å; H158-Y163 WeakPolarHBondContact ND1-CD1 3.21Å; H158-Y163 AromaticContact ND1-CE1 3.42Å; H158-Y163 WeakPolarHBondContact ND1-CE1 3.46Å; H158-Y163 AromaticContact ND1-CG 3.94Å; H158-Y163 AromaticContact ND1-CZ 3.93Å; H158-Y163 AromaticContact NE2-CE1 3.61Å; H158-Y163 AromaticContact NE2-CZ 3.94Å; H158-Y184 AromaticContact CE1-CE1 3.69Å; H158-Y184 AromaticContact ND1-CE1 3.52Å; H158-Y184 AromaticContact ND1-CZ 3.58Å; H158-Y184 PolarHBondContact ND1-OH 3.32Å; H158-Y197 AromaticContact CE1-CE2 3.78Å; H158-Y197 AromaticContact NE2-CE2 3.87Å; H158-Y197 AromaticContact NE2-CZ 3.78Å; H158-Y197 PolarHBondContact NE2-OH 3.44Å
159	L	75.3	Confident	83.5	Confident	61 Å²	61	36.2 Å²	36.2	32%	0.319	20%	0.204	S	C	.	.			trans	56.7	31.7	-178.4	-54.7	161.6	0	0	0	113	N156 R208	N156-L159 PolarHBondContact O-N 3.45Å; N156-L159 VanDerWaalsContact O-N 3.07Å; N156-L159 PolarHBondContact OD1-N 2.76Å; L159-R208 VanDerWaalsContact CD2-NE 3.25Å
160	S	74.8	Confident	84.1	Confident	31 Å²	31	31.7 Å²	31.7	22%	0.217	18%	0.179	C	C	.	.			trans	-133.8	135.4	-179	176.3	0	0	0	0	111	F155 N156 H158 S162 Y163	F155-S160 VanDerWaalsContact CZ-C 3.42Å; N156-S160 PolarHBondContact ND2-O 2.77Å; H158-S160 PolarHBondContact O-N 2.85Å; S160-S162 PolarHBondContact O-N 3.25Å; S160-S162 PolarHBondContact OG-N 3.08Å; S160-S162 PolarHBondContact OG-OG 2.8Å; S160-Y163 PolarHBondContact O-N 2.95Å
161	S	71.6	Confident	84.6	Confident	85 Å²	85	30.2 Å²	30.2	59%	0.594	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-12.2	178	54.1	0	0	0	0	112.6	F155 Y163 V164	F155-S161 VanDerWaalsContact CZ-N 3.33Å; S161-Y163 VanDerWaalsContact C-N 3.26Å; S161-Y163 PolarHBondContact O-N 2.88Å; S161-V164 WeakPolarHBondContact O-CG1 3.34Å
162	S	78.8	Confident	85.2	Confident	54 Å²	54	29.4 Å²	29.4	38%	0.378	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.9	176.6	65.9	0	0	0	0	113.6	S160 V164 T188	S160-S162 PolarHBondContact O-N 3.25Å; S160-S162 PolarHBondContact OG-N 3.08Å; S160-S162 PolarHBondContact OG-OG 2.8Å; S162-V164 PolarHBondContact O-N 2.64Å; S162-T188 WeakPolarHBondContact O-CA 3.46Å
163	Y	86.2	Confident	85.9	Confident	49 Å²	49	31.3 Å²	31.3	19%	0.192	17%	0.17	C	C	.	.			trans	-81.7	64.9	178.9	-72.8	-102.1	0	0	0	110.5	H158 S160 S161 A186 Y187 T188 Y386	H158-Y163 HydrophobicContact CB-CD1 4.27Å; H158-Y163 HydrophobicContact CB-CD2 3.69Å; H158-Y163 HydrophobicContact CB-CE1 4.18Å; H158-Y163 HydrophobicContact CB-CE2 3.56Å; H158-Y163 HydrophobicContact CB-CG 4.05Å; H158-Y163 AromaticContact CD2-CE1 3.59Å; H158-Y163 AromaticContact CD2-CZ 3.46Å; H158-Y163 VanDerWaalsContact CD2-CZ 3.46Å; H158-Y163 PolarHBondContact CD2-OH 3.34Å; H158-Y163 AromaticContact CE1-CD1 3.79Å; H158-Y163 AromaticContact CE1-CE1 3.47Å; H158-Y163 VanDerWaalsContact CE1-CE1 3.47Å; H158-Y163 WeakPolarHBondContact CE1-CE1 3.49Å; H158-Y163 AromaticContact CG-CD1 3.79Å; H158-Y163 AromaticContact CG-CE1 3.49Å; H158-Y163 VanDerWaalsContact CG-CE1 3.49Å; H158-Y163 AromaticContact CG-CE2 3.78Å; H158-Y163 AromaticContact CG-CZ 3.47Å; H158-Y163 VanDerWaalsContact CG-CZ 3.47Å; H158-Y163 AromaticContact ND1-CD1 3.42Å; H158-Y163 WeakPolarHBondContact ND1-CD1 3.21Å; H158-Y163 AromaticContact ND1-CE1 3.42Å; H158-Y163 WeakPolarHBondContact ND1-CE1 3.46Å; H158-Y163 AromaticContact ND1-CG 3.94Å; H158-Y163 AromaticContact ND1-CZ 3.93Å; H158-Y163 AromaticContact NE2-CE1 3.61Å; H158-Y163 AromaticContact NE2-CZ 3.94Å; S160-Y163 PolarHBondContact O-N 2.95Å; S161-Y163 VanDerWaalsContact C-N 3.26Å; S161-Y163 PolarHBondContact O-N 2.88Å; Y163-A186 HydrophobicContact CD1-CB 4.15Å; Y163-A186 VanDerWaalsContact CD1-O 3.3Å; Y163-A186 WeakPolarHBondContact CD1-O 3.29Å; Y163-Y187 CarbonylContact C-O 3.55Å; Y163-Y187 WeakPolarHBondContact CA-O 3.21Å; Y163-T188 HydrophobicContact CD1-CG2 4.31Å; Y163-T188 HydrophobicContact CD2-CG2 4Å; Y163-T188 HydrophobicContact CE1-CG2 4.27Å; Y163-T188 HydrophobicContact CE2-CG2 3.95Å; Y163-T188 HydrophobicContact CG-CG2 4.19Å; Y163-Y386 WeakPolarHBondContact O-CE1 3.35Å; Y163-Y386 PolarHBondContact O-OH 2.79Å
164	V	87.1	Confident	86.6	Confident	42 Å²	42	33 Å²	33	26%	0.255	18%	0.182	S	C	.	.			trans	-81.3	-17.9	-174.8	-58.9	0	0	0	0	113.4	S161 S162 Y187	S161-V164 WeakPolarHBondContact O-CG1 3.34Å; S162-V164 PolarHBondContact O-N 2.64Å; V164-Y187 PolarHBondContact N-O 2.97Å
165	Y	91.5	Very high	87.3	Confident	71 Å²	71	35.4 Å²	35.4	28%	0.278	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.1	-179.4	-58.2	-72.4	0	0	0	109.7	A186 Y187 P190 N225	Y165-A186 CarbonylContact O-C 3.45Å; Y165-A186 WeakPolarHBondContact O-CA 3.2Å; Y165-A186 WeakPolarHBondContact O-CB 3.41Å; Y165-Y187 WeakPolarHBondContact CB-O 3.32Å; Y165-Y187 PolarHBondContact N-O 2.99Å; Y165-Y187 PolarHBondContact O-N 3.41Å; Y165-P190 HydrophobicContact CD1-CB 3.9Å; Y165-P190 HydrophobicContact CD2-CB 4.48Å; Y165-P190 HydrophobicContact CE1-CB 3.63Å; Y165-P190 HydrophobicContact CE1-CG 4.3Å; Y165-P190 HydrophobicContact CE2-CB 4.24Å; Y165-P190 VanDerWaalsContact CE2-CD 3.44Å; Y165-P190 HydrophobicContact CE2-CG 4.29Å; Y165-P190 HydrophobicContact CG-CB 4.31Å; Y165-N225 WeakPolarHBondContact CB-OD1 3.16Å
166	G	92.8	Very high	88	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.3	-164.8	176.7	0	0	0	0	0	113.4	G185 N225 Y227 S372 N373 Y386	G166-G185 WeakPolarHBondContact CA-O 3.43Å; G166-N225 PolarHBondContact N-OD1 3.23Å; G166-Y227 VanDerWaalsContact CA-OH 3.32Å; G166-Y227 WeakPolarHBondContact CA-OH 3.43Å; G166-S372 PolarHBondContact N-OG 3.45Å; G166-S372 PolarHBondContact O-OG 2.89Å; G166-N373 WeakPolarHBondContact O-CB 3.36Å; G166-Y386 VanDerWaalsContact C-CD1 3.42Å; G166-Y386 WeakPolarHBondContact O-CB 3.22Å; G166-Y386 WeakPolarHBondContact O-CD1 3.39Å
167	G	94.9	Very high	88.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	146.9	-169.3	0	0	0	0	0	110.1	G185 Y227	G167-G185 PolarHBondContact N-O 2.91Å; G167-G185 PolarHBondContact O-N 3.1Å; G167-Y227 PolarHBondContact N-OH 2.94Å
168	W	97.2	Very high	89	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.6	176.3	78.6	-69.8	0	0	0	108.5	V153 F183 Y184 L205 Y384 M385 Y391 V392	V153-W168 HydrophobicContact CB-CH2 4.28Å; V153-W168 HydrophobicContact CG1-CH2 4.48Å; V153-W168 HydrophobicContact CG2-CH2 3.64Å; V153-W168 HydrophobicContact CG2-CZ2 4Å; W168-F183 VanDerWaalsContact CA-O 3.31Å; W168-F183 WeakPolarHBondContact CA-O 3.45Å; W168-Y184 HydrophobicContact CB-CD2 4.46Å; W168-L205 HydrophobicContact CE3-CD2 3.89Å; W168-L205 HydrophobicContact CZ3-CD2 3.79Å; W168-Y384 AromaticContact CD2-CD1 3.96Å; W168-Y384 HydrophobicContact CD2-CD1 3.96Å; W168-Y384 HydrophobicContact CD2-CE1 4.47Å; W168-Y384 AromaticContact CE2-CD1 3.67Å; W168-Y384 HydrophobicContact CE3-CD1 4Å; W168-Y384 HydrophobicContact CE3-CE1 4.06Å; W168-Y384 AromaticContact CH2-CD1 3.55Å; W168-Y384 HydrophobicContact CH2-CD1 3.55Å; W168-Y384 AromaticContact CH2-CE1 3.43Å; W168-Y384 HydrophobicContact CH2-CE1 3.43Å; W168-Y384 VanDerWaalsContact CH2-CE1 3.43Å; W168-Y384 AromaticContact CZ2-CD1 3.49Å; W168-Y384 HydrophobicContact CZ2-CD1 3.49Å; W168-Y384 VanDerWaalsContact CZ2-CD1 3.49Å; W168-Y384 AromaticContact CZ2-CE1 3.91Å; W168-Y384 HydrophobicContact CZ2-CE1 3.91Å; W168-Y384 AromaticContact CZ3-CD1 3.82Å; W168-Y384 HydrophobicContact CZ3-CD1 3.82Å; W168-Y384 AromaticContact CZ3-CE1 3.53Å; W168-Y384 HydrophobicContact CZ3-CE1 3.53Å; W168-M385 PolarHBondContact NE1-O 3.25Å; W168-Y391 HydrophobicContact CB-CD1 4.07Å; W168-Y391 HydrophobicContact CB-CE1 4.19Å; W168-Y391 HydrophobicContact CB-CG 4.37Å; W168-Y391 AromaticContact CD1-CD1 3.82Å; W168-Y391 HydrophobicContact CD2-CD1 4.24Å; W168-Y391 HydrophobicContact CD2-CD2 4.1Å; W168-Y391 AromaticContact CD2-CG 3.75Å; W168-Y391 HydrophobicContact CD2-CG 3.75Å; W168-Y391 VanDerWaalsContact CE2-CB 3.44Å; W168-Y391 HydrophobicContact CE3-CD2 4.14Å; W168-Y391 HydrophobicContact CE3-CG 4.25Å; W168-Y391 AromaticContact CG-CD1 3.74Å; W168-Y391 HydrophobicContact CG-CD1 3.74Å; W168-Y391 HydrophobicContact CG-CD2 4.32Å; W168-Y391 HydrophobicContact CG-CE1 4.35Å; W168-Y391 AromaticContact CG-CG 3.76Å; W168-Y391 HydrophobicContact CG-CG 3.76Å; W168-V392 WeakPolarHBondContact CZ2-O 3.41Å; W168-V392 PolarHBondContact NE1-O 3.16Å
169	G	96.8	Very high	89.6	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	-155.3	179.1	0	0	0	0	0	111.7	H182 F183	G169-H182 CarbonylContact O-C 3.49Å; G169-H182 VanDerWaalsContact O-CA 3.23Å; G169-H182 WeakPolarHBondContact O-CA 2.98Å; G169-F183 VanDerWaalsContact C-CD1 3.49Å; G169-F183 VanDerWaalsContact C-CE1 3.46Å; G169-F183 PolarHBondContact N-O 2.99Å; G169-F183 VanDerWaalsContact N-O 3.11Å; G169-F183 WeakPolarHBondContact O-CD1 3.36Å; G169-F183 PolarHBondContact O-N 2.85Å
170	K	96.9	Very high	90.4	Very high	17 Å²	17	55 Å²	55	7%	0.074	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	164.7	176.8	-66.3	176.9	70.3	-159.4	0	111.1	S172 E179 L181 F183 N377 D380 Y384	K170-S172 PolarHBondContact O-N 2.86Å; K170-E179 WeakPolarHBondContact CE-O 3.45Å; K170-E179 PolarHBondContact NZ-O 2.94Å; K170-L181 WeakPolarHBondContact CA-O 3.37Å; K170-F183 WeakPolarHBondContact O-CE1 3.49Å; K170-N377 PolarHBondContact O-ND2 3.25Å; K170-D380 WeakPolarHBondContact CD-OD2 3.4Å; K170-D380 IonicContact NZ-OD2 3.86Å; K170-Y384 VanDerWaalsContact CD-OH 3.29Å; K170-Y384 WeakPolarHBondContact CD-OH 3.38Å
171	D	96.9	Very high	91.4	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.016	28%	0.276	C	S	.	.			trans	-60.4	121.4	163.2	-170.2	-24.2	0	0	0	108.9	K173 P174 L181 V229 H230 S231 N232	D171-K173 PolarHBondContact O-N 3.2Å; D171-K173 VanDerWaalsContact OD1-C 3.24Å; D171-K173 PolarHBondContact OD1-N 2.93Å; D171-P174 HydrophobicContact CB-CB 4.21Å; D171-P174 WeakPolarHBondContact O-CD 3.46Å; D171-L181 HydrophobicContact CB-CD2 4.36Å; D171-V229 WeakPolarHBondContact CA-O 3.09Å; D171-V229 HydrophobicContact CB-CG1 3.92Å; D171-H230 VanDerWaalsContact OD1-CA 3.26Å; D171-H230 WeakPolarHBondContact OD1-CA 3.23Å; D171-S231 PolarHBondContact OD1-N 3.27Å; D171-N232 WeakPolarHBondContact OD2-CA 3.28Å; D171-N232 PolarHBondContact OD2-N 3.08Å
172	S	96.8	Very high	92.6	Very high	10 Å²	10	50.4 Å²	50.4	7%	0.07	25%	0.25	C	S	.	.	S	Bend	trans	-72.1	-15.3	-179.4	49.5	0	0	0	0	113.6	K170 V229 H230 A280	K170-S172 PolarHBondContact O-N 2.86Å; S172-V229 PolarHBondContact N-O 2.94Å; S172-V229 PolarHBondContact OG-O 2.86Å; S172-H230 VanDerWaalsContact OG-CB 3.31Å; S172-H230 WeakPolarHBondContact OG-CB 3.47Å; S172-H230 PolarHBondContact OG-ND1 2.91Å; S172-A280 WeakPolarHBondContact OG-CB 2.98Å
173	K	96.1	Very high	93.4	Very high	92 Å²	92	48.2 Å²	48.2	40%	0.4	23%	0.234	S	C	.	.	S	Bend	trans	-140.9	69.7	173.5	-172.6	178	-178.5	-179.1	0	109	D171 H230 S231 E305	D171-K173 PolarHBondContact O-N 3.2Å; D171-K173 VanDerWaalsContact OD1-C 3.24Å; D171-K173 PolarHBondContact OD1-N 2.93Å; K173-H230 VanDerWaalsContact CB-CE1 3.42Å; K173-H230 WeakPolarHBondContact CB-CE1 3.49Å; K173-H230 WeakPolarHBondContact CD-NE2 3.33Å; K173-S231 VanDerWaalsContact O-CA 3.32Å; K173-S231 WeakPolarHBondContact O-CA 3.23Å; K173-S231 PolarHBondContact O-N 3.5Å; K173-E305 IonicContact NZ-OE1 3.08Å; K173-E305 PolarHBondContact NZ-OE1 3.31Å; K173-E305 IonicContact NZ-OE2 3.7Å; K173-E305 PolarHBondContact NZ-OE2 3.42Å
174	P	94	Very high	93.9	Very high	39 Å²	39	45.9 Å²	45.9	25%	0.253	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-65.1	140.8	-170	26.6	-32.6	0	0	0	111.3	D171 E179	D171-P174 HydrophobicContact CB-CB 4.21Å; D171-P174 WeakPolarHBondContact O-CD 3.46Å; P174-E179 HydrophobicContact CG-CB 4.4Å; P174-E179 HydrophobicContact CG-CG 4.34Å
175	I	90.8	Very high	94.3	Very high	66 Å²	66	43.9 Å²	43.9	34%	0.338	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-72.7	154.5	167.9	57.4	167.9	0	0	0	110.2	G177 Y178 N232	I175-G177 PolarHBondContact O-N 3.39Å; I175-Y178 HydrophobicContact CD1-CD2 3.6Å; I175-Y178 HydrophobicContact CD1-CE2 3.91Å; I175-Y178 HydrophobicContact CD1-CG 4.32Å; I175-Y178 HydrophobicContact CG1-CD2 3.6Å; I175-Y178 HydrophobicContact CG1-CE2 4.41Å; I175-Y178 HydrophobicContact CG1-CG 4.06Å; I175-Y178 PolarHBondContact O-N 2.85Å; I175-N232 HydrophobicContact CD1-CB 4.38Å; I175-N232 HydrophobicContact CG2-CB 4.43Å
176	R	90.9	Very high	94.4	Very high	235 Å²	235	40.6 Å²	40.6	89%	0.887	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	128.4	-178.2	-171.2	177.3	-179.1	171.4	0.9	111.6	E179	R176-E179 VanDerWaalsContact CA-OE1 3.32Å; R176-E179 WeakPolarHBondContact CA-OE1 3.4Å
177	G	89.4	Confident	94.3	Very high	61 Å²	61	40.6 Å²	40.6	63%	0.629	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.6	-4.2	-176.8	0	0	0	0	0	115	I175 E179	I175-G177 PolarHBondContact O-N 3.39Å; G177-E179 WeakPolarHBondContact CA-OE2 3.45Å; G177-E179 VanDerWaalsContact N-CD 3.27Å; G177-E179 PolarHBondContact N-OE1 3.38Å; G177-E179 PolarHBondContact N-OE2 3.11Å
178	Y	91.1	Very high	94	Very high	109 Å²	109	44 Å²	44	43%	0.427	22%	0.221	S	C	.	.			trans	-120.8	20.2	178	-67.7	-91.5	0	0	0	112.5	I175 N180 L181	I175-Y178 HydrophobicContact CD1-CD2 3.6Å; I175-Y178 HydrophobicContact CD1-CE2 3.91Å; I175-Y178 HydrophobicContact CD1-CG 4.32Å; I175-Y178 HydrophobicContact CG1-CD2 3.6Å; I175-Y178 HydrophobicContact CG1-CE2 4.41Å; I175-Y178 HydrophobicContact CG1-CG 4.06Å; I175-Y178 PolarHBondContact O-N 2.85Å; Y178-N180 PolarHBondContact O-N 2.78Å; Y178-N180 VanDerWaalsContact O-N 3.12Å; Y178-L181 HydrophobicContact CD1-CD1 3.96Å; Y178-L181 WeakPolarHBondContact O-CB 3.48Å; Y178-L181 PolarHBondContact O-N 2.83Å
179	E	92.3	Very high	93.5	Very high	88 Å²	88	46.8 Å²	46.8	41%	0.411	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.3	-177.8	-59.2	84.3	173.6	0	0	113.3	K170 P174 R176 G177	K170-E179 WeakPolarHBondContact CE-O 3.45Å; K170-E179 PolarHBondContact NZ-O 2.94Å; P174-E179 HydrophobicContact CG-CB 4.4Å; P174-E179 HydrophobicContact CG-CG 4.34Å; R176-E179 VanDerWaalsContact CA-OE1 3.32Å; R176-E179 WeakPolarHBondContact CA-OE1 3.4Å; G177-E179 WeakPolarHBondContact CA-OE2 3.45Å; G177-E179 VanDerWaalsContact N-CD 3.27Å; G177-E179 PolarHBondContact N-OE1 3.38Å; G177-E179 PolarHBondContact N-OE2 3.11Å
180	N	92.1	Very high	92.4	Very high	98 Å²	98	48.4 Å²	48.4	52%	0.524	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	7.5	177.7	-65.2	-43	0	0	0	113.2	Y178 H182 T200 N201	Y178-N180 PolarHBondContact O-N 2.78Å; Y178-N180 VanDerWaalsContact O-N 3.12Å; N180-H182 PolarHBondContact O-CE1 2.68Å; N180-H182 PolarHBondContact O-N 2.84Å; N180-H182 PolarHBondContact O-ND1 2.7Å; N180-T200 CarbonylContact C-O 3.52Å; N180-N201 HydrophobicContact CB-CB 4.29Å; N180-N201 VanDerWaalsContact O-CA 3.31Å; N180-N201 WeakPolarHBondContact O-CA 3.46Å
181	L	94.8	Very high	91.1	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.026	27%	0.267	C	S	.	.			trans	-63	124.1	178.6	-176	93.4	0	0	0	110	K170 D171 Y178 F198 Y199 F211	K170-L181 WeakPolarHBondContact CA-O 3.37Å; D171-L181 HydrophobicContact CB-CD2 4.36Å; Y178-L181 HydrophobicContact CD1-CD1 3.96Å; Y178-L181 WeakPolarHBondContact O-CB 3.48Å; Y178-L181 PolarHBondContact O-N 2.83Å; L181-F198 HydrophobicContact CD1-CB 4.34Å; L181-F198 HydrophobicContact CD1-CD1 4.42Å; L181-F198 HydrophobicContact CD2-CD1 3.93Å; L181-F198 HydrophobicContact CD2-CE1 4.4Å; L181-F198 HydrophobicContact CG-CD1 4.35Å; L181-Y199 WeakPolarHBondContact CA-O 3.34Å; L181-F211 HydrophobicContact CD1-CE1 3.42Å; L181-F211 VanDerWaalsContact CD1-CE1 3.42Å; L181-F211 HydrophobicContact CD1-CZ 3.48Å; L181-F211 VanDerWaalsContact CD1-CZ 3.48Å
182	H	96.8	Very high	90.5	Very high	13 Å²	13	49.8 Å²	49.8	6%	0.06	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	147.5	170.2	-66.1	69.2	0	0	0	110	G169 N180 F198 Y199 Y202 L205	G169-H182 CarbonylContact O-C 3.49Å; G169-H182 VanDerWaalsContact O-CA 3.23Å; G169-H182 WeakPolarHBondContact O-CA 2.98Å; N180-H182 PolarHBondContact O-CE1 2.68Å; N180-H182 PolarHBondContact O-N 2.84Å; N180-H182 PolarHBondContact O-ND1 2.7Å; H182-F198 WeakPolarHBondContact O-CA 3.31Å; H182-Y199 PolarHBondContact N-O 3.16Å; H182-Y199 PolarHBondContact O-N 3.18Å; H182-Y202 AromaticContact NE2-CD2 3.94Å; H182-L205 HydrophobicContact CB-CB 4.45Å; H182-L205 HydrophobicContact CB-CD1 4.33Å; H182-L205 HydrophobicContact CB-CD2 4.13Å
183	F	97.4	Very high	90.2	Very high	9 Å²	9	49.4 Å²	49.4	4%	0.039	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	156.5	171.6	75.3	-91.9	0	0	0	111	W168 G169 K170 Y197 F198 Y227 V229	W168-F183 VanDerWaalsContact CA-O 3.31Å; W168-F183 WeakPolarHBondContact CA-O 3.45Å; G169-F183 VanDerWaalsContact C-CD1 3.49Å; G169-F183 VanDerWaalsContact C-CE1 3.46Å; G169-F183 PolarHBondContact N-O 2.99Å; G169-F183 VanDerWaalsContact N-O 3.11Å; G169-F183 WeakPolarHBondContact O-CD1 3.36Å; G169-F183 PolarHBondContact O-N 2.85Å; K170-F183 WeakPolarHBondContact O-CE1 3.49Å; F183-Y197 CarbonylContact C-O 3.54Å; F183-Y197 VanDerWaalsContact CA-O 3.28Å; F183-Y197 WeakPolarHBondContact CA-O 3.32Å; F183-F198 HydrophobicContact CB-CD1 3.92Å; F183-F198 HydrophobicContact CB-CE1 3.84Å; F183-Y227 HydrophobicContact CE2-CD2 4.04Å; F183-Y227 AromaticContact CE2-CE2 3.93Å; F183-Y227 HydrophobicContact CE2-CE2 3.93Å; F183-V229 HydrophobicContact CB-CG2 3.96Å; F183-V229 HydrophobicContact CD1-CB 3.7Å; F183-V229 HydrophobicContact CD1-CG2 3.37Å; F183-V229 HydrophobicContact CD2-CG2 4.03Å; F183-V229 HydrophobicContact CE1-CB 3.89Å; F183-V229 HydrophobicContact CE1-CG2 3.78Å; F183-V229 HydrophobicContact CE2-CG2 4.39Å; F183-V229 HydrophobicContact CG-CB 4.34Å; F183-V229 HydrophobicContact CG-CG2 3.5Å; F183-V229 HydrophobicContact CZ-CG2 4.28Å
184	Y	96.4	Very high	90.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135	172.3	163.1	-118.8	0	0	0	109.1	N156 H158 W168 A186 F196 Y197 Y386 Y391	N156-Y184 HydrophobicContact CB-CE2 4.13Å; N156-Y184 WeakPolarHBondContact CB-OH 3.38Å; N156-Y184 PolarHBondContact OD1-OH 2.88Å; H158-Y184 AromaticContact CE1-CE1 3.69Å; H158-Y184 AromaticContact ND1-CE1 3.52Å; H158-Y184 AromaticContact ND1-CZ 3.58Å; H158-Y184 PolarHBondContact ND1-OH 3.32Å; W168-Y184 HydrophobicContact CB-CD2 4.46Å; Y184-A186 HydrophobicContact CE2-CB 3.44Å; Y184-A186 VanDerWaalsContact CE2-CB 3.44Å; Y184-A186 WeakPolarHBondContact OH-CB 3.25Å; Y184-F196 CarbonylContact O-C 3.59Å; Y184-F196 WeakPolarHBondContact O-CA 3.27Å; Y184-Y197 AromaticContact CD1-CD2 3.75Å; Y184-Y197 HydrophobicContact CD1-CD2 3.75Å; Y184-Y197 HydrophobicContact CD1-CG 4.17Å; Y184-Y197 HydrophobicContact CE1-CD2 4.15Å; Y184-Y197 HydrophobicContact CE1-CE2 4.48Å; Y184-Y197 PolarHBondContact N-O 2.95Å; Y184-Y197 PolarHBondContact O-N 2.79Å; Y184-Y386 HydrophobicContact CE2-CE2 4.09Å; Y184-Y391 WeakPolarHBondContact CD1-OH 3.17Å; Y184-Y391 AromaticContact CD2-CE1 3.45Å; Y184-Y391 HydrophobicContact CD2-CE1 3.45Å; Y184-Y391 VanDerWaalsContact CD2-CE1 3.45Å; Y184-Y391 AromaticContact CD2-CZ 3.49Å; Y184-Y391 VanDerWaalsContact CD2-CZ 3.49Å; Y184-Y391 WeakPolarHBondContact CD2-OH 3.41Å; Y184-Y391 AromaticContact CE2-CE1 3.56Å; Y184-Y391 HydrophobicContact CE2-CE1 3.56Å; Y184-Y391 AromaticContact CE2-CZ 3.82Å; Y184-Y391 VanDerWaalsContact CE2-OH 3.22Å; Y184-Y391 WeakPolarHBondContact CE2-OH 3.36Å; Y184-Y391 HydrophobicContact CG-CE1 4.28Å; Y184-Y391 AromaticContact CG-CZ 3.85Å
185	G	95.4	Very high	90.2	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.7	160.3	0	0	0	0	0	107.9	G166 G167 Y227	G166-G185 WeakPolarHBondContact CA-O 3.43Å; G167-G185 PolarHBondContact N-O 2.91Å; G167-G185 PolarHBondContact O-N 3.1Å; G185-Y227 WeakPolarHBondContact CA-OH 3.32Å; G185-Y227 PolarHBondContact O-OH 3.45Å
186	A	92.1	Very high	90.5	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	161.8	163.8	0	0	0	0	0	110.5	Y163 Y165 Y184 Y386	Y163-A186 HydrophobicContact CD1-CB 4.15Å; Y163-A186 VanDerWaalsContact CD1-O 3.3Å; Y163-A186 WeakPolarHBondContact CD1-O 3.29Å; Y165-A186 CarbonylContact O-C 3.45Å; Y165-A186 WeakPolarHBondContact O-CA 3.2Å; Y165-A186 WeakPolarHBondContact O-CB 3.41Å; Y184-A186 HydrophobicContact CE2-CB 3.44Å; Y184-A186 VanDerWaalsContact CE2-CB 3.44Å; Y184-A186 WeakPolarHBondContact OH-CB 3.25Å; A186-Y386 HydrophobicContact CB-CE1 3.96Å; A186-Y386 WeakPolarHBondContact CB-OH 3.17Å
187	Y	92.4	Very high	90.8	Very high	1 Å²	1	34 Å²	34	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	154.2	-163.6	-43.6	-65.2	0	0	0	109.7	Y163 V164 Y165 G192 V193 Y194 D195 Y227	Y163-Y187 CarbonylContact C-O 3.55Å; Y163-Y187 WeakPolarHBondContact CA-O 3.21Å; V164-Y187 PolarHBondContact N-O 2.97Å; Y165-Y187 WeakPolarHBondContact CB-O 3.32Å; Y165-Y187 PolarHBondContact N-O 2.99Å; Y165-Y187 PolarHBondContact O-N 3.41Å; Y187-G192 WeakPolarHBondContact CB-O 3.31Å; Y187-G192 WeakPolarHBondContact CD1-O 3.49Å; Y187-G192 WeakPolarHBondContact CD2-O 3.07Å; Y187-V193 HydrophobicContact CD2-CG2 4.33Å; Y187-V193 HydrophobicContact CE2-CB 3.99Å; Y187-V193 HydrophobicContact CE2-CG1 3.95Å; Y187-V193 HydrophobicContact CE2-CG2 3.86Å; Y187-V193 WeakPolarHBondContact OH-CG1 3.33Å; Y187-Y194 AromaticContact CD1-CD1 3.86Å; Y187-Y194 HydrophobicContact CD1-CD1 3.86Å; Y187-Y194 HydrophobicContact CD1-CD2 4.41Å; Y187-Y194 AromaticContact CD1-CE1 3.44Å; Y187-Y194 HydrophobicContact CD1-CE1 3.44Å; Y187-Y194 VanDerWaalsContact CD1-CE1 3.44Å; Y187-Y194 HydrophobicContact CD1-CE2 4.04Å; Y187-Y194 HydrophobicContact CD1-CG 4.33Å; Y187-Y194 AromaticContact CD1-CZ 3.54Å; Y187-Y194 HydrophobicContact CE1-CD1 4.18Å; Y187-Y194 HydrophobicContact CE1-CD2 4.33Å; Y187-Y194 HydrophobicContact CE1-CE1 4.17Å; Y187-Y194 HydrophobicContact CE1-CE2 4.31Å; Y187-Y194 HydrophobicContact CE1-CG 4.25Å; Y187-Y194 HydrophobicContact CG-CE1 4.13Å; Y187-D195 HydrophobicContact CE1-CB 4.33Å; Y187-D195 PolarHBondContact OH-O 3.34Å; Y187-Y227 AromaticContact CE2-CE1 3.87Å; Y187-Y227 HydrophobicContact CE2-CE1 3.87Å
188	T	88.6	Confident	91.2	Very high	72 Å²	72	31.1 Å²	31.1	44%	0.442	17%	0.17	S	C	.	.	S	Bend	trans	-88.8	-10.3	177.4	57.4	0	0	0	0	112.7	S162 Y163	S162-T188 WeakPolarHBondContact O-CA 3.46Å; Y163-T188 HydrophobicContact CD1-CG2 4.31Å; Y163-T188 HydrophobicContact CD2-CG2 4Å; Y163-T188 HydrophobicContact CE1-CG2 4.27Å; Y163-T188 HydrophobicContact CE2-CG2 3.95Å; Y163-T188 HydrophobicContact CG-CG2 4.19Å
189	S	85.2	Confident	91.4	Very high	62 Å²	62	26.1 Å²	26.1	43%	0.434	15%	0.151	S	C	.	.	S	Bend	trans	-127.1	140.5	-179.2	173.3	0	0	0	0	110.6	G191	S189-G191 PolarHBondContact O-N 3.48Å; S189-G191 VanDerWaalsContact O-N 3.1Å; S189-G191 PolarHBondContact OG-N 2.93Å
190	P	73.9	Confident	91.5	Very high	35 Å²	35	24.9 Å²	24.9	23%	0.227	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-8.8	179.5	28.6	-34.1	0	0	0	113.5	Y165 G224 S273	Y165-P190 HydrophobicContact CD1-CB 3.9Å; Y165-P190 HydrophobicContact CD2-CB 4.48Å; Y165-P190 HydrophobicContact CE1-CB 3.63Å; Y165-P190 HydrophobicContact CE1-CG 4.3Å; Y165-P190 HydrophobicContact CE2-CB 4.24Å; Y165-P190 VanDerWaalsContact CE2-CD 3.44Å; Y165-P190 HydrophobicContact CE2-CG 4.29Å; Y165-P190 HydrophobicContact CG-CB 4.31Å; P190-G224 PolarHBondContact O-N 3.03Å; P190-S273 PolarHBondContact O-OG 3.12Å
191	G	70.8	Confident	91.4	Very high	40 Å²	40	22.7 Å²	22.7	41%	0.412	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	7.7	-171.5	0	0	0	0	0	115.7	S189	S189-G191 PolarHBondContact O-N 3.48Å; S189-G191 VanDerWaalsContact O-N 3.1Å; S189-G191 PolarHBondContact OG-N 2.93Å
192	G	83.3	Confident	91.1	Very high	10 Å²	10	24 Å²	24	10%	0.103	14%	0.142	C	C	.	.			trans	-139	106.3	-176.4	0	0	0	0	0	112.7	Y187 Y194	Y187-G192 WeakPolarHBondContact CB-O 3.31Å; Y187-G192 WeakPolarHBondContact CD1-O 3.49Å; Y187-G192 WeakPolarHBondContact CD2-O 3.07Å; G192-Y194 VanDerWaalsContact O-CD1 3.31Å; G192-Y194 WeakPolarHBondContact O-CD1 3.35Å; G192-Y194 WeakPolarHBondContact O-CE1 2.9Å
193	V	91.5	Very high	90.6	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-102.7	103.2	166	179	0	0	0	0	107.6	Y187 F196 G222 G224 Y227	Y187-V193 HydrophobicContact CD2-CG2 4.33Å; Y187-V193 HydrophobicContact CE2-CB 3.99Å; Y187-V193 HydrophobicContact CE2-CG1 3.95Å; Y187-V193 HydrophobicContact CE2-CG2 3.86Å; Y187-V193 WeakPolarHBondContact OH-CG1 3.33Å; V193-F196 HydrophobicContact CG1-CE1 4.34Å; V193-F196 HydrophobicContact CG1-CE2 3.69Å; V193-F196 HydrophobicContact CG1-CZ 3.31Å; V193-G222 PolarHBondContact N-O 3.24Å; V193-G222 PolarHBondContact O-N 2.92Å; V193-G224 WeakPolarHBondContact CG2-O 3.44Å; V193-Y227 HydrophobicContact CG1-CD1 3.9Å; V193-Y227 HydrophobicContact CG1-CE1 4.05Å; V193-Y227 HydrophobicContact CG2-CD1 4.04Å; V193-Y227 HydrophobicContact CG2-CE1 4.06Å
194	Y	94.1	Very high	90.2	Very high	69 Å²	69	27.3 Å²	27.3	27%	0.271	16%	0.159	S	C	.	.			trans	-138.3	-18	-169.7	54.1	-96.6	0	0	0	115	Y187 G192 T215 L216	Y187-Y194 AromaticContact CD1-CD1 3.86Å; Y187-Y194 HydrophobicContact CD1-CD1 3.86Å; Y187-Y194 HydrophobicContact CD1-CD2 4.41Å; Y187-Y194 AromaticContact CD1-CE1 3.44Å; Y187-Y194 HydrophobicContact CD1-CE1 3.44Å; Y187-Y194 VanDerWaalsContact CD1-CE1 3.44Å; Y187-Y194 HydrophobicContact CD1-CE2 4.04Å; Y187-Y194 HydrophobicContact CD1-CG 4.33Å; Y187-Y194 AromaticContact CD1-CZ 3.54Å; Y187-Y194 HydrophobicContact CE1-CD1 4.18Å; Y187-Y194 HydrophobicContact CE1-CD2 4.33Å; Y187-Y194 HydrophobicContact CE1-CE1 4.17Å; Y187-Y194 HydrophobicContact CE1-CE2 4.31Å; Y187-Y194 HydrophobicContact CE1-CG 4.25Å; Y187-Y194 HydrophobicContact CG-CE1 4.13Å; G192-Y194 VanDerWaalsContact O-CD1 3.31Å; G192-Y194 WeakPolarHBondContact O-CD1 3.35Å; G192-Y194 WeakPolarHBondContact O-CE1 2.9Å; Y194-T215 CarbonylContact O-C 3.56Å; Y194-T215 VanDerWaalsContact O-CA 3.25Å; Y194-T215 WeakPolarHBondContact O-CA 3.49Å; Y194-L216 PolarHBondContact O-N 3.3Å
195	D	95.2	Very high	89.9	Confident	11 Å²	11	27.3 Å²	27.3	6%	0.059	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.1	-177.4	-90.6	-45.1	0	0	0	111.1	Y187 Y197 R213 I214 T215	Y187-D195 HydrophobicContact CE1-CB 4.33Å; Y187-D195 PolarHBondContact OH-O 3.34Å; D195-Y197 HydrophobicContact CB-CE2 4.03Å; D195-R213 VanDerWaalsContact CG-NH2 3.3Å; D195-R213 IonicContact OD1-CZ 2.99Å; D195-R213 IonicContact OD1-NE 3.96Å; D195-R213 PolarHBondContact OD1-NE 3.47Å; D195-R213 VanDerWaalsContact OD1-NE 3.08Å; D195-R213 IonicContact OD1-NH2 2.79Å; D195-R213 PolarHBondContact OD1-NH2 2.79Å; D195-R213 IonicContact OD2-CZ 3.53Å; D195-R213 IonicContact OD2-NE 3.28Å; D195-R213 IonicContact OD2-NH2 3.89Å; D195-R213 PolarHBondContact OD2-NH2 2.99Å; D195-I214 CarbonylContact C-O 3.53Å; D195-I214 WeakPolarHBondContact CA-O 3.41Å; D195-T215 WeakPolarHBondContact OD1-CB 3.42Å; D195-T215 PolarHBondContact OD1-OG1 2.81Å
196	F	97.4	Very high	89.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.9	176.5	-65.4	-93.7	0	0	0	110.9	Y184 V193 F198 R213 I214 L216 Y227 I234	Y184-F196 CarbonylContact O-C 3.59Å; Y184-F196 WeakPolarHBondContact O-CA 3.27Å; V193-F196 HydrophobicContact CG1-CE1 4.34Å; V193-F196 HydrophobicContact CG1-CE2 3.69Å; V193-F196 HydrophobicContact CG1-CZ 3.31Å; F196-F198 HydrophobicContact CB-CE2 3.8Å; F196-F198 HydrophobicContact CB-CZ 4.22Å; F196-R213 CarbonylContact O-C 3.57Å; F196-R213 VanDerWaalsContact O-CA 3.31Å; F196-R213 WeakPolarHBondContact O-CA 3.32Å; F196-I214 HydrophobicContact CB-CB 4.39Å; F196-I214 PolarHBondContact N-O 3.42Å; F196-I214 PolarHBondContact O-N 3.31Å; F196-L216 HydrophobicContact CE2-CD1 3.94Å; F196-L216 HydrophobicContact CE2-CG 4.24Å; F196-Y227 HydrophobicContact CD1-CE2 4.44Å; F196-Y227 AromaticContact CE1-CD2 3.59Å; F196-Y227 HydrophobicContact CE1-CD2 3.59Å; F196-Y227 AromaticContact CE1-CE2 3.67Å; F196-Y227 HydrophobicContact CE1-CE2 3.67Å; F196-Y227 HydrophobicContact CE1-CG 4.08Å; F196-Y227 HydrophobicContact CZ-CD2 4.28Å; F196-Y227 HydrophobicContact CZ-CG 4.31Å; F196-I234 HydrophobicContact CB-CD1 4Å; F196-I234 HydrophobicContact CD1-CD1 3.95Å; F196-I234 HydrophobicContact CD1-CG2 4.27Å; F196-I234 HydrophobicContact CD2-CD1 3.58Å; F196-I234 HydrophobicContact CE1-CD1 4.28Å; F196-I234 HydrophobicContact CE1-CG2 3.63Å; F196-I234 HydrophobicContact CE2-CD1 3.96Å; F196-I234 HydrophobicContact CE2-CG2 4.05Å; F196-I234 HydrophobicContact CG-CD1 3.57Å; F196-I234 HydrophobicContact CZ-CD1 4.29Å; F196-I234 HydrophobicContact CZ-CG2 3.5Å; F196-I234 VanDerWaalsContact CZ-CG2 3.5Å
197	Y	97.4	Very high	88.7	Confident	28 Å²	28	29.4 Å²	29.4	11%	0.11	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.2	-179.4	-59	-100.3	0	0	0	108.9	H158 F183 Y184 D195 N210 R213	H158-Y197 AromaticContact CE1-CE2 3.78Å; H158-Y197 AromaticContact NE2-CE2 3.87Å; H158-Y197 AromaticContact NE2-CZ 3.78Å; H158-Y197 PolarHBondContact NE2-OH 3.44Å; F183-Y197 CarbonylContact C-O 3.54Å; F183-Y197 VanDerWaalsContact CA-O 3.28Å; F183-Y197 WeakPolarHBondContact CA-O 3.32Å; Y184-Y197 AromaticContact CD1-CD2 3.75Å; Y184-Y197 HydrophobicContact CD1-CD2 3.75Å; Y184-Y197 HydrophobicContact CD1-CG 4.17Å; Y184-Y197 HydrophobicContact CE1-CD2 4.15Å; Y184-Y197 HydrophobicContact CE1-CE2 4.48Å; Y184-Y197 PolarHBondContact N-O 2.95Å; Y184-Y197 PolarHBondContact O-N 2.79Å; D195-Y197 HydrophobicContact CB-CE2 4.03Å; Y197-N210 HydrophobicContact CD1-CB 4.45Å; Y197-R213 HydrophobicContact CD1-CB 4.44Å; Y197-R213 HydrophobicContact CD1-CG 4.23Å; Y197-R213 HydrophobicContact CE1-CG 4Å; Y197-R213 PolarHBondContact OH-NE 2.88Å
198	F	97.1	Very high	88.3	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.1	-179.2	-63.9	-90.7	0	0	0	111	L181 H182 F183 F196 N210 F211 K212 I214 V229 I234 L249	L181-F198 HydrophobicContact CD1-CB 4.34Å; L181-F198 HydrophobicContact CD1-CD1 4.42Å; L181-F198 HydrophobicContact CD2-CD1 3.93Å; L181-F198 HydrophobicContact CD2-CE1 4.4Å; L181-F198 HydrophobicContact CG-CD1 4.35Å; H182-F198 WeakPolarHBondContact O-CA 3.31Å; F183-F198 HydrophobicContact CB-CD1 3.92Å; F183-F198 HydrophobicContact CB-CE1 3.84Å; F196-F198 HydrophobicContact CB-CE2 3.8Å; F196-F198 HydrophobicContact CB-CZ 4.22Å; F198-N210 CarbonylContact O-C 3.56Å; F198-N210 VanDerWaalsContact O-CA 3.26Å; F198-N210 WeakPolarHBondContact O-CA 3.45Å; F198-N210 WeakPolarHBondContact O-CB 3.28Å; F198-F211 HydrophobicContact CB-CD1 4.24Å; F198-F211 HydrophobicContact CB-CE1 3.51Å; F198-F211 HydrophobicContact CB-CZ 3.81Å; F198-F211 WeakPolarHBondContact O-CD1 3.31Å; F198-F211 WeakPolarHBondContact O-CE1 3.38Å; F198-F211 PolarHBondContact O-N 2.92Å; F198-K212 HydrophobicContact CB-CB 4.21Å; F198-K212 HydrophobicContact CD2-CB 4.43Å; F198-K212 PolarHBondContact N-O 3.08Å; F198-I214 HydrophobicContact CD2-CG1 4.43Å; F198-I214 HydrophobicContact CE2-CB 4.37Å; F198-I214 HydrophobicContact CE2-CG1 3.88Å; F198-V229 HydrophobicContact CE1-CG1 4.49Å; F198-V229 HydrophobicContact CE1-CG2 4.06Å; F198-V229 HydrophobicContact CZ-CG2 4.5Å; F198-I234 HydrophobicContact CE2-CD1 4.37Å; F198-I234 HydrophobicContact CZ-CD1 3.92Å; F198-I234 HydrophobicContact CZ-CG1 4.14Å; F198-L249 HydrophobicContact CD1-CD1 4.48Å; F198-L249 HydrophobicContact CE1-CD1 3.6Å; F198-L249 HydrophobicContact CE2-CD1 4.38Å; F198-L249 HydrophobicContact CE2-CD2 3.88Å; F198-L249 HydrophobicContact CZ-CD1 3.54Å; F198-L249 HydrophobicContact CZ-CD2 3.65Å; F198-L249 HydrophobicContact CZ-CG 4.26Å
199	Y	95.9	Very high	88.2	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136	-177.4	-54.2	-91.3	0	0	0	108.7	L181 H182 N201 N204 L205 K209 N210	L181-Y199 WeakPolarHBondContact CA-O 3.34Å; H182-Y199 PolarHBondContact N-O 3.16Å; H182-Y199 PolarHBondContact O-N 3.18Å; Y199-N201 PolarHBondContact O-N 2.99Å; Y199-N204 VanDerWaalsContact CD1-O 3.24Å; Y199-N204 WeakPolarHBondContact CD1-O 3.48Å; Y199-L205 HydrophobicContact CD1-CB 4.47Å; Y199-L205 HydrophobicContact CD2-CB 4.42Å; Y199-L205 HydrophobicContact CD2-CD1 3.41Å; Y199-L205 VanDerWaalsContact CD2-CD1 3.41Å; Y199-L205 HydrophobicContact CE2-CD1 3.56Å; Y199-L205 HydrophobicContact CG-CB 4.09Å; Y199-L205 HydrophobicContact CG-CD1 3.93Å; Y199-K209 WeakPolarHBondContact CD1-O 3.23Å; Y199-N210 HydrophobicContact CD1-CB 3.95Å; Y199-N210 HydrophobicContact CE1-CB 3.56Å; Y199-N210 VanDerWaalsContact CE1-N 3.33Å; Y199-N210 HydrophobicContact CE2-CB 4.49Å
200	T	93.4	Very high	88.6	Confident	62 Å²	62	34.5 Å²	34.5	38%	0.38	18%	0.179	S	C	.	.	S	Bend	trans	-69.7	-25.3	-174.1	58.5	0	0	0	0	113	N180 N204 F211	N180-T200 CarbonylContact C-O 3.52Å; T200-N204 PolarHBondContact OG1-ND2 3.25Å; T200-F211 HydrophobicContact CG2-CB 3.99Å; T200-F211 HydrophobicContact CG2-CD1 3.42Å; T200-F211 VanDerWaalsContact CG2-CD1 3.42Å; T200-F211 HydrophobicContact CG2-CE1 4Å; T200-F211 HydrophobicContact CG2-CG 3.72Å
201	N	90.5	Very high	89.5	Confident	52 Å²	52	37.4 Å²	37.4	28%	0.278	19%	0.189	S	C	.	.	S	Bend	trans	-159.1	174.4	-178.4	59.3	35.8	0	0	0	109.9	N180 Y199 E203 N204 L205	N180-N201 HydrophobicContact CB-CB 4.29Å; N180-N201 VanDerWaalsContact O-CA 3.31Å; N180-N201 WeakPolarHBondContact O-CA 3.46Å; Y199-N201 PolarHBondContact O-N 2.99Å; N201-E203 PolarHBondContact OD1-N 3.28Å; N201-N204 PolarHBondContact O-N 3.43Å; N201-N204 WeakPolarHBondContact OD1-CB 3.14Å; N201-N204 PolarHBondContact OD1-N 2.86Å; N201-L205 PolarHBondContact O-N 2.83Å; N201-L205 VanDerWaalsContact O-N 3.12Å
202	Y	88.4	Confident	90.6	Very high	32 Å²	32	38.9 Å²	38.9	13%	0.125	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-39.3	-179.9	-174.2	-116.9	0	0	0	113.1	Q119 M120 E123 V153 H182 N204 L205 L206	Q119-Y202 PolarHBondContact NE2-OH 2.85Å; M120-Y202 HydrophobicContact CG-CD1 4.16Å; M120-Y202 HydrophobicContact CG-CE1 4.43Å; E123-Y202 WeakPolarHBondContact OE1-CE1 3.4Å; E123-Y202 PolarHBondContact OE1-OH 2.77Å; V153-Y202 HydrophobicContact CG1-CE2 3.64Å; V153-Y202 WeakPolarHBondContact CG1-OH 3.48Å; V153-Y202 HydrophobicContact CG2-CE2 4.37Å; H182-Y202 AromaticContact NE2-CD2 3.94Å; Y202-N204 PolarHBondContact O-N 3.45Å; Y202-L205 HydrophobicContact CD2-CD2 4.09Å; Y202-L205 HydrophobicContact CE2-CD2 4.34Å; Y202-L205 WeakPolarHBondContact O-CA 3.08Å; Y202-L205 VanDerWaalsContact O-CB 3.28Å; Y202-L205 WeakPolarHBondContact O-CB 3.17Å; Y202-L205 PolarHBondContact O-N 3.22Å; Y202-L205 VanDerWaalsContact O-N 3.1Å; Y202-L206 HydrophobicContact CD1-CD1 4.04Å; Y202-L206 HydrophobicContact CD1-CG 4.4Å; Y202-L206 HydrophobicContact CE1-CD1 3.66Å; Y202-L206 HydrophobicContact CE1-CD2 4.43Å; Y202-L206 HydrophobicContact CE1-CG 4.18Å; Y202-L206 HydrophobicContact CE2-CD2 4.23Å; Y202-L206 HydrophobicContact CE2-CG 4.49Å; Y202-L206 WeakPolarHBondContact O-CG 3.41Å; Y202-L206 PolarHBondContact O-N 3.37Å
203	E	85.7	Confident	91.2	Very high	62 Å²	62	44.7 Å²	44.7	29%	0.29	20%	0.202	S	C	.	.	H	α-helix	trans	-58.3	-47.6	176.6	-175.5	-177.5	-174	0	0	111.3	H113 M120 N201 L205 L206 L207	H113-E203 IonicContact CE1-OE1 3.91Å; H113-E203 IonicContact ND1-OE1 2.79Å; M120-E203 HydrophobicContact SD-CB 3.98Å; M120-E203 HydrophobicContact SD-CG 4.25Å; N201-E203 PolarHBondContact OD1-N 3.28Å; E203-L205 VanDerWaalsContact C-N 3.28Å; E203-L205 PolarHBondContact O-N 2.7Å; E203-L206 PolarHBondContact O-N 3.46Å; E203-L206 VanDerWaalsContact O-N 3.16Å; E203-L207 HydrophobicContact CG-CD1 4.08Å; E203-L207 WeakPolarHBondContact O-CB 3.18Å; E203-L207 WeakPolarHBondContact O-CG 3.21Å; E203-L207 PolarHBondContact O-N 2.89Å
204	N	89.8	Confident	91.5	Very high	30 Å²	30	45.7 Å²	45.7	16%	0.16	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-30.8	177.2	-79.8	-25.6	0	0	0	112.5	Y199 T200 N201 Y202 R208 K209	Y199-N204 VanDerWaalsContact CD1-O 3.24Å; Y199-N204 WeakPolarHBondContact CD1-O 3.48Å; T200-N204 PolarHBondContact OG1-ND2 3.25Å; N201-N204 PolarHBondContact O-N 3.43Å; N201-N204 WeakPolarHBondContact OD1-CB 3.14Å; N201-N204 PolarHBondContact OD1-N 2.86Å; Y202-N204 PolarHBondContact O-N 3.45Å; N204-R208 PolarHBondContact O-N 3.15Å; N204-R208 VanDerWaalsContact O-N 3.08Å; N204-K209 HydrophobicContact CB-CB 4.43Å; N204-K209 PolarHBondContact O-N 3.36Å
205	L	89.9	Confident	91.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-50.2	170.3	179.2	72.5	0	0	0	110.7	Q154 W168 H182 Y199 N201 Y202 E203 L207 R208 Y391	Q154-L205 PolarHBondContact NE2-O 3.4Å; W168-L205 HydrophobicContact CE3-CD2 3.89Å; W168-L205 HydrophobicContact CZ3-CD2 3.79Å; H182-L205 HydrophobicContact CB-CB 4.45Å; H182-L205 HydrophobicContact CB-CD1 4.33Å; H182-L205 HydrophobicContact CB-CD2 4.13Å; Y199-L205 HydrophobicContact CD1-CB 4.47Å; Y199-L205 HydrophobicContact CD2-CB 4.42Å; Y199-L205 HydrophobicContact CD2-CD1 3.41Å; Y199-L205 VanDerWaalsContact CD2-CD1 3.41Å; Y199-L205 HydrophobicContact CE2-CD1 3.56Å; Y199-L205 HydrophobicContact CG-CB 4.09Å; Y199-L205 HydrophobicContact CG-CD1 3.93Å; N201-L205 PolarHBondContact O-N 2.83Å; N201-L205 VanDerWaalsContact O-N 3.12Å; Y202-L205 HydrophobicContact CD2-CD2 4.09Å; Y202-L205 HydrophobicContact CE2-CD2 4.34Å; Y202-L205 WeakPolarHBondContact O-CA 3.08Å; Y202-L205 VanDerWaalsContact O-CB 3.28Å; Y202-L205 WeakPolarHBondContact O-CB 3.17Å; Y202-L205 PolarHBondContact O-N 3.22Å; Y202-L205 VanDerWaalsContact O-N 3.1Å; E203-L205 VanDerWaalsContact C-N 3.28Å; E203-L205 PolarHBondContact O-N 2.7Å; L205-L207 VanDerWaalsContact C-N 3.31Å; L205-L207 PolarHBondContact O-N 2.94Å; L205-R208 PolarHBondContact O-N 3.07Å; L205-Y391 HydrophobicContact CD1-CD2 4.45Å; L205-Y391 HydrophobicContact CD1-CE2 3.83Å; L205-Y391 HydrophobicContact CD2-CD2 4.36Å; L205-Y391 HydrophobicContact CG-CE2 4.25Å
206	L	81.4	Confident	91.6	Very high	6 Å²	6	46 Å²	46	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-38.9	179.3	-62.8	-176.7	0	0	0	112.5	A116 Q119 V153 Q154 Y202 E203 R208	A116-L206 HydrophobicContact CB-CB 3.77Å; A116-L206 HydrophobicContact CB-CD1 3.85Å; A116-L206 HydrophobicContact CB-CG 4.48Å; Q119-L206 HydrophobicContact CB-CD1 4.07Å; Q119-L206 HydrophobicContact CG-CD1 4.02Å; V153-L206 HydrophobicContact CG1-CD2 3.54Å; Q154-L206 HydrophobicContact CG-CD2 4.4Å; Q154-L206 PolarHBondContact OE1-O 3.08Å; Q154-L206 VanDerWaalsContact OE1-O 3.08Å; Y202-L206 HydrophobicContact CD1-CD1 4.04Å; Y202-L206 HydrophobicContact CD1-CG 4.4Å; Y202-L206 HydrophobicContact CE1-CD1 3.66Å; Y202-L206 HydrophobicContact CE1-CD2 4.43Å; Y202-L206 HydrophobicContact CE1-CG 4.18Å; Y202-L206 HydrophobicContact CE2-CD2 4.23Å; Y202-L206 HydrophobicContact CE2-CG 4.49Å; Y202-L206 WeakPolarHBondContact O-CG 3.41Å; Y202-L206 PolarHBondContact O-N 3.37Å; E203-L206 PolarHBondContact O-N 3.46Å; E203-L206 VanDerWaalsContact O-N 3.16Å; L206-R208 PolarHBondContact O-N 3.29Å; L206-R208 PolarHBondContact O-NH1 3.19Å
207	L	80.6	Confident	91.5	Very high	39 Å²	39	48.4 Å²	48.4	20%	0.204	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.3	175.1	-66.8	178.5	0	0	0	113.4	R112 H113 A116 E203 L205 K209	R112-L207 HydrophobicContact CB-CD2 3.89Å; H113-L207 HydrophobicContact CB-CD2 4.15Å; A116-L207 HydrophobicContact CB-CD2 4.32Å; E203-L207 HydrophobicContact CG-CD1 4.08Å; E203-L207 WeakPolarHBondContact O-CB 3.18Å; E203-L207 WeakPolarHBondContact O-CG 3.21Å; E203-L207 PolarHBondContact O-N 2.89Å; L205-L207 VanDerWaalsContact C-N 3.31Å; L205-L207 PolarHBondContact O-N 2.94Å; L207-K209 HydrophobicContact CB-CB 4.26Å; L207-K209 PolarHBondContact O-N 3.1Å
208	R	84.3	Confident	91.2	Very high	43 Å²	43	54.4 Å²	54.4	16%	0.162	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	31	-172.4	-61	171.1	-175.5	71.1	-1.6	112.7	Q154 F155 N156 L159 N204 L205 L206 N210	Q154-R208 VanDerWaalsContact OE1-CZ 3.25Å; Q154-R208 VanDerWaalsContact OE1-NH1 3.08Å; F155-R208 PolarHBondContact O-NH2 3.3Å; N156-R208 PolarHBondContact O-NE 3.41Å; L159-R208 VanDerWaalsContact CD2-NE 3.25Å; N204-R208 PolarHBondContact O-N 3.15Å; N204-R208 VanDerWaalsContact O-N 3.08Å; L205-R208 PolarHBondContact O-N 3.07Å; L206-R208 PolarHBondContact O-N 3.29Å; L206-R208 PolarHBondContact O-NH1 3.19Å; R208-N210 PolarHBondContact O-N 3.32Å
209	K	86.9	Confident	91	Very high	140 Å²	140	60.8 Å²	60.8	61%	0.609	30%	0.296	S	S	*	.			trans	-93.9	79.2	178.6	-171	178.8	179.7	178.4	0	110.3	Y199 N204 L207	Y199-K209 WeakPolarHBondContact CD1-O 3.23Å; N204-K209 HydrophobicContact CB-CB 4.43Å; N204-K209 PolarHBondContact O-N 3.36Å; L207-K209 HydrophobicContact CB-CB 4.26Å; L207-K209 PolarHBondContact O-N 3.1Å
210	N	93.2	Very high	91	Very high	59 Å²	59	62.9 Å²	62.9	32%	0.316	30%	0.304	S	S	.	.			trans	-71.9	142.1	177.6	73.3	-65.9	0	0	0	110.2	Y197 F198 Y199 R208 K212	Y197-N210 HydrophobicContact CD1-CB 4.45Å; F198-N210 CarbonylContact O-C 3.56Å; F198-N210 VanDerWaalsContact O-CA 3.26Å; F198-N210 WeakPolarHBondContact O-CA 3.45Å; F198-N210 WeakPolarHBondContact O-CB 3.28Å; Y199-N210 HydrophobicContact CD1-CB 3.95Å; Y199-N210 HydrophobicContact CE1-CB 3.56Å; Y199-N210 VanDerWaalsContact CE1-N 3.33Å; Y199-N210 HydrophobicContact CE2-CB 4.49Å; R208-N210 PolarHBondContact O-N 3.32Å; N210-K212 PolarHBondContact ND2-O 2.9Å; N210-K212 VanDerWaalsContact ND2-O 3.12Å
211	F	93.7	Very high	91.1	Very high	96 Å²	96	61.6 Å²	61.6	42%	0.421	30%	0.296	S	S	.	.	S	Bend	trans	-94.4	-19.8	174.1	76.9	-84.2	0	0	0	112.1	L181 F198 T200	L181-F211 HydrophobicContact CD1-CE1 3.42Å; L181-F211 VanDerWaalsContact CD1-CE1 3.42Å; L181-F211 HydrophobicContact CD1-CZ 3.48Å; L181-F211 VanDerWaalsContact CD1-CZ 3.48Å; F198-F211 HydrophobicContact CB-CD1 4.24Å; F198-F211 HydrophobicContact CB-CE1 3.51Å; F198-F211 HydrophobicContact CB-CZ 3.81Å; F198-F211 WeakPolarHBondContact O-CD1 3.31Å; F198-F211 WeakPolarHBondContact O-CE1 3.38Å; F198-F211 PolarHBondContact O-N 2.92Å; T200-F211 HydrophobicContact CG2-CB 3.99Å; T200-F211 HydrophobicContact CG2-CD1 3.42Å; T200-F211 VanDerWaalsContact CG2-CD1 3.42Å; T200-F211 HydrophobicContact CG2-CE1 4Å; T200-F211 HydrophobicContact CG2-CG 3.72Å
212	K	94	Very high	91.3	Very high	70 Å²	70	59.1 Å²	59.1	30%	0.304	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	139.1	179.1	-165.8	178.3	-170.4	-171.7	0	109.4	F198 N210 I214 L249	F198-K212 HydrophobicContact CB-CB 4.21Å; F198-K212 HydrophobicContact CD2-CB 4.43Å; F198-K212 PolarHBondContact N-O 3.08Å; N210-K212 PolarHBondContact ND2-O 2.9Å; N210-K212 VanDerWaalsContact ND2-O 3.12Å; K212-I214 HydrophobicContact CD-CD1 4.33Å; K212-I214 HydrophobicContact CG-CD1 4.39Å; K212-L249 PolarHBondContact NZ-O 3.23Å
213	R	96	Very high	91.5	Very high	132 Å²	132	58.5 Å²	58.5	50%	0.498	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.9	165.4	179.9	-177.5	174.7	-179.6	3	107.2	D195 F196 Y197	D195-R213 VanDerWaalsContact CG-NH2 3.3Å; D195-R213 IonicContact OD1-CZ 2.99Å; D195-R213 IonicContact OD1-NE 3.96Å; D195-R213 PolarHBondContact OD1-NE 3.47Å; D195-R213 VanDerWaalsContact OD1-NE 3.08Å; D195-R213 IonicContact OD1-NH2 2.79Å; D195-R213 PolarHBondContact OD1-NH2 2.79Å; D195-R213 IonicContact OD2-CZ 3.53Å; D195-R213 IonicContact OD2-NE 3.28Å; D195-R213 IonicContact OD2-NH2 3.89Å; D195-R213 PolarHBondContact OD2-NH2 2.99Å; F196-R213 CarbonylContact O-C 3.57Å; F196-R213 VanDerWaalsContact O-CA 3.31Å; F196-R213 WeakPolarHBondContact O-CA 3.32Å; Y197-R213 HydrophobicContact CD1-CB 4.44Å; Y197-R213 HydrophobicContact CD1-CG 4.23Å; Y197-R213 HydrophobicContact CE1-CG 4Å; Y197-R213 PolarHBondContact OH-NE 2.88Å
214	I	96	Very high	91.8	Very high	22 Å²	22	55.7 Å²	55.7	11%	0.113	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129	172	-67.3	-58.8	0	0	0	107.2	D195 F196 F198 K212 L216 F247 L249	D195-I214 CarbonylContact C-O 3.53Å; D195-I214 WeakPolarHBondContact CA-O 3.41Å; F196-I214 HydrophobicContact CB-CB 4.39Å; F196-I214 PolarHBondContact N-O 3.42Å; F196-I214 PolarHBondContact O-N 3.31Å; F198-I214 HydrophobicContact CD2-CG1 4.43Å; F198-I214 HydrophobicContact CE2-CB 4.37Å; F198-I214 HydrophobicContact CE2-CG1 3.88Å; K212-I214 HydrophobicContact CD-CD1 4.33Å; K212-I214 HydrophobicContact CG-CD1 4.39Å; I214-L216 HydrophobicContact CG2-CD2 3.93Å; I214-F247 HydrophobicContact CD1-CE1 4.29Å; I214-F247 HydrophobicContact CG1-CE1 4.33Å; I214-F247 HydrophobicContact CG2-CD1 4.17Å; I214-F247 HydrophobicContact CG2-CE1 3.61Å; I214-F247 HydrophobicContact CG2-CZ 4.39Å; I214-L249 HydrophobicContact CG1-CD2 3.96Å
215	T	96.3	Very high	91.8	Very high	83 Å²	83	54.3 Å²	54.3	51%	0.509	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.9	169.2	-53.8	0	0	0	0	108.1	Y194 D195	Y194-T215 CarbonylContact O-C 3.56Å; Y194-T215 VanDerWaalsContact O-CA 3.25Å; Y194-T215 WeakPolarHBondContact O-CA 3.49Å; D195-T215 WeakPolarHBondContact OD1-CB 3.42Å; D195-T215 PolarHBondContact OD1-OG1 2.81Å
216	L	95.3	Very high	92	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	26%	0.264	C	S	.	.			trans	-75.6	135.4	177.9	-56.2	-171.6	0	0	0	109.6	Y194 F196 I214 W220 Y236 F247 Y254	Y194-L216 PolarHBondContact O-N 3.3Å; F196-L216 HydrophobicContact CE2-CD1 3.94Å; F196-L216 HydrophobicContact CE2-CG 4.24Å; I214-L216 HydrophobicContact CG2-CD2 3.93Å; L216-W220 WeakPolarHBondContact CD1-O 3.43Å; L216-Y236 HydrophobicContact CD1-CE1 4.1Å; L216-Y236 HydrophobicContact CD1-CE2 4.1Å; L216-F247 HydrophobicContact CD2-CD1 4.28Å; L216-F247 HydrophobicContact CD2-CG 4.44Å; L216-Y254 HydrophobicContact CD2-CE1 4.08Å
217	P	94.8	Very high	92.7	Very high	49 Å²	49	54.5 Å²	54.5	32%	0.318	26%	0.263	S	S	.	.			trans	-60.7	154.3	170.5	-16.9	28.2	0	0	0	111.1	E219 W220 V221 Y254	P217-E219 HydrophobicContact CB-CG 4.3Å; P217-E219 PolarHBondContact O-N 3.19Å; P217-W220 CarbonylContact O-C 3.58Å; P217-W220 WeakPolarHBondContact O-CA 3.49Å; P217-W220 PolarHBondContact O-N 3.49Å; P217-V221 PolarHBondContact O-N 3.34Å; P217-Y254 WeakPolarHBondContact CD-OH 3.32Å
218	N	92.4	Very high	93.5	Very high	154 Å²	154	53.2 Å²	53.2	82%	0.824	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-50.3	-38	-177.7	-70	-10.1	0	0	0	113.9	W220	N218-W220 PolarHBondContact O-N 2.88Å
219	E	93.6	Very high	94.2	Very high	136 Å²	136	51.2 Å²	51.2	64%	0.636	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-71	-12	179.2	70.5	-133.1	-161.1	0	0	114.8	P217 H238	P217-E219 HydrophobicContact CB-CG 4.3Å; P217-E219 PolarHBondContact O-N 3.19Å; E219-H238 PolarHBondContact O-CE1 3.01Å; E219-H238 PolarHBondContact O-NE2 3.33Å
220	W	95.3	Very high	94.7	Very high	49 Å²	49	44.7 Å²	44.7	19%	0.186	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-120.9	6.1	-177.1	-67	109.7	0	0	0	112.7	L216 P217 N218 G222 Y236 T245 Y254 Y256	L216-W220 WeakPolarHBondContact CD1-O 3.43Å; P217-W220 CarbonylContact O-C 3.58Å; P217-W220 WeakPolarHBondContact O-CA 3.49Å; P217-W220 PolarHBondContact O-N 3.49Å; N218-W220 PolarHBondContact O-N 2.88Å; W220-G222 PolarHBondContact O-N 2.97Å; W220-Y236 WeakPolarHBondContact O-CE2 3.37Å; W220-Y236 PolarHBondContact O-OH 2.92Å; W220-T245 HydrophobicContact CE3-CG2 3.97Å; W220-T245 HydrophobicContact CZ3-CG2 4.1Å; W220-Y254 HydrophobicContact CB-CD1 3.86Å; W220-Y254 HydrophobicContact CB-CE1 3.52Å; W220-Y254 AromaticContact CD1-CD2 3.77Å; W220-Y254 AromaticContact CD1-CE2 3.73Å; W220-Y254 AromaticContact CD1-CG 3.96Å; W220-Y254 AromaticContact CD1-CZ 3.87Å; W220-Y254 AromaticContact CD2-CD1 3.39Å; W220-Y254 HydrophobicContact CD2-CD1 3.39Å; W220-Y254 HydrophobicContact CD2-CD2 4Å; W220-Y254 AromaticContact CD2-CE1 3.98Å; W220-Y254 HydrophobicContact CD2-CE1 3.98Å; W220-Y254 AromaticContact CD2-CG 3.41Å; W220-Y254 HydrophobicContact CD2-CG 3.41Å; W220-Y254 VanDerWaalsContact CD2-CG 3.41Å; W220-Y254 AromaticContact CE2-CD2 3.78Å; W220-Y254 AromaticContact CE2-CG 3.51Å; W220-Y254 AromaticContact CE3-CD1 3.58Å; W220-Y254 HydrophobicContact CE3-CD1 3.58Å; W220-Y254 HydrophobicContact CE3-CE1 4.44Å; W220-Y254 AromaticContact CE3-CG 3.78Å; W220-Y254 HydrophobicContact CE3-CG 3.78Å; W220-Y254 AromaticContact CG-CD1 3.5Å; W220-Y254 HydrophobicContact CG-CD1 3.5Å; W220-Y254 HydrophobicContact CG-CD2 4.04Å; W220-Y254 AromaticContact CG-CE1 3.54Å; W220-Y254 HydrophobicContact CG-CE1 3.54Å; W220-Y254 HydrophobicContact CG-CE2 4.09Å; W220-Y254 AromaticContact CG-CG 3.76Å; W220-Y254 HydrophobicContact CG-CG 3.76Å; W220-Y254 AromaticContact CG-CZ 3.86Å; W220-Y254 VanDerWaalsContact CH2-CB 3.46Å; W220-Y254 HydrophobicContact CH2-CG 4.3Å; W220-Y254 VanDerWaalsContact CZ2-CB 3.46Å; W220-Y254 HydrophobicContact CZ2-CD2 4.38Å; W220-Y254 AromaticContact CZ2-CG 3.98Å; W220-Y254 HydrophobicContact CZ2-CG 3.98Å; W220-Y254 HydrophobicContact CZ3-CD1 4.33Å; W220-Y254 HydrophobicContact CZ3-CG 4.21Å; W220-Y254 AromaticContact NE1-CD2 3.64Å; W220-Y254 AromaticContact NE1-CG 3.85Å; W220-Y256 AromaticContact CH2-CD1 3.94Å; W220-Y256 HydrophobicContact CH2-CD1 3.94Å; W220-Y256 HydrophobicContact CZ3-CD1 4.04Å
221	V	94.8	Very high	94.8	Very high	34 Å²	34	44 Å²	44	21%	0.206	22%	0.22	C	C	.	.			trans	-60.1	124.7	176.7	171.9	0	0	0	0	109.2	P217 H238	P217-V221 PolarHBondContact O-N 3.34Å; V221-H238 PolarHBondContact O-CD2 3.02Å
222	G	94.8	Very high	94.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-83	179.6	178.3	0	0	0	0	0	113.4	V193 W220 Y236 Q237	V193-G222 PolarHBondContact N-O 3.24Å; V193-G222 PolarHBondContact O-N 2.92Å; W220-G222 PolarHBondContact O-N 2.97Å; G222-Y236 VanDerWaalsContact CA-CD2 3.48Å; G222-Q237 CarbonylContact C-O 3.49Å; G222-Q237 WeakPolarHBondContact CA-O 3.43Å
223	V	92.7	Very high	95	Very high	20 Å²	20	37.4 Å²	37.4	12%	0.121	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155.9	178.9	178.9	0	0	0	0	109.4	Q237 N239	V223-Q237 PolarHBondContact N-O 3.15Å; V223-Q237 WeakPolarHBondContact O-CB 3.37Å; V223-N239 HydrophobicContact CG2-CB 4.08Å
224	G	91.3	Very high	95.1	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.9	-173.4	-180	0	0	0	0	0	112.4	P190 V193 S273	P190-G224 PolarHBondContact O-N 3.03Å; V193-G224 WeakPolarHBondContact CG2-O 3.44Å; G224-S273 VanDerWaalsContact CA-O 3.31Å; G224-S273 WeakPolarHBondContact CA-O 3.31Å
225	N	90.9	Very high	95.2	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.011	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	-0.4	-174.4	-43.1	-66.2	0	0	0	114.5	Y165 G166 Y227 S372 N373	Y165-N225 WeakPolarHBondContact CB-OD1 3.16Å; G166-N225 PolarHBondContact N-OD1 3.23Å; N225-Y227 PolarHBondContact O-N 3.24Å; N225-Y227 VanDerWaalsContact O-N 3.16Å; N225-S372 WeakPolarHBondContact CB-O 3.37Å; N225-N373 HydrophobicContact CB-CB 4.4Å; N225-N373 PolarHBondContact O-ND2 3.4Å; N225-N373 VanDerWaalsContact O-ND2 3.12Å
226	N	93.9	Very high	95.3	Very high	6 Å²	6	26.5 Å²	26.5	3%	0.032	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	62.2	-179.8	-76	7.4	0	0	0	110.5	Q274 D277 F278 N325 N373	N226-Q274 PolarHBondContact OD1-NE2 3.14Å; N226-D277 HydrophobicContact CB-CB 4.14Å; N226-D277 WeakPolarHBondContact CB-OD1 3.19Å; N226-D277 VanDerWaalsContact CG-OD1 3.28Å; N226-D277 PolarHBondContact ND2-OD1 3.46Å; N226-D277 PolarHBondContact ND2-OD2 3.34Å; N226-F278 PolarHBondContact O-N 3.37Å; N226-N325 PolarHBondContact ND2-ND2 3.07Å; N226-N325 PolarHBondContact ND2-OD1 2.91Å; N226-N373 PolarHBondContact OD1-ND2 3.27Å; N226-N373 VanDerWaalsContact OD1-ND2 3.08Å
227	Y	96	Very high	95.3	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	149.6	171.6	49.6	-102.6	0	0	0	109.8	G166 G167 F183 G185 Y187 V193 F196 N225 Y235	G166-Y227 VanDerWaalsContact CA-OH 3.32Å; G166-Y227 WeakPolarHBondContact CA-OH 3.43Å; G167-Y227 PolarHBondContact N-OH 2.94Å; F183-Y227 HydrophobicContact CE2-CD2 4.04Å; F183-Y227 AromaticContact CE2-CE2 3.93Å; F183-Y227 HydrophobicContact CE2-CE2 3.93Å; G185-Y227 WeakPolarHBondContact CA-OH 3.32Å; G185-Y227 PolarHBondContact O-OH 3.45Å; Y187-Y227 AromaticContact CE2-CE1 3.87Å; Y187-Y227 HydrophobicContact CE2-CE1 3.87Å; V193-Y227 HydrophobicContact CG1-CD1 3.9Å; V193-Y227 HydrophobicContact CG1-CE1 4.05Å; V193-Y227 HydrophobicContact CG2-CD1 4.04Å; V193-Y227 HydrophobicContact CG2-CE1 4.06Å; F196-Y227 HydrophobicContact CD1-CE2 4.44Å; F196-Y227 AromaticContact CE1-CD2 3.59Å; F196-Y227 HydrophobicContact CE1-CD2 3.59Å; F196-Y227 AromaticContact CE1-CE2 3.67Å; F196-Y227 HydrophobicContact CE1-CE2 3.67Å; F196-Y227 HydrophobicContact CE1-CG 4.08Å; F196-Y227 HydrophobicContact CZ-CD2 4.28Å; F196-Y227 HydrophobicContact CZ-CG 4.31Å; N225-Y227 PolarHBondContact O-N 3.24Å; N225-Y227 VanDerWaalsContact O-N 3.16Å; Y227-Y235 CarbonylContact C-O 3.51Å; Y227-Y235 WeakPolarHBondContact CA-O 3.42Å; Y227-Y235 WeakPolarHBondContact CB-O 3.37Å
228	I	97.7	Very high	95.3	Very high	12 Å²	12	24.8 Å²	24.8	6%	0.062	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	159.9	177.8	68.4	174.4	0	0	0	110.5	H230 I234 Y235 F278 A280 L285	I228-H230 HydrophobicContact CD1-CB 4.19Å; I228-H230 HydrophobicContact CG1-CB 4.47Å; I228-I234 WeakPolarHBondContact O-CA 3.02Å; I228-Y235 HydrophobicContact CG1-CD2 4.43Å; I228-Y235 PolarHBondContact N-O 3.46Å; I228-Y235 VanDerWaalsContact N-O 3.08Å; I228-Y235 PolarHBondContact O-N 3.22Å; I228-F278 HydrophobicContact CD1-CB 4Å; I228-F278 HydrophobicContact CG1-CB 3.85Å; I228-F278 HydrophobicContact CG2-CB 4.35Å; I228-F278 VanDerWaalsContact CG2-O 3.25Å; I228-F278 WeakPolarHBondContact CG2-O 3.3Å; I228-A280 HydrophobicContact CD1-CB 3.95Å; I228-L285 HydrophobicContact CD1-CD1 3.65Å
229	V	98.1	Very high	95.3	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.5	162.4	-178.5	0	0	0	0	107.6	D171 S172 F183 F198 S233 I234 L249	D171-V229 WeakPolarHBondContact CA-O 3.09Å; D171-V229 HydrophobicContact CB-CG1 3.92Å; S172-V229 PolarHBondContact N-O 2.94Å; S172-V229 PolarHBondContact OG-O 2.86Å; F183-V229 HydrophobicContact CB-CG2 3.96Å; F183-V229 HydrophobicContact CD1-CB 3.7Å; F183-V229 HydrophobicContact CD1-CG2 3.37Å; F183-V229 HydrophobicContact CD2-CG2 4.03Å; F183-V229 HydrophobicContact CE1-CB 3.89Å; F183-V229 HydrophobicContact CE1-CG2 3.78Å; F183-V229 HydrophobicContact CE2-CG2 4.39Å; F183-V229 HydrophobicContact CG-CB 4.34Å; F183-V229 HydrophobicContact CG-CG2 3.5Å; F183-V229 HydrophobicContact CZ-CG2 4.28Å; F198-V229 HydrophobicContact CE1-CG1 4.49Å; F198-V229 HydrophobicContact CE1-CG2 4.06Å; F198-V229 HydrophobicContact CZ-CG2 4.5Å; V229-S233 WeakPolarHBondContact CA-O 3.45Å; V229-I234 HydrophobicContact CG2-CG1 4.39Å; V229-L249 HydrophobicContact CG1-CD1 4.44Å
230	H	97.5	Very high	95.1	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.019	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	124.5	179.7	-175.1	86.8	0	0	0	109.7	D171 S172 K173 I228 N232 S233 Y235 L285 E305	D171-H230 VanDerWaalsContact OD1-CA 3.26Å; D171-H230 WeakPolarHBondContact OD1-CA 3.23Å; S172-H230 VanDerWaalsContact OG-CB 3.31Å; S172-H230 WeakPolarHBondContact OG-CB 3.47Å; S172-H230 PolarHBondContact OG-ND1 2.91Å; K173-H230 VanDerWaalsContact CB-CE1 3.42Å; K173-H230 WeakPolarHBondContact CB-CE1 3.49Å; K173-H230 WeakPolarHBondContact CD-NE2 3.33Å; I228-H230 HydrophobicContact CD1-CB 4.19Å; I228-H230 HydrophobicContact CG1-CB 4.47Å; H230-N232 VanDerWaalsContact C-N 3.29Å; H230-N232 PolarHBondContact O-N 2.94Å; H230-S233 PolarHBondContact N-O 3.48Å; H230-S233 PolarHBondContact O-N 3.32Å; H230-S233 VanDerWaalsContact O-N 3.11Å; H230-Y235 HydrophobicContact CB-CD2 3.94Å; H230-Y235 HydrophobicContact CB-CE2 3.7Å; H230-Y235 WeakPolarHBondContact O-CE2 3.36Å; H230-L285 HydrophobicContact CB-CD1 4.37Å; H230-E305 IonicContact NE2-OE1 3.6Å; H230-E305 PolarHBondContact NE2-OE1 2.96Å; H230-E305 IonicContact NE2-OE2 2.74Å
231	S	95.8	Very high	95.1	Very high	43 Å²	43	19.7 Å²	19.7	30%	0.301	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	50.6	179.4	-155.2	0	0	0	0	112.2	D171 K173 S233	D171-S231 PolarHBondContact OD1-N 3.27Å; K173-S231 VanDerWaalsContact O-CA 3.32Å; K173-S231 WeakPolarHBondContact O-CA 3.23Å; K173-S231 PolarHBondContact O-N 3.5Å; S231-S233 PolarHBondContact O-N 2.95Å; S231-S233 VanDerWaalsContact O-N 3.13Å; S231-S233 PolarHBondContact O-OG 3.48Å
232	N	94.6	Very high	95.1	Very high	22 Å²	22	19.9 Å²	19.9	12%	0.118	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	30.7	178.3	-167.8	53.3	0	0	0	114.1	D171 I175 H230 L249 T250	D171-N232 WeakPolarHBondContact OD2-CA 3.28Å; D171-N232 PolarHBondContact OD2-N 3.08Å; I175-N232 HydrophobicContact CD1-CB 4.38Å; I175-N232 HydrophobicContact CG2-CB 4.43Å; H230-N232 VanDerWaalsContact C-N 3.29Å; H230-N232 PolarHBondContact O-N 2.94Å; N232-L249 VanDerWaalsContact O-CB 3.24Å; N232-L249 WeakPolarHBondContact O-CB 3.49Å; N232-L249 WeakPolarHBondContact O-CG 3.26Å; N232-L249 PolarHBondContact O-N 3.38Å; N232-T250 PolarHBondContact ND2-OG1 3.47Å
233	S	97.4	Very high	95.3	Very high	6 Å²	6	20 Å²	20	4%	0.042	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.8	172.8	-53.5	0	0	0	0	109.9	V229 H230 S231 Y235 F247 N248	V229-S233 WeakPolarHBondContact CA-O 3.45Å; H230-S233 PolarHBondContact N-O 3.48Å; H230-S233 PolarHBondContact O-N 3.32Å; H230-S233 VanDerWaalsContact O-N 3.11Å; S231-S233 PolarHBondContact O-N 2.95Å; S231-S233 VanDerWaalsContact O-N 3.13Å; S231-S233 PolarHBondContact O-OG 3.48Å; S233-Y235 WeakPolarHBondContact O-CD2 3.46Å; S233-F247 CarbonylContact C-O 3.47Å; S233-F247 WeakPolarHBondContact CA-O 3.39Å; S233-F247 WeakPolarHBondContact CB-O 3.02Å; S233-N248 PolarHBondContact OG-ND2 2.98Å; S233-N248 VanDerWaalsContact OG-ND2 3.15Å
234	I	97.9	Very high	95.5	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.1	174	-49.6	179.3	0	0	0	107.8	F196 F198 I228 V229 Y236 K246 F247 L249	F196-I234 HydrophobicContact CB-CD1 4Å; F196-I234 HydrophobicContact CD1-CD1 3.95Å; F196-I234 HydrophobicContact CD1-CG2 4.27Å; F196-I234 HydrophobicContact CD2-CD1 3.58Å; F196-I234 HydrophobicContact CE1-CD1 4.28Å; F196-I234 HydrophobicContact CE1-CG2 3.63Å; F196-I234 HydrophobicContact CE2-CD1 3.96Å; F196-I234 HydrophobicContact CE2-CG2 4.05Å; F196-I234 HydrophobicContact CG-CD1 3.57Å; F196-I234 HydrophobicContact CZ-CD1 4.29Å; F196-I234 HydrophobicContact CZ-CG2 3.5Å; F196-I234 VanDerWaalsContact CZ-CG2 3.5Å; F198-I234 HydrophobicContact CE2-CD1 4.37Å; F198-I234 HydrophobicContact CZ-CD1 3.92Å; F198-I234 HydrophobicContact CZ-CG1 4.14Å; I228-I234 WeakPolarHBondContact O-CA 3.02Å; V229-I234 HydrophobicContact CG2-CG1 4.39Å; I234-Y236 HydrophobicContact CG2-CD1 4Å; I234-K246 CarbonylContact O-C 3.53Å; I234-K246 WeakPolarHBondContact O-CA 3.42Å; I234-F247 HydrophobicContact CB-CB 4.48Å; I234-F247 HydrophobicContact CD1-CD1 4.12Å; I234-F247 HydrophobicContact CG1-CD1 4.45Å; I234-F247 PolarHBondContact N-O 3.26Å; I234-F247 PolarHBondContact O-N 3.04Å; I234-L249 HydrophobicContact CD1-CD2 3.94Å; I234-L249 HydrophobicContact CG1-CD1 4.49Å; I234-L249 HydrophobicContact CG1-CD2 3.95Å; I234-L249 HydrophobicContact CG1-CG 4.32Å
235	Y	98.3	Very high	95.8	Very high	7 Å²	7	19 Å²	19	3%	0.027	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.2	176.1	-66.8	-97.5	0	0	0	109.5	Y227 I228 H230 S233 T245 K246 F278 L285 F308	Y227-Y235 CarbonylContact C-O 3.51Å; Y227-Y235 WeakPolarHBondContact CA-O 3.42Å; Y227-Y235 WeakPolarHBondContact CB-O 3.37Å; I228-Y235 HydrophobicContact CG1-CD2 4.43Å; I228-Y235 PolarHBondContact N-O 3.46Å; I228-Y235 VanDerWaalsContact N-O 3.08Å; I228-Y235 PolarHBondContact O-N 3.22Å; H230-Y235 HydrophobicContact CB-CD2 3.94Å; H230-Y235 HydrophobicContact CB-CE2 3.7Å; H230-Y235 WeakPolarHBondContact O-CE2 3.36Å; S233-Y235 WeakPolarHBondContact O-CD2 3.46Å; Y235-T245 WeakPolarHBondContact CA-O 3.11Å; Y235-K246 HydrophobicContact CD1-CB 3.58Å; Y235-K246 HydrophobicContact CE1-CB 3.51Å; Y235-K246 HydrophobicContact CE1-CD 3.7Å; Y235-K246 HydrophobicContact CE1-CG 4.23Å; Y235-K246 HydrophobicContact CG-CB 4.22Å; Y235-F278 HydrophobicContact CD1-CD1 4.19Å; Y235-F278 AromaticContact CD1-CE1 3.71Å; Y235-F278 HydrophobicContact CD1-CE1 3.71Å; Y235-F278 HydrophobicContact CD1-CZ 4.22Å; Y235-F278 HydrophobicContact CG-CD1 4.23Å; Y235-F278 HydrophobicContact CG-CE1 4.13Å; Y235-L285 HydrophobicContact CD1-CD2 4.04Å; Y235-L285 HydrophobicContact CE1-CD2 3.55Å; Y235-L285 HydrophobicContact CE2-CD2 4.41Å; Y235-F308 AromaticContact CD1-CE2 3.7Å; Y235-F308 HydrophobicContact CD1-CE2 3.7Å; Y235-F308 HydrophobicContact CD1-CZ 4.23Å; Y235-F308 HydrophobicContact CE1-CD2 4.03Å; Y235-F308 AromaticContact CE1-CE2 3.56Å; Y235-F308 HydrophobicContact CE1-CE2 3.56Å; Y235-F308 HydrophobicContact CE1-CZ 4.36Å
236	Y	97.4	Very high	96.1	Very high	1 Å²	1	20.4 Å²	20.4	0%	0.004	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	158.5	-173.2	62.1	-85.3	0	0	0	112.4	L216 W220 G222 I234 T245 F247 F278	L216-Y236 HydrophobicContact CD1-CE1 4.1Å; L216-Y236 HydrophobicContact CD1-CE2 4.1Å; W220-Y236 WeakPolarHBondContact O-CE2 3.37Å; W220-Y236 PolarHBondContact O-OH 2.92Å; G222-Y236 VanDerWaalsContact CA-CD2 3.48Å; I234-Y236 HydrophobicContact CG2-CD1 4Å; Y236-T245 HydrophobicContact CE1-CG2 3.81Å; Y236-T245 HydrophobicContact CE2-CG2 3.86Å; Y236-T245 VanDerWaalsContact CZ-CG2 3.42Å; Y236-T245 PolarHBondContact N-O 3.33Å; Y236-T245 PolarHBondContact O-N 3.22Å; Y236-T245 WeakPolarHBondContact OH-CG2 3.49Å; Y236-F247 HydrophobicContact CE1-CB 4.2Å; Y236-F278 VanDerWaalsContact C-CE2 3.45Å; Y236-F278 VanDerWaalsContact N-CE2 3.31Å; Y236-F278 WeakPolarHBondContact O-CE2 3.22Å
237	Q	97	Very high	96.3	Very high	5 Å²	5	20.5 Å²	20.5	2%	0.023	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	136.2	174.4	177.4	-178.1	-48.7	0	0	110.3	G222 V223 N239 F242 S273 N275 L276	G222-Q237 CarbonylContact C-O 3.49Å; G222-Q237 WeakPolarHBondContact CA-O 3.43Å; V223-Q237 PolarHBondContact N-O 3.15Å; V223-Q237 WeakPolarHBondContact O-CB 3.37Å; Q237-N239 PolarHBondContact NE2-OD1 3.17Å; Q237-F242 HydrophobicContact CG-CD2 4.49Å; Q237-F242 HydrophobicContact CG-CE2 4.09Å; Q237-S273 PolarHBondContact NE2-O 3.37Å; Q237-N275 PolarHBondContact NE2-OD1 2.96Å; Q237-L276 HydrophobicContact CB-CB 4.12Å; Q237-L276 HydrophobicContact CB-CD1 4.47Å; Q237-L276 HydrophobicContact CG-CB 4.22Å; Q237-L276 HydrophobicContact CG-CD1 4.15Å; Q237-L276 HydrophobicContact CG-CG 4.16Å
238	H	94.9	Very high	96.4	Very high	13 Å²	13	22.6 Å²	22.6	6%	0.06	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.2	170.8	-173.5	-152.6	0	0	0	109.3	E219 V221 S240 P241 F242 S243 T245	E219-H238 PolarHBondContact O-CE1 3.01Å; E219-H238 PolarHBondContact O-NE2 3.33Å; V221-H238 PolarHBondContact O-CD2 3.02Å; H238-S240 PolarHBondContact CE1-O 3.03Å; H238-P241 CarbonylContact C-O 3.56Å; H238-P241 VanDerWaalsContact O-O 3.08Å; H238-F242 CarbonylContact O-C 3.6Å; H238-F242 VanDerWaalsContact O-CA 3.24Å; H238-F242 WeakPolarHBondContact O-CA 3.35Å; H238-S243 PolarHBondContact N-O 3.49Å; H238-S243 PolarHBondContact O-N 3.2Å; H238-T245 WeakPolarHBondContact CB-OG1 3.46Å
239	N	91.6	Very high	96.2	Very high	76 Å²	76	22.3 Å²	22.3	41%	0.406	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-1.4	-174	-78.7	6.9	0	0	0	114.6	V223 Q237 P241 F242	V223-N239 HydrophobicContact CG2-CB 4.08Å; Q237-N239 PolarHBondContact NE2-OD1 3.17Å; N239-P241 CarbonylContact C-O 3.48Å; N239-P241 CarbonylContact O-C 3.48Å; N239-F242 PolarHBondContact O-N 3.46Å; N239-F242 WeakPolarHBondContact OD1-CD2 3.31Å
240	S	89.3	Confident	96	Very high	99 Å²	99	27.5 Å²	27.5	69%	0.692	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133	71.8	-179.8	-173.1	0	0	0	0	112.4	H238	H238-S240 PolarHBondContact CE1-O 3.03Å
241	P	94.3	Very high	95.9	Very high	57 Å²	57	30.1 Å²	30.1	37%	0.37	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.3	165.9	7.3	34.5	-36.1	0	0	0	113.6	H238 N239 S243 Y256 V258	H238-P241 CarbonylContact C-O 3.56Å; H238-P241 VanDerWaalsContact O-O 3.08Å; N239-P241 CarbonylContact C-O 3.48Å; N239-P241 CarbonylContact O-C 3.48Å; P241-S243 WeakPolarHBondContact O-CB 3.33Å; P241-S243 PolarHBondContact O-N 3.1Å; P241-S243 PolarHBondContact O-OG 2.95Å; P241-Y256 HydrophobicContact CG-CD2 4.15Å; P241-Y256 HydrophobicContact CG-CE2 3.7Å; P241-V258 HydrophobicContact CB-CG2 4.33Å; P241-V258 HydrophobicContact CG-CG2 4.09Å
242	F	96.4	Very high	95.9	Very high	39 Å²	39	31.8 Å²	31.8	17%	0.171	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	106.4	171.2	-177.8	-118.1	0	0	0	110.4	Q237 H238 N239 A262 A264 N275 L276	Q237-F242 HydrophobicContact CG-CD2 4.49Å; Q237-F242 HydrophobicContact CG-CE2 4.09Å; H238-F242 CarbonylContact O-C 3.6Å; H238-F242 VanDerWaalsContact O-CA 3.24Å; H238-F242 WeakPolarHBondContact O-CA 3.35Å; N239-F242 PolarHBondContact O-N 3.46Å; N239-F242 WeakPolarHBondContact OD1-CD2 3.31Å; F242-A262 HydrophobicContact CE1-CB 3.92Å; F242-A264 HydrophobicContact CD1-CB 4.19Å; F242-A264 HydrophobicContact CD2-CB 4.07Å; F242-A264 HydrophobicContact CE1-CB 4.21Å; F242-A264 HydrophobicContact CE2-CB 4.1Å; F242-A264 HydrophobicContact CG-CB 4.12Å; F242-A264 HydrophobicContact CZ-CB 4.17Å; F242-N275 HydrophobicContact CE2-CB 3.75Å; F242-N275 HydrophobicContact CZ-CB 3.68Å; F242-L276 HydrophobicContact CE1-CD2 4.22Å; F242-L276 HydrophobicContact CE2-CD1 4.21Å; F242-L276 HydrophobicContact CE2-CD2 4.4Å; F242-L276 HydrophobicContact CE2-CG 3.9Å; F242-L276 HydrophobicContact CZ-CD1 4.19Å; F242-L276 HydrophobicContact CZ-CD2 3.66Å; F242-L276 HydrophobicContact CZ-CG 3.67Å
243	S	97.5	Very high	96	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	155.8	-166.5	55.9	0	0	0	0	112.3	H238 P241 R257	H238-S243 PolarHBondContact N-O 3.49Å; H238-S243 PolarHBondContact O-N 3.2Å; P241-S243 WeakPolarHBondContact O-CB 3.33Å; P241-S243 PolarHBondContact O-N 3.1Å; P241-S243 PolarHBondContact O-OG 2.95Å; S243-R257 WeakPolarHBondContact CA-O 3.2Å; S243-R257 WeakPolarHBondContact CB-O 3.46Å
244	M	97.8	Very high	96	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.4	164.6	74.8	172.2	178.1	0	0	108	Y256 R257 I259 L276 F278 I287 I303 F308 I310	M244-Y256 CarbonylContact O-C 3.56Å; M244-Y256 VanDerWaalsContact O-CA 3.27Å; M244-Y256 WeakPolarHBondContact O-CA 3.23Å; M244-R257 HydrophobicContact CE-CB 3.6Å; M244-R257 HydrophobicContact CE-CG 3.96Å; M244-R257 HydrophobicContact CG-CB 4Å; M244-R257 WeakPolarHBondContact CG-O 3.43Å; M244-R257 PolarHBondContact N-O 2.86Å; M244-R257 PolarHBondContact O-N 3.41Å; M244-I259 HydrophobicContact CB-CD1 4.3Å; M244-I259 HydrophobicContact CG-CD1 4.31Å; M244-I259 HydrophobicContact CG-CG1 4.36Å; M244-I259 HydrophobicContact SD-CD1 3.95Å; M244-I259 HydrophobicContact SD-CG1 4.23Å; M244-L276 HydrophobicContact CB-CD1 4.17Å; M244-F278 HydrophobicContact CB-CE1 4.3Å; M244-F278 HydrophobicContact CB-CE2 4.26Å; M244-F278 HydrophobicContact CB-CZ 3.58Å; M244-F278 HydrophobicContact CG-CZ 4.49Å; M244-I287 HydrophobicContact CB-CD1 3.58Å; M244-I287 HydrophobicContact CG-CD1 4.46Å; M244-I287 HydrophobicContact SD-CD1 4.12Å; M244-I303 HydrophobicContact SD-CD1 4.03Å; M244-I303 HydrophobicContact SD-CG1 4.3Å; M244-F308 HydrophobicContact CB-CZ 4.46Å; M244-F308 HydrophobicContact CE-CD2 4.38Å; M244-F308 HydrophobicContact CE-CE2 4.33Å; M244-F308 WeakPolarHBondContact CE-O 3.45Å; M244-F308 HydrophobicContact CG-CE1 4.31Å; M244-F308 HydrophobicContact CG-CE2 4.36Å; M244-F308 HydrophobicContact CG-CZ 3.88Å; M244-F308 HydrophobicContact SD-CE2 4.24Å; M244-F308 HydrophobicContact SD-CZ 4.35Å; M244-I310 HydrophobicContact CE-CD1 4.11Å; M244-I310 HydrophobicContact SD-CD1 4.24Å
245	T	97.9	Very high	96	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.1	-176.1	-62.2	0	0	0	0	110.5	W220 Y235 Y236 H238 D255	W220-T245 HydrophobicContact CE3-CG2 3.97Å; W220-T245 HydrophobicContact CZ3-CG2 4.1Å; Y235-T245 WeakPolarHBondContact CA-O 3.11Å; Y236-T245 HydrophobicContact CE1-CG2 3.81Å; Y236-T245 HydrophobicContact CE2-CG2 3.86Å; Y236-T245 VanDerWaalsContact CZ-CG2 3.42Å; Y236-T245 PolarHBondContact N-O 3.33Å; Y236-T245 PolarHBondContact O-N 3.22Å; Y236-T245 WeakPolarHBondContact OH-CG2 3.49Å; H238-T245 WeakPolarHBondContact CB-OG1 3.46Å; T245-D255 CarbonylContact C-O 3.53Å; T245-D255 WeakPolarHBondContact CA-O 3.09Å
246	K	97.5	Very high	95.9	Very high	33 Å²	33	47 Å²	47	14%	0.143	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.4	169.2	72.2	179.2	178.2	-177.5	0	111.9	I234 Y235 Y254 D255 F308	I234-K246 CarbonylContact O-C 3.53Å; I234-K246 WeakPolarHBondContact O-CA 3.42Å; Y235-K246 HydrophobicContact CD1-CB 3.58Å; Y235-K246 HydrophobicContact CE1-CB 3.51Å; Y235-K246 HydrophobicContact CE1-CD 3.7Å; Y235-K246 HydrophobicContact CE1-CG 4.23Å; Y235-K246 HydrophobicContact CG-CB 4.22Å; K246-Y254 WeakPolarHBondContact O-CA 3.13Å; K246-D255 HydrophobicContact CD-CB 4.45Å; K246-D255 WeakPolarHBondContact CE-OD2 3.35Å; K246-D255 HydrophobicContact CG-CB 3.9Å; K246-D255 PolarHBondContact N-O 3.38Å; K246-D255 IonicContact NZ-OD2 3.96Å; K246-D255 PolarHBondContact O-N 2.88Å; K246-F308 HydrophobicContact CB-CE1 4.16Å; K246-F308 HydrophobicContact CB-CE2 4.14Å; K246-F308 HydrophobicContact CB-CZ 3.81Å; K246-F308 HydrophobicContact CD-CB 4.39Å; K246-F308 HydrophobicContact CD-CD1 3.96Å; K246-F308 HydrophobicContact CD-CD2 3.75Å; K246-F308 HydrophobicContact CD-CE1 4.14Å; K246-F308 HydrophobicContact CD-CE2 3.97Å; K246-F308 HydrophobicContact CD-CG 3.76Å; K246-F308 HydrophobicContact CD-CZ 4.15Å; K246-F308 HydrophobicContact CG-CD1 4.01Å; K246-F308 HydrophobicContact CG-CD2 4.39Å; K246-F308 HydrophobicContact CG-CE1 3.78Å; K246-F308 HydrophobicContact CG-CE2 4.2Å; K246-F308 HydrophobicContact CG-CG 4.32Å; K246-F308 HydrophobicContact CG-CZ 3.89Å
247	F	97.9	Very high	96	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.035	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.2	172.1	174.3	-115.6	0	0	0	110.4	I214 L216 S233 I234 Y236 L249 Y254	I214-F247 HydrophobicContact CD1-CE1 4.29Å; I214-F247 HydrophobicContact CG1-CE1 4.33Å; I214-F247 HydrophobicContact CG2-CD1 4.17Å; I214-F247 HydrophobicContact CG2-CE1 3.61Å; I214-F247 HydrophobicContact CG2-CZ 4.39Å; L216-F247 HydrophobicContact CD2-CD1 4.28Å; L216-F247 HydrophobicContact CD2-CG 4.44Å; S233-F247 CarbonylContact C-O 3.47Å; S233-F247 WeakPolarHBondContact CA-O 3.39Å; S233-F247 WeakPolarHBondContact CB-O 3.02Å; I234-F247 HydrophobicContact CB-CB 4.48Å; I234-F247 HydrophobicContact CD1-CD1 4.12Å; I234-F247 HydrophobicContact CG1-CD1 4.45Å; I234-F247 PolarHBondContact N-O 3.26Å; I234-F247 PolarHBondContact O-N 3.04Å; Y236-F247 HydrophobicContact CE1-CB 4.2Å; F247-L249 HydrophobicContact CD1-CD2 4.04Å; F247-L249 HydrophobicContact CE1-CD2 3.9Å; F247-Y254 HydrophobicContact CB-CD1 3.92Å; F247-Y254 HydrophobicContact CB-CE1 3.77Å; F247-Y254 AromaticContact CD2-CD1 3.67Å; F247-Y254 HydrophobicContact CD2-CD1 3.67Å; F247-Y254 AromaticContact CD2-CD2 3.95Å; F247-Y254 HydrophobicContact CD2-CD2 3.95Å; F247-Y254 AromaticContact CD2-CE1 3.3Å; F247-Y254 HydrophobicContact CD2-CE1 3.3Å; F247-Y254 AromaticContact CD2-CE2 3.59Å; F247-Y254 HydrophobicContact CD2-CE2 3.59Å; F247-Y254 AromaticContact CD2-CG 3.98Å; F247-Y254 HydrophobicContact CD2-CG 3.98Å; F247-Y254 AromaticContact CD2-CZ 3.24Å; F247-Y254 HydrophobicContact CE2-CD2 4.26Å; F247-Y254 HydrophobicContact CE2-CE1 4.05Å; F247-Y254 AromaticContact CE2-CE2 3.61Å; F247-Y254 HydrophobicContact CE2-CE2 3.61Å; F247-Y254 AromaticContact CE2-CZ 3.48Å; F247-Y254 VanDerWaalsContact CE2-CZ 3.48Å; F247-Y254 HydrophobicContact CG-CD1 4.17Å; F247-Y254 AromaticContact CG-CE1 3.71Å; F247-Y254 HydrophobicContact CG-CE1 3.71Å; F247-Y254 AromaticContact CG-CZ 3.99Å
248	N	97.1	Very high	96	Very high	47 Å²	47	56.2 Å²	56.2	25%	0.251	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	120.3	-179	-176	-86.5	0	0	0	111.7	S233 T250 S251 S252 K253	S233-N248 PolarHBondContact OG-ND2 2.98Å; S233-N248 VanDerWaalsContact OG-ND2 3.15Å; N248-T250 VanDerWaalsContact C-N 3.29Å; N248-T250 PolarHBondContact O-N 3.12Å; N248-T250 PolarHBondContact OD1-N 2.85Å; N248-S251 WeakPolarHBondContact CB-OG 3.39Å; N248-S251 VanDerWaalsContact CG-OG 3.27Å; N248-S251 PolarHBondContact OD1-N 2.74Å; N248-S251 PolarHBondContact OD1-OG 2.78Å; N248-S252 VanDerWaalsContact O-CA 3.26Å; N248-S252 WeakPolarHBondContact O-CA 3.24Å; N248-S252 PolarHBondContact O-N 3.5Å; N248-K253 PolarHBondContact N-O 2.83Å
249	L	94.8	Very high	96.1	Very high	6 Å²	6	56 Å²	56	3%	0.031	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-18	-171.7	-63.7	170.1	0	0	0	114.5	F198 K212 I214 V229 N232 I234 F247	F198-L249 HydrophobicContact CD1-CD1 4.48Å; F198-L249 HydrophobicContact CE1-CD1 3.6Å; F198-L249 HydrophobicContact CE2-CD1 4.38Å; F198-L249 HydrophobicContact CE2-CD2 3.88Å; F198-L249 HydrophobicContact CZ-CD1 3.54Å; F198-L249 HydrophobicContact CZ-CD2 3.65Å; F198-L249 HydrophobicContact CZ-CG 4.26Å; K212-L249 PolarHBondContact NZ-O 3.23Å; I214-L249 HydrophobicContact CG1-CD2 3.96Å; V229-L249 HydrophobicContact CG1-CD1 4.44Å; N232-L249 VanDerWaalsContact O-CB 3.24Å; N232-L249 WeakPolarHBondContact O-CB 3.49Å; N232-L249 WeakPolarHBondContact O-CG 3.26Å; N232-L249 PolarHBondContact O-N 3.38Å; I234-L249 HydrophobicContact CD1-CD2 3.94Å; I234-L249 HydrophobicContact CG1-CD1 4.49Å; I234-L249 HydrophobicContact CG1-CD2 3.95Å; I234-L249 HydrophobicContact CG1-CG 4.32Å; F247-L249 HydrophobicContact CD1-CD2 4.04Å; F247-L249 HydrophobicContact CE1-CD2 3.9Å
250	T	92.5	Very high	96.2	Very high	110 Å²	110	58.2 Å²	58.2	68%	0.675	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-51.7	177.9	-62.9	0	0	0	0	111.7	N232 N248	N232-T250 PolarHBondContact ND2-OG1 3.47Å; N248-T250 VanDerWaalsContact C-N 3.29Å; N248-T250 PolarHBondContact O-N 3.12Å; N248-T250 PolarHBondContact OD1-N 2.85Å
251	S	95.7	Very high	96.5	Very high	59 Å²	59	56.1 Å²	56.1	41%	0.413	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-10.6	-174.7	62.6	0	0	0	0	113.4	N248 K253	N248-S251 WeakPolarHBondContact CB-OG 3.39Å; N248-S251 VanDerWaalsContact CG-OG 3.27Å; N248-S251 PolarHBondContact OD1-N 2.74Å; N248-S251 PolarHBondContact OD1-OG 2.78Å; S251-K253 PolarHBondContact O-N 3.42Å
252	S	96	Very high	96.6	Very high	77 Å²	77	54 Å²	54	54%	0.538	29%	0.288	S	S	.	.			trans	54.7	33.3	-174	-57.2	0	0	0	0	112.9	N248	N248-S252 VanDerWaalsContact O-CA 3.26Å; N248-S252 WeakPolarHBondContact O-CA 3.24Å; N248-S252 PolarHBondContact O-N 3.5Å
253	K	97	Very high	96.6	Very high	148 Å²	148	52.5 Å²	52.5	64%	0.643	28%	0.281	S	S	*	.			trans	-100.6	140.3	178.6	-69	-174.7	177.6	-176.9	0	110.9	N248 S251	N248-K253 PolarHBondContact N-O 2.83Å; S251-K253 PolarHBondContact O-N 3.42Å
254	Y	97.2	Very high	96.5	Very high	54 Å²	54	55 Å²	55	21%	0.212	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	146.8	171.3	-62.6	-92	0	0	0	110.2	L216 P217 W220 K246 F247	L216-Y254 HydrophobicContact CD2-CE1 4.08Å; P217-Y254 WeakPolarHBondContact CD-OH 3.32Å; W220-Y254 HydrophobicContact CB-CD1 3.86Å; W220-Y254 HydrophobicContact CB-CE1 3.52Å; W220-Y254 AromaticContact CD1-CD2 3.77Å; W220-Y254 AromaticContact CD1-CE2 3.73Å; W220-Y254 AromaticContact CD1-CG 3.96Å; W220-Y254 AromaticContact CD1-CZ 3.87Å; W220-Y254 AromaticContact CD2-CD1 3.39Å; W220-Y254 HydrophobicContact CD2-CD1 3.39Å; W220-Y254 HydrophobicContact CD2-CD2 4Å; W220-Y254 AromaticContact CD2-CE1 3.98Å; W220-Y254 HydrophobicContact CD2-CE1 3.98Å; W220-Y254 AromaticContact CD2-CG 3.41Å; W220-Y254 HydrophobicContact CD2-CG 3.41Å; W220-Y254 VanDerWaalsContact CD2-CG 3.41Å; W220-Y254 AromaticContact CE2-CD2 3.78Å; W220-Y254 AromaticContact CE2-CG 3.51Å; W220-Y254 AromaticContact CE3-CD1 3.58Å; W220-Y254 HydrophobicContact CE3-CD1 3.58Å; W220-Y254 HydrophobicContact CE3-CE1 4.44Å; W220-Y254 AromaticContact CE3-CG 3.78Å; W220-Y254 HydrophobicContact CE3-CG 3.78Å; W220-Y254 AromaticContact CG-CD1 3.5Å; W220-Y254 HydrophobicContact CG-CD1 3.5Å; W220-Y254 HydrophobicContact CG-CD2 4.04Å; W220-Y254 AromaticContact CG-CE1 3.54Å; W220-Y254 HydrophobicContact CG-CE1 3.54Å; W220-Y254 HydrophobicContact CG-CE2 4.09Å; W220-Y254 AromaticContact CG-CG 3.76Å; W220-Y254 HydrophobicContact CG-CG 3.76Å; W220-Y254 AromaticContact CG-CZ 3.86Å; W220-Y254 VanDerWaalsContact CH2-CB 3.46Å; W220-Y254 HydrophobicContact CH2-CG 4.3Å; W220-Y254 VanDerWaalsContact CZ2-CB 3.46Å; W220-Y254 HydrophobicContact CZ2-CD2 4.38Å; W220-Y254 AromaticContact CZ2-CG 3.98Å; W220-Y254 HydrophobicContact CZ2-CG 3.98Å; W220-Y254 HydrophobicContact CZ3-CD1 4.33Å; W220-Y254 HydrophobicContact CZ3-CG 4.21Å; W220-Y254 AromaticContact NE1-CD2 3.64Å; W220-Y254 AromaticContact NE1-CG 3.85Å; K246-Y254 WeakPolarHBondContact O-CA 3.13Å; F247-Y254 HydrophobicContact CB-CD1 3.92Å; F247-Y254 HydrophobicContact CB-CE1 3.77Å; F247-Y254 AromaticContact CD2-CD1 3.67Å; F247-Y254 HydrophobicContact CD2-CD1 3.67Å; F247-Y254 AromaticContact CD2-CD2 3.95Å; F247-Y254 HydrophobicContact CD2-CD2 3.95Å; F247-Y254 AromaticContact CD2-CE1 3.3Å; F247-Y254 HydrophobicContact CD2-CE1 3.3Å; F247-Y254 AromaticContact CD2-CE2 3.59Å; F247-Y254 HydrophobicContact CD2-CE2 3.59Å; F247-Y254 AromaticContact CD2-CG 3.98Å; F247-Y254 HydrophobicContact CD2-CG 3.98Å; F247-Y254 AromaticContact CD2-CZ 3.24Å; F247-Y254 HydrophobicContact CE2-CD2 4.26Å; F247-Y254 HydrophobicContact CE2-CE1 4.05Å; F247-Y254 AromaticContact CE2-CE2 3.61Å; F247-Y254 HydrophobicContact CE2-CE2 3.61Å; F247-Y254 AromaticContact CE2-CZ 3.48Å; F247-Y254 VanDerWaalsContact CE2-CZ 3.48Å; F247-Y254 HydrophobicContact CG-CD1 4.17Å; F247-Y254 AromaticContact CG-CE1 3.71Å; F247-Y254 HydrophobicContact CG-CE1 3.71Å; F247-Y254 AromaticContact CG-CZ 3.99Å
255	D	97.3	Very high	96.4	Very high	51 Å²	51	59 Å²	59	27%	0.273	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.4	170.9	-171.1	13.5	0	0	0	108.1	T245 K246 F308	T245-D255 CarbonylContact C-O 3.53Å; T245-D255 WeakPolarHBondContact CA-O 3.09Å; K246-D255 HydrophobicContact CD-CB 4.45Å; K246-D255 WeakPolarHBondContact CE-OD2 3.35Å; K246-D255 HydrophobicContact CG-CB 3.9Å; K246-D255 PolarHBondContact N-O 3.38Å; K246-D255 IonicContact NZ-OD2 3.96Å; K246-D255 PolarHBondContact O-N 2.88Å; D255-F308 HydrophobicContact CB-CD1 4.16Å; D255-F308 WeakPolarHBondContact O-CE1 3.39Å
256	Y	97.7	Very high	96.4	Very high	102 Å²	102	60.4 Å²	60.4	40%	0.4	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.4	-178.5	78	-84.7	0	0	0	111.4	W220 P241 M244	W220-Y256 AromaticContact CH2-CD1 3.94Å; W220-Y256 HydrophobicContact CH2-CD1 3.94Å; W220-Y256 HydrophobicContact CZ3-CD1 4.04Å; P241-Y256 HydrophobicContact CG-CD2 4.15Å; P241-Y256 HydrophobicContact CG-CE2 3.7Å; M244-Y256 CarbonylContact O-C 3.56Å; M244-Y256 VanDerWaalsContact O-CA 3.27Å; M244-Y256 WeakPolarHBondContact O-CA 3.23Å
257	R	97.7	Very high	96.3	Very high	119 Å²	119	59.3 Å²	59.3	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.5	173.2	-67.1	-61.5	-175.3	-146.1	-3.8	111.4	S243 M244 F308	S243-R257 WeakPolarHBondContact CA-O 3.2Å; S243-R257 WeakPolarHBondContact CB-O 3.46Å; M244-R257 HydrophobicContact CE-CB 3.6Å; M244-R257 HydrophobicContact CE-CG 3.96Å; M244-R257 HydrophobicContact CG-CB 4Å; M244-R257 WeakPolarHBondContact CG-O 3.43Å; M244-R257 PolarHBondContact N-O 2.86Å; M244-R257 PolarHBondContact O-N 3.41Å; R257-F308 HydrophobicContact CG-CD1 4.07Å; R257-F308 WeakPolarHBondContact CG-O 3.38Å
258	V	97.9	Very high	96.2	Very high	80 Å²	80	59.2 Å²	59.2	49%	0.485	33%	0.333	S	S	.	.			trans	-81.3	126.2	168.1	178.7	0	0	0	0	108.3	P241	P241-V258 HydrophobicContact CB-CG2 4.33Å; P241-V258 HydrophobicContact CG-CG2 4.09Å
259	I	97.2	Very high	96.2	Very high	10 Å²	10	60 Å²	60	5%	0.051	35%	0.346	C	S	.	.			trans	-90.1	109.5	171	-57.4	173.5	0	0	0	106	M244 D261 A262 L276 I287 Y289 I310	M244-I259 HydrophobicContact CB-CD1 4.3Å; M244-I259 HydrophobicContact CG-CD1 4.31Å; M244-I259 HydrophobicContact CG-CG1 4.36Å; M244-I259 HydrophobicContact SD-CD1 3.95Å; M244-I259 HydrophobicContact SD-CG1 4.23Å; I259-D261 VanDerWaalsContact C-N 3.27Å; I259-D261 VanDerWaalsContact CG2-OD1 3.23Å; I259-D261 WeakPolarHBondContact CG2-OD1 3.45Å; I259-D261 PolarHBondContact O-N 2.91Å; I259-A262 HydrophobicContact CB-CB 3.73Å; I259-A262 HydrophobicContact CG2-CB 3.74Å; I259-A262 PolarHBondContact O-N 2.77Å; I259-A262 VanDerWaalsContact O-N 3.13Å; I259-L276 HydrophobicContact CD1-CD2 4.44Å; I259-I287 HydrophobicContact CD1-CD1 3.59Å; I259-I287 HydrophobicContact CD1-CG1 4.36Å; I259-I287 HydrophobicContact CD1-CG2 3.87Å; I259-Y289 HydrophobicContact CD1-CD1 4.47Å; I259-Y289 HydrophobicContact CD1-CE1 4.48Å; I259-Y289 HydrophobicContact CG2-CE1 4.12Å; I259-Y289 HydrophobicContact CG2-CE2 4.22Å; I259-I310 HydrophobicContact CD1-CD1 4.13Å; I259-I310 HydrophobicContact CG1-CD1 4.28Å; I259-I310 HydrophobicContact CG1-CG1 4.39Å
260	S	93.9	Very high	96	Very high	121 Å²	121	62.8 Å²	62.8	85%	0.846	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.6	-164	-62.6	0	0	0	0	114.2
261	D	94.4	Very high	95.9	Very high	55 Å²	55	58.3 Å²	58.3	29%	0.294	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-10.1	179	64.3	-35.6	0	0	0	113.3	I259 Y289 S291	I259-D261 VanDerWaalsContact C-N 3.27Å; I259-D261 VanDerWaalsContact CG2-OD1 3.23Å; I259-D261 WeakPolarHBondContact CG2-OD1 3.45Å; I259-D261 PolarHBondContact O-N 2.91Å; D261-Y289 PolarHBondContact OD1-OH 3.26Å; D261-Y289 PolarHBondContact OD2-OH 2.84Å; D261-Y289 VanDerWaalsContact OD2-OH 3.07Å; D261-S291 WeakPolarHBondContact O-CA 3.42Å; D261-S291 WeakPolarHBondContact O-CB 3.14Å
262	A	97.3	Very high	95.6	Very high	14 Å²	14	60.3 Å²	60.3	12%	0.116	34%	0.344	C	S	.	.			trans	-70.4	135.4	178.9	0	0	0	0	0	111.6	F242 I259 L276 Y289	F242-A262 HydrophobicContact CE1-CB 3.92Å; I259-A262 HydrophobicContact CB-CB 3.73Å; I259-A262 HydrophobicContact CG2-CB 3.74Å; I259-A262 PolarHBondContact O-N 2.77Å; I259-A262 VanDerWaalsContact O-N 3.13Å; A262-L276 HydrophobicContact CB-CD2 4.04Å; A262-Y289 HydrophobicContact CB-CD2 3.5Å; A262-Y289 VanDerWaalsContact CB-CD2 3.5Å; A262-Y289 HydrophobicContact CB-CE2 3.91Å; A262-Y289 HydrophobicContact CB-CG 3.97Å
263	S	96.4	Very high	95.4	Very high	6 Å²	6	57.3 Å²	57.3	4%	0.042	32%	0.323	C	S	.	.			trans	-108.3	134.6	-178.9	179.6	0	0	0	0	111.6	S265 A290 D292	S263-S265 PolarHBondContact O-N 2.83Å; S263-S265 WeakPolarHBondContact OG-CB 3.28Å; S263-S265 PolarHBondContact OG-N 2.93Å; S263-A290 PolarHBondContact N-O 3.22Å; S263-D292 VanDerWaalsContact CB-OD2 3.29Å; S263-D292 WeakPolarHBondContact CB-OD2 3.32Å; S263-D292 PolarHBondContact OG-OD2 3.48Å
264	A	95.1	Very high	95.3	Very high	54 Å²	54	50.3 Å²	50.3	45%	0.446	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	1.4	172.7	0	0	0	0	0	113	F242 N275	F242-A264 HydrophobicContact CD1-CB 4.19Å; F242-A264 HydrophobicContact CD2-CB 4.07Å; F242-A264 HydrophobicContact CE1-CB 4.21Å; F242-A264 HydrophobicContact CE2-CB 4.1Å; F242-A264 HydrophobicContact CG-CB 4.12Å; F242-A264 HydrophobicContact CZ-CB 4.17Å; A264-N275 VanDerWaalsContact C-ND2 3.28Å; A264-N275 PolarHBondContact O-ND2 2.81Å
265	S	95.8	Very high	95.2	Very high	84 Å²	84	48.1 Å²	48.1	59%	0.587	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-15.8	-176.2	-60.8	0	0	0	0	114.3	S263	S263-S265 PolarHBondContact O-N 2.83Å; S263-S265 WeakPolarHBondContact OG-CB 3.28Å; S263-S265 PolarHBondContact OG-N 2.93Å
266	F	97.1	Very high	95.2	Very high	31 Å²	31	45.9 Å²	45.9	14%	0.136	27%	0.272	C	S	.	.			trans	-115	117.9	-175.8	-53.5	-71.4	0	0	0	110.6	N275 A290 D292 Q321	F266-N275 PolarHBondContact O-ND2 2.84Å; F266-A290 HydrophobicContact CB-CB 3.78Å; F266-A290 HydrophobicContact CD2-CB 4.02Å; F266-A290 HydrophobicContact CG-CB 4.14Å; F266-D292 VanDerWaalsContact CE2-OD1 3.25Å; F266-D292 WeakPolarHBondContact CE2-OD1 3.44Å; F266-Q321 HydrophobicContact CD1-CG 4.46Å
267	S	96.3	Very high	95.2	Very high	10 Å²	10	41 Å²	41	7%	0.07	25%	0.253	C	S	.	.			trans	-120	176.3	172.6	-162.8	0	0	0	0	110.9	S271 Q274 K320 Q321	S267-S271 WeakPolarHBondContact CB-O 3.5Å; S267-S271 PolarHBondContact OG-O 2.92Å; S267-Q274 WeakPolarHBondContact CA-O 3.15Å; S267-Q274 VanDerWaalsContact OG-CA 3.28Å; S267-Q274 WeakPolarHBondContact OG-CA 3.39Å; S267-Q274 WeakPolarHBondContact OG-CB 3.31Å; S267-Q274 PolarHBondContact OG-N 3.34Å; S267-Q274 PolarHBondContact OG-O 3.17Å; S267-K320 CarbonylContact O-C 3.45Å; S267-Q321 WeakPolarHBondContact O-CA 3.45Å; S267-Q321 WeakPolarHBondContact O-CG 3.02Å; S267-Q321 PolarHBondContact O-N 2.93Å
268	Y	96.9	Very high	95.3	Very high	6 Å²	6	35.4 Å²	35.4	2%	0.024	23%	0.232	C	C	.	.			trans	-75.3	166.3	176.2	-71.9	-56.6	0	0	0	111.8	Y270 S271 Q274 D277 I298 K320 A323 G324 A326	Y268-Y270 VanDerWaalsContact C-N 3.26Å; Y268-Y270 PolarHBondContact O-N 3.11Å; Y268-S271 PolarHBondContact O-N 3.29Å; Y268-Q274 HydrophobicContact CD2-CB 4.16Å; Y268-D277 HydrophobicContact CE2-CB 3.96Å; Y268-D277 WeakPolarHBondContact CE2-OD2 3.34Å; Y268-D277 VanDerWaalsContact CZ-OD2 3.27Å; Y268-D277 PolarHBondContact OH-OD2 3.28Å; Y268-I298 HydrophobicContact CE1-CD1 4.41Å; Y268-K320 HydrophobicContact CD1-CG 3.75Å; Y268-K320 WeakPolarHBondContact CD1-O 3.42Å; Y268-K320 HydrophobicContact CE1-CD 4.43Å; Y268-K320 HydrophobicContact CE1-CG 3.64Å; Y268-K320 HydrophobicContact CG-CG 4.49Å; Y268-K320 VanDerWaalsContact CZ-NZ 3.26Å; Y268-A323 HydrophobicContact CD1-CB 4.05Å; Y268-A323 WeakPolarHBondContact CD1-O 3.32Å; Y268-A323 HydrophobicContact CE1-CB 4.16Å; Y268-G324 WeakPolarHBondContact CB-O 3.19Å; Y268-A326 HydrophobicContact CE1-CB 4.42Å; Y268-A326 WeakPolarHBondContact OH-CB 3.27Å; Y268-A326 PolarHBondContact OH-N 3.47Å
269	A	95.1	Very high	95.3	Very high	64 Å²	64	31.7 Å²	31.7	53%	0.529	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-31.9	-176.1	0	0	0	0	0	113.8	A323	A269-A323 WeakPolarHBondContact CB-O 3.42Å; A269-A323 PolarHBondContact N-O 2.85Å
270	Y	91.2	Very high	95.4	Very high	63 Å²	63	31.3 Å²	31.3	25%	0.247	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-3.7	-176.7	-60.5	-52.3	0	0	0	114.6	Y268 T338 E344 K366 Y371	Y268-Y270 VanDerWaalsContact C-N 3.26Å; Y268-Y270 PolarHBondContact O-N 3.11Å; Y270-T338 VanDerWaalsContact OH-CB 3.25Å; Y270-T338 WeakPolarHBondContact OH-CB 3.31Å; Y270-T338 PolarHBondContact OH-OG1 3.49Å; Y270-E344 PolarHBondContact OH-OE2 3.44Å; Y270-K366 PolarHBondContact OH-NZ 2.81Å; Y270-Y371 HydrophobicContact CD2-CD1 4.31Å; Y270-Y371 AromaticContact CD2-CE1 3.89Å; Y270-Y371 HydrophobicContact CD2-CE1 3.89Å; Y270-Y371 HydrophobicContact CD2-CE2 4.1Å; Y270-Y371 AromaticContact CD2-CZ 3.75Å; Y270-Y371 HydrophobicContact CE2-CD1 4.02Å; Y270-Y371 AromaticContact CE2-CE1 3.38Å; Y270-Y371 HydrophobicContact CE2-CE1 3.38Å; Y270-Y371 HydrophobicContact CE2-CE2 4.35Å; Y270-Y371 AromaticContact CE2-CZ 3.55Å
271	S	90.6	Very high	95.6	Very high	17 Å²	17	25.9 Å²	25.9	12%	0.119	17%	0.169	C	C	.	.			trans	-145.2	146.5	-175.5	-172.6	0	0	0	0	112.1	S267 Y268 S273	S267-S271 WeakPolarHBondContact CB-O 3.5Å; S267-S271 PolarHBondContact OG-O 2.92Å; Y268-S271 PolarHBondContact O-N 3.29Å; S271-S273 PolarHBondContact OG-N 2.98Å
272	S	90.4	Very high	95.7	Very high	101 Å²	101	25.4 Å²	25.4	71%	0.706	17%	0.165	S	C	*	.	S	Bend	trans	-92.7	-8.1	174.9	56.2	0	0	0	0	113.8
273	S	91.3	Very high	95.6	Very high	14 Å²	14	27.8 Å²	27.8	10%	0.098	18%	0.179	C	C	.	.	S	Bend	trans	-129.5	12.7	-167.6	64.3	0	0	0	0	114.7	P190 G224 Q237 S271	P190-S273 PolarHBondContact O-OG 3.12Å; G224-S273 VanDerWaalsContact CA-O 3.31Å; G224-S273 WeakPolarHBondContact CA-O 3.31Å; Q237-S273 PolarHBondContact NE2-O 3.37Å; S271-S273 PolarHBondContact OG-N 2.98Å
274	Q	93.5	Very high	95.6	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	18%	0.183	C	C	.	.			trans	-100	75	174.8	-71.6	179.1	-38.2	0	0	110.9	N226 S267 Y268 K320 S372	N226-Q274 PolarHBondContact OD1-NE2 3.14Å; S267-Q274 WeakPolarHBondContact CA-O 3.15Å; S267-Q274 VanDerWaalsContact OG-CA 3.28Å; S267-Q274 WeakPolarHBondContact OG-CA 3.39Å; S267-Q274 WeakPolarHBondContact OG-CB 3.31Å; S267-Q274 PolarHBondContact OG-N 3.34Å; S267-Q274 PolarHBondContact OG-O 3.17Å; Y268-Q274 HydrophobicContact CD2-CB 4.16Å; Q274-K320 PolarHBondContact O-NZ 2.97Å; Q274-S372 PolarHBondContact NE2-O 2.75Å
275	N	96.3	Very high	95.8	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.037	16%	0.162	C	C	.	.			trans	-87	-43.8	-179.3	-54.6	104.9	0	0	0	110.9	Q237 F242 A264 F266 K320	Q237-N275 PolarHBondContact NE2-OD1 2.96Å; F242-N275 HydrophobicContact CE2-CB 3.75Å; F242-N275 HydrophobicContact CZ-CB 3.68Å; A264-N275 VanDerWaalsContact C-ND2 3.28Å; A264-N275 PolarHBondContact O-ND2 2.81Å; F266-N275 PolarHBondContact O-ND2 2.84Å; N275-K320 VanDerWaalsContact O-CE 3.31Å; N275-K320 WeakPolarHBondContact O-CE 3.16Å
276	L	97.8	Very high	95.9	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.026	13%	0.134	C	C	.	.	S	Bend	trans	-101.9	140.9	170.7	-52.4	-177.8	0	0	0	109.5	Q237 F242 M244 I259 A262 I287 Y289	Q237-L276 HydrophobicContact CB-CB 4.12Å; Q237-L276 HydrophobicContact CB-CD1 4.47Å; Q237-L276 HydrophobicContact CG-CB 4.22Å; Q237-L276 HydrophobicContact CG-CD1 4.15Å; Q237-L276 HydrophobicContact CG-CG 4.16Å; F242-L276 HydrophobicContact CE1-CD2 4.22Å; F242-L276 HydrophobicContact CE2-CD1 4.21Å; F242-L276 HydrophobicContact CE2-CD2 4.4Å; F242-L276 HydrophobicContact CE2-CG 3.9Å; F242-L276 HydrophobicContact CZ-CD1 4.19Å; F242-L276 HydrophobicContact CZ-CD2 3.66Å; F242-L276 HydrophobicContact CZ-CG 3.67Å; M244-L276 HydrophobicContact CB-CD1 4.17Å; I259-L276 HydrophobicContact CD1-CD2 4.44Å; A262-L276 HydrophobicContact CB-CD2 4.04Å; L276-I287 HydrophobicContact CB-CD1 3.92Å; L276-I287 HydrophobicContact CB-CG1 4.32Å; L276-I287 HydrophobicContact CD1-CD1 4.02Å; L276-I287 HydrophobicContact CD2-CD1 4.19Å; L276-I287 HydrophobicContact CG-CD1 4.26Å; L276-Y289 HydrophobicContact CD2-CG 4.38Å
277	D	98.1	Very high	96	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	106.4	-174.5	173.4	23.9	0	0	0	108.5	N226 Y268 I287 I288	N226-D277 HydrophobicContact CB-CB 4.14Å; N226-D277 WeakPolarHBondContact CB-OD1 3.19Å; N226-D277 VanDerWaalsContact CG-OD1 3.28Å; N226-D277 PolarHBondContact ND2-OD1 3.46Å; N226-D277 PolarHBondContact ND2-OD2 3.34Å; Y268-D277 HydrophobicContact CE2-CB 3.96Å; Y268-D277 WeakPolarHBondContact CE2-OD2 3.34Å; Y268-D277 VanDerWaalsContact CZ-OD2 3.27Å; Y268-D277 PolarHBondContact OH-OD2 3.28Å; D277-I287 CarbonylContact O-C 3.57Å; D277-I287 WeakPolarHBondContact O-CA 3.47Å; D277-I288 HydrophobicContact CB-CB 4.04Å; D277-I288 WeakPolarHBondContact CB-O 3.42Å; D277-I288 PolarHBondContact N-O 3.34Å; D277-I288 PolarHBondContact O-N 2.62Å
278	F	98.6	Very high	96.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.8	179.4	-78.3	-86.6	0	0	0	110	N226 I228 Y235 Y236 M244 I287 I303 F308	N226-F278 PolarHBondContact O-N 3.37Å; I228-F278 HydrophobicContact CD1-CB 4Å; I228-F278 HydrophobicContact CG1-CB 3.85Å; I228-F278 HydrophobicContact CG2-CB 4.35Å; I228-F278 VanDerWaalsContact CG2-O 3.25Å; I228-F278 WeakPolarHBondContact CG2-O 3.3Å; Y235-F278 HydrophobicContact CD1-CD1 4.19Å; Y235-F278 AromaticContact CD1-CE1 3.71Å; Y235-F278 HydrophobicContact CD1-CE1 3.71Å; Y235-F278 HydrophobicContact CD1-CZ 4.22Å; Y235-F278 HydrophobicContact CG-CD1 4.23Å; Y235-F278 HydrophobicContact CG-CE1 4.13Å; Y236-F278 VanDerWaalsContact C-CE2 3.45Å; Y236-F278 VanDerWaalsContact N-CE2 3.31Å; Y236-F278 WeakPolarHBondContact O-CE2 3.22Å; M244-F278 HydrophobicContact CB-CE1 4.3Å; M244-F278 HydrophobicContact CB-CE2 4.26Å; M244-F278 HydrophobicContact CB-CZ 3.58Å; M244-F278 HydrophobicContact CG-CZ 4.49Å; F278-I287 HydrophobicContact CE1-CD1 4.18Å; F278-I287 HydrophobicContact CE2-CD1 4.25Å; F278-I287 HydrophobicContact CZ-CD1 4.1Å; F278-I303 HydrophobicContact CD1-CD1 3.96Å; F278-I303 HydrophobicContact CE1-CD1 3.71Å; F278-F308 HydrophobicContact CE1-CE2 4.45Å
279	A	98.6	Very high	96.2	Very high	2 Å²	2	19.5 Å²	19.5	2%	0.017	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.2	175.3	0	0	0	0	0	110.1	W286 I288 M328	A279-W286 HydrophobicContact CB-CB 4.35Å; A279-W286 PolarHBondContact N-O 3.27Å; A279-W286 WeakPolarHBondContact O-CA 3.47Å; A279-W286 PolarHBondContact O-N 3.39Å; A279-I288 HydrophobicContact CB-CD1 4.36Å; A279-M328 HydrophobicContact CB-CB 4.19Å; A279-M328 HydrophobicContact CB-CG 3.81Å
280	A	98.1	Very high	96.3	Very high	2 Å²	2	16.5 Å²	16.5	2%	0.017	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.7	171.1	0	0	0	0	0	109.4	S172 I228 G284 L285 P378	S172-A280 WeakPolarHBondContact OG-CB 2.98Å; I228-A280 HydrophobicContact CD1-CB 3.95Å; A280-G284 WeakPolarHBondContact CA-O 3.31Å; A280-L285 HydrophobicContact CB-CD1 4.48Å; A280-P378 WeakPolarHBondContact O-CD 3.35Å
281	D	98	Very high	96.6	Very high	7 Å²	7	13.5 Å²	13.5	4%	0.037	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	-173.6	174.2	74.3	2.7	0	0	0	110.5	T283 G284 W286 M328 C330 G331 Y376	D281-T283 PolarHBondContact O-N 2.85Å; D281-T283 VanDerWaalsContact O-N 3.08Å; D281-T283 WeakPolarHBondContact OD1-CA 3.33Å; D281-T283 WeakPolarHBondContact OD1-CB 3.12Å; D281-T283 PolarHBondContact OD1-N 3.22Å; D281-T283 PolarHBondContact OD1-OG1 3.12Å; D281-T283 PolarHBondContact OD2-OG1 3.37Å; D281-G284 PolarHBondContact N-O 2.87Å; D281-G284 PolarHBondContact O-N 2.85Å; D281-G284 PolarHBondContact OD1-N 2.83Å; D281-W286 PolarHBondContact OD1-NE1 2.74Å; D281-W286 PolarHBondContact OD2-NE1 3.08Å; D281-M328 HydrophobicContact CB-CB 3.98Å; D281-C330 PolarHBondContact OD2-N 2.85Å; D281-G331 WeakPolarHBondContact OD2-CA 3.47Å; D281-G331 PolarHBondContact OD2-N 2.79Å; D281-Y376 HydrophobicContact CB-CD1 4.5Å; D281-Y376 HydrophobicContact CB-CE1 4.5Å
282	E	96.9	Very high	96.9	Very high	45 Å²	45	17.6 Å²	17.6	21%	0.21	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.5	179.9	-65.4	77.1	-168.7	0	0	113.3	C139 C330 Y376 P378	C139-E282 WeakPolarHBondContact SG-CB 3.43Å; E282-C330 PolarHBondContact OE2-N 3.36Å; E282-C330 PolarHBondContact OE2-SG 2.99Å; E282-C330 VanDerWaalsContact OE2-SG 3.37Å; E282-Y376 WeakPolarHBondContact OE1-CE1 3.48Å; E282-Y376 PolarHBondContact OE1-OH 2.91Å; E282-P378 HydrophobicContact CG-CB 4.16Å
283	T	96.3	Very high	97.1	Very high	65 Å²	65	20.7 Å²	20.7	40%	0.399	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.5	-174.9	76.1	0	0	0	0	113.2	D281 W286 K302	D281-T283 PolarHBondContact O-N 2.85Å; D281-T283 VanDerWaalsContact O-N 3.08Å; D281-T283 WeakPolarHBondContact OD1-CA 3.33Å; D281-T283 WeakPolarHBondContact OD1-CB 3.12Å; D281-T283 PolarHBondContact OD1-N 3.22Å; D281-T283 PolarHBondContact OD1-OG1 3.12Å; D281-T283 PolarHBondContact OD2-OG1 3.37Å; T283-W286 VanDerWaalsContact OG1-CZ2 3.22Å; T283-W286 WeakPolarHBondContact OG1-CZ2 3.24Å; T283-K302 PolarHBondContact O-NZ 3.38Å
284	G	95.8	Very high	97.3	Very high	12 Å²	12	21.5 Å²	21.5	12%	0.124	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.2	-157.4	171.5	0	0	0	0	0	115	A280 D281 W286	A280-G284 WeakPolarHBondContact CA-O 3.31Å; D281-G284 PolarHBondContact N-O 2.87Å; D281-G284 PolarHBondContact O-N 2.85Å; D281-G284 PolarHBondContact OD1-N 2.83Å; G284-W286 VanDerWaalsContact O-CD1 3.23Å; G284-W286 PolarHBondContact O-NE1 3.28Å
285	L	98.6	Very high	97.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	139.4	-179.1	-176.9	65.4	0	0	0	110.9	I228 H230 Y235 A280 I303 E305	I228-L285 HydrophobicContact CD1-CD1 3.65Å; H230-L285 HydrophobicContact CB-CD1 4.37Å; Y235-L285 HydrophobicContact CD1-CD2 4.04Å; Y235-L285 HydrophobicContact CE1-CD2 3.55Å; Y235-L285 HydrophobicContact CE2-CD2 4.41Å; A280-L285 HydrophobicContact CB-CD1 4.48Å; L285-I303 HydrophobicContact CB-CB 4.3Å; L285-I303 HydrophobicContact CD2-CB 4.08Å; L285-I303 HydrophobicContact CD2-CD1 4.06Å; L285-I303 HydrophobicContact CD2-CG2 3.95Å; L285-I303 HydrophobicContact CG-CB 4.06Å; L285-I303 HydrophobicContact CG-CD1 3.91Å; L285-I303 HydrophobicContact CG-CG2 4.49Å; L285-I303 PolarHBondContact O-N 3.42Å; L285-E305 HydrophobicContact CB-CG 4.13Å; L285-E305 HydrophobicContact CD2-CG 4.45Å
286	W	98.8	Very high	97.5	Very high	3 Å²	3	28.8 Å²	28.8	1%	0.011	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	156.5	-173.2	-55.3	91	0	0	0	111.2	A279 D281 T283 G284 I300 A301 K302 W314 M328 T352	A279-W286 HydrophobicContact CB-CB 4.35Å; A279-W286 PolarHBondContact N-O 3.27Å; A279-W286 WeakPolarHBondContact O-CA 3.47Å; A279-W286 PolarHBondContact O-N 3.39Å; D281-W286 PolarHBondContact OD1-NE1 2.74Å; D281-W286 PolarHBondContact OD2-NE1 3.08Å; T283-W286 VanDerWaalsContact OG1-CZ2 3.22Å; T283-W286 WeakPolarHBondContact OG1-CZ2 3.24Å; G284-W286 VanDerWaalsContact O-CD1 3.23Å; G284-W286 PolarHBondContact O-NE1 3.28Å; W286-I300 HydrophobicContact CE3-CG2 3.8Å; W286-I300 HydrophobicContact CZ3-CG2 4.12Å; W286-A301 CarbonylContact C-O 3.59Å; W286-A301 WeakPolarHBondContact CA-O 3.49Å; W286-K302 HydrophobicContact CD2-CB 4.48Å; W286-K302 HydrophobicContact CD2-CG 4.35Å; W286-K302 HydrophobicContact CE3-CB 3.76Å; W286-K302 HydrophobicContact CE3-CG 4.07Å; W286-K302 HydrophobicContact CH2-CB 4.25Å; W286-K302 HydrophobicContact CH2-CD 4.04Å; W286-K302 HydrophobicContact CH2-CG 4.18Å; W286-K302 HydrophobicContact CZ2-CD 4.35Å; W286-K302 HydrophobicContact CZ2-CG 4.43Å; W286-K302 HydrophobicContact CZ3-CB 3.64Å; W286-K302 HydrophobicContact CZ3-CD 4.29Å; W286-K302 HydrophobicContact CZ3-CG 4Å; W286-W314 HydrophobicContact CE3-CZ3 4.38Å; W286-W314 HydrophobicContact CH2-CH2 4.17Å; W286-W314 HydrophobicContact CH2-CZ3 4.29Å; W286-W314 HydrophobicContact CZ3-CE3 4.17Å; W286-W314 AromaticContact CZ3-CH2 3.82Å; W286-W314 HydrophobicContact CZ3-CH2 3.82Å; W286-W314 AromaticContact CZ3-CZ3 3.49Å; W286-W314 HydrophobicContact CZ3-CZ3 3.49Å; W286-W314 VanDerWaalsContact CZ3-CZ3 3.49Å; W286-M328 HydrophobicContact CB-CG 3.9Å; W286-M328 HydrophobicContact CD2-CE 3.75Å; W286-M328 HydrophobicContact CD2-CG 4.26Å; W286-M328 HydrophobicContact CE3-CE 3.92Å; W286-M328 HydrophobicContact CG-CB 4.4Å; W286-M328 HydrophobicContact CG-CE 4.25Å; W286-M328 HydrophobicContact CG-CG 3.74Å; W286-M328 HydrophobicContact CH2-CE 4.08Å; W286-M328 HydrophobicContact CZ2-CE 3.91Å; W286-M328 HydrophobicContact CZ3-CE 4.07Å; W286-T352 HydrophobicContact CH2-CG2 4.1Å; W286-T352 HydrophobicContact CZ3-CG2 4.06Å
287	I	98.6	Very high	97.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.4	166.2	-167.1	164	0	0	0	109.9	M244 I259 L276 D277 F278 Y289 A301 I303 I310	M244-I287 HydrophobicContact CB-CD1 3.58Å; M244-I287 HydrophobicContact CG-CD1 4.46Å; M244-I287 HydrophobicContact SD-CD1 4.12Å; I259-I287 HydrophobicContact CD1-CD1 3.59Å; I259-I287 HydrophobicContact CD1-CG1 4.36Å; I259-I287 HydrophobicContact CD1-CG2 3.87Å; L276-I287 HydrophobicContact CB-CD1 3.92Å; L276-I287 HydrophobicContact CB-CG1 4.32Å; L276-I287 HydrophobicContact CD1-CD1 4.02Å; L276-I287 HydrophobicContact CD2-CD1 4.19Å; L276-I287 HydrophobicContact CG-CD1 4.26Å; D277-I287 CarbonylContact O-C 3.57Å; D277-I287 WeakPolarHBondContact O-CA 3.47Å; F278-I287 HydrophobicContact CE1-CD1 4.18Å; F278-I287 HydrophobicContact CE2-CD1 4.25Å; F278-I287 HydrophobicContact CZ-CD1 4.1Å; I287-Y289 HydrophobicContact CG2-CD1 4.27Å; I287-Y289 HydrophobicContact CG2-CE1 4.36Å; I287-A301 HydrophobicContact CG2-CB 3.92Å; I287-A301 PolarHBondContact N-O 3.07Å; I287-A301 PolarHBondContact O-N 2.98Å; I287-I303 HydrophobicContact CB-CD1 3.83Å; I287-I303 HydrophobicContact CB-CG1 4.4Å; I287-I303 HydrophobicContact CG2-CD1 4.06Å; I287-I303 HydrophobicContact CG2-CG1 4.11Å; I287-I310 HydrophobicContact CG2-CD1 3.88Å
288	I	98.8	Very high	97.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.7	179.5	-52.8	174.1	0	0	0	107.2	D277 A279 I298 V299 A326 M328 M333	D277-I288 HydrophobicContact CB-CB 4.04Å; D277-I288 WeakPolarHBondContact CB-O 3.42Å; D277-I288 PolarHBondContact N-O 3.34Å; D277-I288 PolarHBondContact O-N 2.62Å; A279-I288 HydrophobicContact CB-CD1 4.36Å; I288-I298 HydrophobicContact CG2-CG2 3.45Å; I288-I298 VanDerWaalsContact CG2-CG2 3.45Å; I288-V299 WeakPolarHBondContact CA-O 3.41Å; I288-A326 HydrophobicContact CD1-CB 3.95Å; I288-A326 HydrophobicContact CG2-CB 4.44Å; I288-M328 HydrophobicContact CD1-CG 4.36Å; I288-M328 HydrophobicContact CD1-SD 4.43Å; I288-M333 HydrophobicContact CD1-CG 4.21Å
289	Y	98.5	Very high	97.6	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	-170.8	-179.1	62.4	-86.6	0	0	0	110.3	I259 D261 A262 L276 I287 I298 V299 A301	I259-Y289 HydrophobicContact CD1-CD1 4.47Å; I259-Y289 HydrophobicContact CD1-CE1 4.48Å; I259-Y289 HydrophobicContact CG2-CE1 4.12Å; I259-Y289 HydrophobicContact CG2-CE2 4.22Å; D261-Y289 PolarHBondContact OD1-OH 3.26Å; D261-Y289 PolarHBondContact OD2-OH 2.84Å; D261-Y289 VanDerWaalsContact OD2-OH 3.07Å; A262-Y289 HydrophobicContact CB-CD2 3.5Å; A262-Y289 VanDerWaalsContact CB-CD2 3.5Å; A262-Y289 HydrophobicContact CB-CE2 3.91Å; A262-Y289 HydrophobicContact CB-CG 3.97Å; L276-Y289 HydrophobicContact CD2-CG 4.38Å; I287-Y289 HydrophobicContact CG2-CD1 4.27Å; I287-Y289 HydrophobicContact CG2-CE1 4.36Å; Y289-I298 CarbonylContact O-C 3.47Å; Y289-I298 WeakPolarHBondContact O-CA 3.37Å; Y289-V299 HydrophobicContact CD2-CB 4.08Å; Y289-V299 HydrophobicContact CE1-CB 4.31Å; Y289-V299 HydrophobicContact CE1-CG1 3.98Å; Y289-V299 HydrophobicContact CE2-CB 3.76Å; Y289-V299 HydrophobicContact CE2-CG1 3.78Å; Y289-V299 HydrophobicContact CE2-CG2 4.29Å; Y289-V299 HydrophobicContact CG-CB 4.48Å; Y289-V299 VanDerWaalsContact CZ-CG1 3.45Å; Y289-V299 PolarHBondContact N-O 3.25Å; Y289-V299 PolarHBondContact O-N 2.96Å; Y289-V299 WeakPolarHBondContact OH-CG1 3.43Å; Y289-A301 HydrophobicContact CE1-CB 3.79Å
290	A	98.4	Very high	97.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	156.1	167.7	0	0	0	0	0	109.9	S263 F266 K297 K320	S263-A290 PolarHBondContact N-O 3.22Å; F266-A290 HydrophobicContact CB-CB 3.78Å; F266-A290 HydrophobicContact CD2-CB 4.02Å; F266-A290 HydrophobicContact CG-CB 4.14Å; A290-K297 WeakPolarHBondContact CB-O 3.48Å; A290-K320 HydrophobicContact CB-CB 3.99Å; A290-K320 HydrophobicContact CB-CD 3.93Å
291	S	96.8	Very high	97.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	16%	0.155	C	C	.	.			trans	-122.3	153	179.3	65.3	0	0	0	0	111.2	D261 E293 N294 K295 G296	D261-S291 WeakPolarHBondContact O-CA 3.42Å; D261-S291 WeakPolarHBondContact O-CB 3.14Å; S291-E293 VanDerWaalsContact C-N 3.27Å; S291-N294 CarbonylContact O-C 3.47Å; S291-N294 PolarHBondContact O-N 3.1Å; S291-N294 WeakPolarHBondContact OG-CB 3.46Å; S291-N294 PolarHBondContact OG-N 2.95Å; S291-K295 PolarHBondContact O-N 2.95Å; S291-G296 PolarHBondContact O-N 3.37Å
292	D	96.2	Very high	97.6	Very high	103 Å²	103	32.5 Å²	32.5	55%	0.551	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-36.8	172.1	-69	-62.5	0	0	0	111.1	S263 F266 N294 K295	S263-D292 VanDerWaalsContact CB-OD2 3.29Å; S263-D292 WeakPolarHBondContact CB-OD2 3.32Å; S263-D292 PolarHBondContact OG-OD2 3.48Å; F266-D292 VanDerWaalsContact CE2-OD1 3.25Å; F266-D292 WeakPolarHBondContact CE2-OD1 3.44Å; D292-N294 VanDerWaalsContact C-N 3.34Å; D292-N294 PolarHBondContact O-N 3.38Å; D292-K295 WeakPolarHBondContact O-CA 3.44Å; D292-K295 PolarHBondContact O-N 3.42Å
293	E	94.5	Very high	97.7	Very high	166 Å²	166	30.6 Å²	30.6	78%	0.776	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-41.5	175.9	-173.3	175.6	-179.4	0	0	112.1	S291 K295	S291-E293 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.18Å
294	N	95.6	Very high	97.7	Very high	31 Å²	31	30.2 Å²	30.2	17%	0.166	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	16.8	174.3	-159.6	27	0	0	0	112.9	S291 D292 G296 K297 V299	S291-N294 CarbonylContact O-C 3.47Å; S291-N294 PolarHBondContact O-N 3.1Å; S291-N294 WeakPolarHBondContact OG-CB 3.46Å; S291-N294 PolarHBondContact OG-N 2.95Å; D292-N294 VanDerWaalsContact C-N 3.34Å; D292-N294 PolarHBondContact O-N 3.38Å; N294-G296 VanDerWaalsContact C-N 3.27Å; N294-G296 PolarHBondContact O-N 3.01Å; N294-K297 WeakPolarHBondContact ND2-CB 3.22Å; N294-K297 PolarHBondContact ND2-O 3.1Å; N294-K297 VanDerWaalsContact O-CB 3.31Å; N294-K297 WeakPolarHBondContact O-CB 3.47Å; N294-K297 WeakPolarHBondContact O-CG 3.13Å; N294-K297 PolarHBondContact O-N 3.42Å; N294-V299 HydrophobicContact CB-CG2 4.12Å
295	K	97	Very high	97.7	Very high	160 Å²	160	32.4 Å²	32.4	70%	0.696	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	37.9	175.1	-53.4	179.7	-178.2	179.5	0	113.3	S291 D292 E293 K297 Y319	S291-K295 PolarHBondContact O-N 2.95Å; D292-K295 WeakPolarHBondContact O-CA 3.44Å; D292-K295 PolarHBondContact O-N 3.42Å; E293-K295 PolarHBondContact O-N 3.18Å; K295-K297 VanDerWaalsContact C-N 3.27Å; K295-K297 PolarHBondContact O-N 3.24Å; K295-Y319 VanDerWaalsContact O-CE1 3.24Å; K295-Y319 WeakPolarHBondContact O-CE1 3.24Å
296	G	97.6	Very high	97.5	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.01	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	9.9	180	0	0	0	0	0	115	S291 N294 K320	S291-G296 PolarHBondContact O-N 3.37Å; N294-G296 VanDerWaalsContact C-N 3.27Å; N294-G296 PolarHBondContact O-N 3.01Å; G296-K320 PolarHBondContact O-N 3.1Å
297	K	98.5	Very high	97.4	Very high	58 Å²	58	44.4 Å²	44.4	25%	0.252	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	149.4	171.1	-64	176.6	179.7	-176.6	0	111.6	A290 N294 K295 V299 T316 V318 Y319	A290-K297 WeakPolarHBondContact CB-O 3.48Å; N294-K297 WeakPolarHBondContact ND2-CB 3.22Å; N294-K297 PolarHBondContact ND2-O 3.1Å; N294-K297 VanDerWaalsContact O-CB 3.31Å; N294-K297 WeakPolarHBondContact O-CB 3.47Å; N294-K297 WeakPolarHBondContact O-CG 3.13Å; N294-K297 PolarHBondContact O-N 3.42Å; K295-K297 VanDerWaalsContact C-N 3.27Å; K295-K297 PolarHBondContact O-N 3.24Å; K297-V299 PolarHBondContact O-N 3.04Å; K297-T316 WeakPolarHBondContact CB-O 3.47Å; K297-T316 WeakPolarHBondContact CD-O 3.04Å; K297-V318 CarbonylContact C-O 3.42Å; K297-V318 WeakPolarHBondContact CA-O 3.33Å; K297-V318 WeakPolarHBondContact CB-O 3.24Å; K297-Y319 HydrophobicContact CG-CD1 3.96Å; K297-Y319 HydrophobicContact CG-CE1 4.01Å; K297-Y319 HydrophobicContact CG-CG 4.31Å
298	I	98.6	Very high	97.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	133.2	-178	-66.7	171.6	0	0	0	109.7	Y268 I288 Y289 I300 T316 V318 K320 A323 M333 A335	Y268-I298 HydrophobicContact CE1-CD1 4.41Å; I288-I298 HydrophobicContact CG2-CG2 3.45Å; I288-I298 VanDerWaalsContact CG2-CG2 3.45Å; Y289-I298 CarbonylContact O-C 3.47Å; Y289-I298 WeakPolarHBondContact O-CA 3.37Å; I298-I300 HydrophobicContact CG2-CG1 4.36Å; I298-T316 WeakPolarHBondContact CB-OG1 3.35Å; I298-T316 HydrophobicContact CG2-CG2 4.38Å; I298-T316 WeakPolarHBondContact O-CB 3.28Å; I298-T316 WeakPolarHBondContact O-CG2 3.4Å; I298-T316 PolarHBondContact O-N 2.75Å; I298-T316 PolarHBondContact O-OG1 3.47Å; I298-V318 HydrophobicContact CD1-CG1 4.04Å; I298-V318 PolarHBondContact N-O 2.97Å; I298-K320 HydrophobicContact CG1-CB 3.76Å; I298-K320 HydrophobicContact CG1-CG 4Å; I298-A323 HydrophobicContact CD1-CB 4.24Å; I298-M333 HydrophobicContact CG2-CE 3.98Å; I298-A335 HydrophobicContact CD1-CB 4.48Å
299	V	98.7	Very high	97.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.1	170.9	-178	0	0	0	0	107.1	I288 Y289 N294 K297 T313 W314	I288-V299 WeakPolarHBondContact CA-O 3.41Å; Y289-V299 HydrophobicContact CD2-CB 4.08Å; Y289-V299 HydrophobicContact CE1-CB 4.31Å; Y289-V299 HydrophobicContact CE1-CG1 3.98Å; Y289-V299 HydrophobicContact CE2-CB 3.76Å; Y289-V299 HydrophobicContact CE2-CG1 3.78Å; Y289-V299 HydrophobicContact CE2-CG2 4.29Å; Y289-V299 HydrophobicContact CG-CB 4.48Å; Y289-V299 VanDerWaalsContact CZ-CG1 3.45Å; Y289-V299 PolarHBondContact N-O 3.25Å; Y289-V299 PolarHBondContact O-N 2.96Å; Y289-V299 WeakPolarHBondContact OH-CG1 3.43Å; N294-V299 HydrophobicContact CB-CG2 4.12Å; K297-V299 PolarHBondContact O-N 3.04Å; V299-T313 HydrophobicContact CG1-CG2 3.24Å; V299-W314 WeakPolarHBondContact CA-O 3.25Å
300	I	98.4	Very high	97.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.2	176.2	-53.8	154.2	0	0	0	106.5	W286 I298 T313 W314 T316 M328 M333 Y350 T352	W286-I300 HydrophobicContact CE3-CG2 3.8Å; W286-I300 HydrophobicContact CZ3-CG2 4.12Å; I298-I300 HydrophobicContact CG2-CG1 4.36Å; I300-T313 CarbonylContact O-C 3.58Å; I300-T313 WeakPolarHBondContact O-CA 3.39Å; I300-W314 HydrophobicContact CB-CB 4.49Å; I300-W314 PolarHBondContact N-O 2.59Å; I300-W314 PolarHBondContact O-N 2.92Å; I300-T316 HydrophobicContact CD1-CG2 3.65Å; I300-T316 HydrophobicContact CG1-CG2 4.12Å; I300-M328 HydrophobicContact CG2-CE 4.09Å; I300-M328 HydrophobicContact CG2-SD 3.9Å; I300-M333 HydrophobicContact CD1-CB 3.39Å; I300-M333 HydrophobicContact CD1-CE 4Å; I300-M333 HydrophobicContact CD1-CG 3.89Å; I300-M333 HydrophobicContact CG1-CB 4.04Å; I300-M333 HydrophobicContact CG1-CE 4.4Å; I300-M333 HydrophobicContact CG1-CG 4.07Å; I300-Y350 HydrophobicContact CD1-CD1 3.84Å; I300-Y350 HydrophobicContact CD1-CG 4.14Å; I300-T352 HydrophobicContact CD1-CG2 4.5Å; I300-T352 HydrophobicContact CG2-CG2 4.42Å
301	A	98.5	Very high	97.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138	173.2	0	0	0	0	0	111.8	W286 I287 Y289 I310 N312	W286-A301 CarbonylContact C-O 3.59Å; W286-A301 WeakPolarHBondContact CA-O 3.49Å; I287-A301 HydrophobicContact CG2-CB 3.92Å; I287-A301 PolarHBondContact N-O 3.07Å; I287-A301 PolarHBondContact O-N 2.98Å; Y289-A301 HydrophobicContact CE1-CB 3.79Å; A301-I310 HydrophobicContact CB-CD1 3.96Å; A301-I310 HydrophobicContact CB-CG2 3.91Å; A301-N312 CarbonylContact C-O 3.46Å; A301-N312 WeakPolarHBondContact CA-O 3.44Å
302	K	98.6	Very high	97.2	Very high	35 Å²	35	57 Å²	57	15%	0.152	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.7	175.6	-164.6	175.1	-174.4	73.3	0	109.1	T283 W286 E311 N312 W314	T283-K302 PolarHBondContact O-NZ 3.38Å; W286-K302 HydrophobicContact CD2-CB 4.48Å; W286-K302 HydrophobicContact CD2-CG 4.35Å; W286-K302 HydrophobicContact CE3-CB 3.76Å; W286-K302 HydrophobicContact CE3-CG 4.07Å; W286-K302 HydrophobicContact CH2-CB 4.25Å; W286-K302 HydrophobicContact CH2-CD 4.04Å; W286-K302 HydrophobicContact CH2-CG 4.18Å; W286-K302 HydrophobicContact CZ2-CD 4.35Å; W286-K302 HydrophobicContact CZ2-CG 4.43Å; W286-K302 HydrophobicContact CZ3-CB 3.64Å; W286-K302 HydrophobicContact CZ3-CD 4.29Å; W286-K302 HydrophobicContact CZ3-CG 4Å; K302-E311 WeakPolarHBondContact CD-OE2 3.48Å; K302-E311 PolarHBondContact O-N 3.4Å; K302-N312 PolarHBondContact N-O 2.69Å; K302-W314 HydrophobicContact CB-CH2 4.08Å; K302-W314 HydrophobicContact CB-CZ3 3.87Å
303	I	98.5	Very high	97.3	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.9	179.8	-62	167	0	0	0	109.1	M244 F278 L285 I287 E305 F308 G309 I310	M244-I303 HydrophobicContact SD-CD1 4.03Å; M244-I303 HydrophobicContact SD-CG1 4.3Å; F278-I303 HydrophobicContact CD1-CD1 3.96Å; F278-I303 HydrophobicContact CE1-CD1 3.71Å; L285-I303 HydrophobicContact CB-CB 4.3Å; L285-I303 HydrophobicContact CD2-CB 4.08Å; L285-I303 HydrophobicContact CD2-CD1 4.06Å; L285-I303 HydrophobicContact CD2-CG2 3.95Å; L285-I303 HydrophobicContact CG-CB 4.06Å; L285-I303 HydrophobicContact CG-CD1 3.91Å; L285-I303 HydrophobicContact CG-CG2 4.49Å; L285-I303 PolarHBondContact O-N 3.42Å; I287-I303 HydrophobicContact CB-CD1 3.83Å; I287-I303 HydrophobicContact CB-CG1 4.4Å; I287-I303 HydrophobicContact CG2-CD1 4.06Å; I287-I303 HydrophobicContact CG2-CG1 4.11Å; I303-E305 PolarHBondContact O-N 3.1Å; I303-F308 HydrophobicContact CG2-CD2 4.03Å; I303-G309 CarbonylContact C-O 3.59Å; I303-G309 WeakPolarHBondContact CA-O 3.47Å; I303-I310 HydrophobicContact CG1-CD1 4.33Å
304	D	97.8	Very high	97.4	Very high	58 Å²	58	48.4 Å²	48.4	31%	0.31	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	107.8	165.2	173.8	-105	0	0	0	108.9	K306 S307 F308 G309 E311	D304-K306 PolarHBondContact O-N 3.25Å; D304-K306 VanDerWaalsContact O-N 3.12Å; D304-S307 PolarHBondContact O-N 3.29Å; D304-S307 WeakPolarHBondContact OD1-CA 3.44Å; D304-S307 WeakPolarHBondContact OD1-CB 3.26Å; D304-S307 PolarHBondContact OD1-N 3.08Å; D304-S307 PolarHBondContact OD1-OG 3.4Å; D304-F308 VanDerWaalsContact O-CA 3.24Å; D304-F308 WeakPolarHBondContact O-CA 3.31Å; D304-F308 PolarHBondContact O-N 2.97Å; D304-G309 PolarHBondContact N-O 2.96Å; D304-E311 HydrophobicContact CB-CB 4.42Å
305	E	95.3	Very high	97.5	Very high	57 Å²	57	51.1 Å²	51.1	27%	0.266	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.5	-174.2	-69.1	-179.6	-133.5	0	0	112.9	K173 H230 L285 I303	K173-E305 IonicContact NZ-OE1 3.08Å; K173-E305 PolarHBondContact NZ-OE1 3.31Å; K173-E305 IonicContact NZ-OE2 3.7Å; K173-E305 PolarHBondContact NZ-OE2 3.42Å; H230-E305 IonicContact NE2-OE1 3.6Å; H230-E305 PolarHBondContact NE2-OE1 2.96Å; H230-E305 IonicContact NE2-OE2 2.74Å; L285-E305 HydrophobicContact CB-CG 4.13Å; L285-E305 HydrophobicContact CD2-CG 4.45Å; I303-E305 PolarHBondContact O-N 3.1Å
306	K	94.3	Very high	97.6	Very high	196 Å²	196	43.7 Å²	43.7	85%	0.852	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-51.7	-175.5	-176	179.9	178.2	-177.1	0	112.4	D304 F308	D304-K306 PolarHBondContact O-N 3.25Å; D304-K306 VanDerWaalsContact O-N 3.12Å; K306-F308 VanDerWaalsContact C-N 3.34Å
307	S	95.9	Very high	97.5	Very high	61 Å²	61	45 Å²	45	43%	0.427	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-14.3	179.8	66.5	0	0	0	0	113.2	D304 G309	D304-S307 PolarHBondContact O-N 3.29Å; D304-S307 WeakPolarHBondContact OD1-CA 3.44Å; D304-S307 WeakPolarHBondContact OD1-CB 3.26Å; D304-S307 PolarHBondContact OD1-N 3.08Å; D304-S307 PolarHBondContact OD1-OG 3.4Å; S307-G309 PolarHBondContact O-N 3.45Å; S307-G309 PolarHBondContact OG-N 3.02Å
308	F	97.2	Very high	97.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	34.4	-168.2	-166.7	-137.7	0	0	0	112.1	Y235 M244 K246 D255 R257 F278 I303 D304 K306	Y235-F308 AromaticContact CD1-CE2 3.7Å; Y235-F308 HydrophobicContact CD1-CE2 3.7Å; Y235-F308 HydrophobicContact CD1-CZ 4.23Å; Y235-F308 HydrophobicContact CE1-CD2 4.03Å; Y235-F308 AromaticContact CE1-CE2 3.56Å; Y235-F308 HydrophobicContact CE1-CE2 3.56Å; Y235-F308 HydrophobicContact CE1-CZ 4.36Å; M244-F308 HydrophobicContact CB-CZ 4.46Å; M244-F308 HydrophobicContact CE-CD2 4.38Å; M244-F308 HydrophobicContact CE-CE2 4.33Å; M244-F308 WeakPolarHBondContact CE-O 3.45Å; M244-F308 HydrophobicContact CG-CE1 4.31Å; M244-F308 HydrophobicContact CG-CE2 4.36Å; M244-F308 HydrophobicContact CG-CZ 3.88Å; M244-F308 HydrophobicContact SD-CE2 4.24Å; M244-F308 HydrophobicContact SD-CZ 4.35Å; K246-F308 HydrophobicContact CB-CE1 4.16Å; K246-F308 HydrophobicContact CB-CE2 4.14Å; K246-F308 HydrophobicContact CB-CZ 3.81Å; K246-F308 HydrophobicContact CD-CB 4.39Å; K246-F308 HydrophobicContact CD-CD1 3.96Å; K246-F308 HydrophobicContact CD-CD2 3.75Å; K246-F308 HydrophobicContact CD-CE1 4.14Å; K246-F308 HydrophobicContact CD-CE2 3.97Å; K246-F308 HydrophobicContact CD-CG 3.76Å; K246-F308 HydrophobicContact CD-CZ 4.15Å; K246-F308 HydrophobicContact CG-CD1 4.01Å; K246-F308 HydrophobicContact CG-CD2 4.39Å; K246-F308 HydrophobicContact CG-CE1 3.78Å; K246-F308 HydrophobicContact CG-CE2 4.2Å; K246-F308 HydrophobicContact CG-CG 4.32Å; K246-F308 HydrophobicContact CG-CZ 3.89Å; D255-F308 HydrophobicContact CB-CD1 4.16Å; D255-F308 WeakPolarHBondContact O-CE1 3.39Å; R257-F308 HydrophobicContact CG-CD1 4.07Å; R257-F308 WeakPolarHBondContact CG-O 3.38Å; F278-F308 HydrophobicContact CE1-CE2 4.45Å; I303-F308 HydrophobicContact CG2-CD2 4.03Å; D304-F308 VanDerWaalsContact O-CA 3.24Å; D304-F308 WeakPolarHBondContact O-CA 3.31Å; D304-F308 PolarHBondContact O-N 2.97Å; K306-F308 VanDerWaalsContact C-N 3.34Å
309	G	97.2	Very high	97.5	Very high	18 Å²	18	48.6 Å²	48.6	19%	0.186	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	170.1	-179.9	0	0	0	0	0	112.6	I303 D304 S307	I303-G309 CarbonylContact C-O 3.59Å; I303-G309 WeakPolarHBondContact CA-O 3.47Å; D304-G309 PolarHBondContact N-O 2.96Å; S307-G309 PolarHBondContact O-N 3.45Å; S307-G309 PolarHBondContact OG-N 3.02Å
310	I	97.9	Very high	97.5	Very high	63 Å²	63	48.6 Å²	48.6	32%	0.323	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	123.6	171.8	-57.8	-54.4	0	0	0	109.3	M244 I259 I287 A301 I303 T313	M244-I310 HydrophobicContact CE-CD1 4.11Å; M244-I310 HydrophobicContact SD-CD1 4.24Å; I259-I310 HydrophobicContact CD1-CD1 4.13Å; I259-I310 HydrophobicContact CG1-CD1 4.28Å; I259-I310 HydrophobicContact CG1-CG1 4.39Å; I287-I310 HydrophobicContact CG2-CD1 3.88Å; A301-I310 HydrophobicContact CB-CD1 3.96Å; A301-I310 HydrophobicContact CB-CG2 3.91Å; I303-I310 HydrophobicContact CG1-CD1 4.33Å; I310-T313 WeakPolarHBondContact CG2-OG1 3.39Å
311	E	96.8	Very high	97.4	Very high	107 Å²	107	53.8 Å²	53.8	50%	0.5	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-48.8	177.6	-173.6	-173.8	-175.8	0	0	111.4	K302 D304	K302-E311 WeakPolarHBondContact CD-OE2 3.48Å; K302-E311 PolarHBondContact O-N 3.4Å; D304-E311 HydrophobicContact CB-CB 4.42Å
312	N	97.6	Very high	97.3	Very high	79 Å²	79	56.7 Å²	56.7	42%	0.422	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	157.4	-177.8	-66	120.5	0	0	0	110.9	A301 K302 W314	A301-N312 CarbonylContact C-O 3.46Å; A301-N312 WeakPolarHBondContact CA-O 3.44Å; K302-N312 PolarHBondContact N-O 2.69Å; N312-W314 HydrophobicContact CB-CE3 4.37Å; N312-W314 HydrophobicContact CB-CH2 3.22Å; N312-W314 HydrophobicContact CB-CZ2 3.84Å; N312-W314 HydrophobicContact CB-CZ3 3.5Å; N312-W314 WeakPolarHBondContact O-CZ3 3.33Å
313	T	98	Very high	97.3	Very high	56 Å²	56	55 Å²	55	34%	0.344	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142	-176.6	-52.9	0	0	0	0	110.9	V299 I300 I310	V299-T313 HydrophobicContact CG1-CG2 3.24Å; I300-T313 CarbonylContact O-C 3.58Å; I300-T313 WeakPolarHBondContact O-CA 3.39Å; I310-T313 WeakPolarHBondContact CG2-OG1 3.39Å
314	W	98.4	Very high	97.2	Very high	31 Å²	31	54.9 Å²	54.9	12%	0.117	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	132.4	179.1	-61	-103.1	0	0	0	110.3	W286 V299 I300 K302 N312 Y350 T352	W286-W314 HydrophobicContact CE3-CZ3 4.38Å; W286-W314 HydrophobicContact CH2-CH2 4.17Å; W286-W314 HydrophobicContact CH2-CZ3 4.29Å; W286-W314 HydrophobicContact CZ3-CE3 4.17Å; W286-W314 AromaticContact CZ3-CH2 3.82Å; W286-W314 HydrophobicContact CZ3-CH2 3.82Å; W286-W314 AromaticContact CZ3-CZ3 3.49Å; W286-W314 HydrophobicContact CZ3-CZ3 3.49Å; W286-W314 VanDerWaalsContact CZ3-CZ3 3.49Å; V299-W314 WeakPolarHBondContact CA-O 3.25Å; I300-W314 HydrophobicContact CB-CB 4.49Å; I300-W314 PolarHBondContact N-O 2.59Å; I300-W314 PolarHBondContact O-N 2.92Å; K302-W314 HydrophobicContact CB-CH2 4.08Å; K302-W314 HydrophobicContact CB-CZ3 3.87Å; N312-W314 HydrophobicContact CB-CE3 4.37Å; N312-W314 HydrophobicContact CB-CH2 3.22Å; N312-W314 HydrophobicContact CB-CZ2 3.84Å; N312-W314 HydrophobicContact CB-CZ3 3.5Å; N312-W314 WeakPolarHBondContact O-CZ3 3.33Å; W314-Y350 HydrophobicContact CB-CD1 4.47Å; W314-Y350 HydrophobicContact CB-CE1 3.68Å; W314-Y350 AromaticContact CD1-CE1 3.74Å; W314-Y350 AromaticContact CG-CE1 3.96Å; W314-Y350 HydrophobicContact CG-CE1 3.96Å; W314-T352 HydrophobicContact CD2-CG2 3.95Å; W314-T352 HydrophobicContact CE3-CG2 4.21Å; W314-T352 HydrophobicContact CG-CG2 4.23Å; W314-T352 PolarHBondContact NE1-O 2.98Å
315	H	97.8	Very high	97.2	Very high	88 Å²	88	52.1 Å²	52.1	41%	0.407	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	135.7	177.6	-59.4	-92.6	0	0	0	109.7	Y350	H315-Y350 WeakPolarHBondContact O-CE2 3.41Å
316	T	97.8	Very high	97.3	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	166.7	-177.2	76.8	0	0	0	0	112.1	K297 I298 I300 M333 Y350	K297-T316 WeakPolarHBondContact CB-O 3.47Å; K297-T316 WeakPolarHBondContact CD-O 3.04Å; I298-T316 WeakPolarHBondContact CB-OG1 3.35Å; I298-T316 HydrophobicContact CG2-CG2 4.38Å; I298-T316 WeakPolarHBondContact O-CB 3.28Å; I298-T316 WeakPolarHBondContact O-CG2 3.4Å; I298-T316 PolarHBondContact O-N 2.75Å; I298-T316 PolarHBondContact O-OG1 3.47Å; I300-T316 HydrophobicContact CD1-CG2 3.65Å; I300-T316 HydrophobicContact CG1-CG2 4.12Å; T316-M333 HydrophobicContact CG2-CE 3.81Å; T316-Y350 HydrophobicContact CG2-CD2 3.85Å; T316-Y350 HydrophobicContact CG2-CE2 4.41Å; T316-Y350 HydrophobicContact CG2-CG 3.92Å
317	G	96.9	Very high	97.5	Very high	28 Å²	28	40.1 Å²	40.1	29%	0.289	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-10.9	175.9	0	0	0	0	0	116.7	Y348 E357	G317-Y348 PolarHBondContact N-OH 3.13Å; G317-E357 PolarHBondContact N-OE1 3.41Å
318	V	97.7	Very high	97.6	Very high	13 Å²	13	37.2 Å²	37.2	8%	0.079	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.8	-167.8	169.5	0	0	0	0	112.9	K297 I298 F347 Y348	K297-V318 CarbonylContact C-O 3.42Å; K297-V318 WeakPolarHBondContact CA-O 3.33Å; K297-V318 WeakPolarHBondContact CB-O 3.24Å; I298-V318 HydrophobicContact CD1-CG1 4.04Å; I298-V318 PolarHBondContact N-O 2.97Å; V318-F347 HydrophobicContact CG1-CE2 4.13Å; V318-F347 HydrophobicContact CG1-CZ 3.63Å; V318-F347 HydrophobicContact CG2-CE2 3.97Å; V318-F347 HydrophobicContact CG2-CZ 4.23Å; V318-Y348 HydrophobicContact CB-CD1 4.35Å; V318-Y348 HydrophobicContact CB-CE1 4.44Å; V318-Y348 HydrophobicContact CG2-CD1 3.58Å; V318-Y348 HydrophobicContact CG2-CD2 3.4Å; V318-Y348 HydrophobicContact CG2-CE1 3.85Å; V318-Y348 HydrophobicContact CG2-CE2 3.66Å; V318-Y348 HydrophobicContact CG2-CG 3.33Å
319	Y	98.2	Very high	97.7	Very high	120 Å²	120	37.2 Å²	37.2	47%	0.471	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.1	172.7	-68.8	-81.1	0	0	0	111.3	K295 K297 Q321 S322 A323	K295-Y319 VanDerWaalsContact O-CE1 3.24Å; K295-Y319 WeakPolarHBondContact O-CE1 3.24Å; K297-Y319 HydrophobicContact CG-CD1 3.96Å; K297-Y319 HydrophobicContact CG-CE1 4.01Å; K297-Y319 HydrophobicContact CG-CG 4.31Å; Y319-Q321 VanDerWaalsContact C-N 3.26Å; Y319-Q321 PolarHBondContact O-N 3.28Å; Y319-S322 WeakPolarHBondContact O-CB 3.42Å; Y319-S322 PolarHBondContact O-N 2.98Å; Y319-S322 PolarHBondContact O-OG 3.15Å; Y319-A323 PolarHBondContact O-N 2.97Å
320	K	98.3	Very high	97.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-59	-39.4	-178.1	-166.5	176.7	-163.9	-62.8	0	112.1	S267 Y268 Q274 N275 A290 G296 I298 S322 A323	S267-K320 CarbonylContact O-C 3.45Å; Y268-K320 HydrophobicContact CD1-CG 3.75Å; Y268-K320 WeakPolarHBondContact CD1-O 3.42Å; Y268-K320 HydrophobicContact CE1-CD 4.43Å; Y268-K320 HydrophobicContact CE1-CG 3.64Å; Y268-K320 HydrophobicContact CG-CG 4.49Å; Y268-K320 VanDerWaalsContact CZ-NZ 3.26Å; Q274-K320 PolarHBondContact O-NZ 2.97Å; N275-K320 VanDerWaalsContact O-CE 3.31Å; N275-K320 WeakPolarHBondContact O-CE 3.16Å; A290-K320 HydrophobicContact CB-CB 3.99Å; A290-K320 HydrophobicContact CB-CD 3.93Å; G296-K320 PolarHBondContact O-N 3.1Å; I298-K320 HydrophobicContact CG1-CB 3.76Å; I298-K320 HydrophobicContact CG1-CG 4Å; K320-S322 PolarHBondContact O-N 2.9Å; K320-A323 PolarHBondContact O-N 3.32Å; K320-A323 VanDerWaalsContact O-N 3.12Å
321	Q	97.2	Very high	97.7	Very high	109 Å²	109	34.7 Å²	34.7	51%	0.509	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-66	-17.6	177.3	-67.9	173.9	-42.1	0	0	114.2	F266 S267 Y319	F266-Q321 HydrophobicContact CD1-CG 4.46Å; S267-Q321 WeakPolarHBondContact O-CA 3.45Å; S267-Q321 WeakPolarHBondContact O-CG 3.02Å; S267-Q321 PolarHBondContact O-N 2.93Å; Y319-Q321 VanDerWaalsContact C-N 3.26Å; Y319-Q321 PolarHBondContact O-N 3.28Å
322	S	96.3	Very high	97.8	Very high	62 Å²	62	30.2 Å²	30.2	43%	0.434	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-90	-14.4	175.8	72.4	0	0	0	0	113.4	Y319 K320	Y319-S322 WeakPolarHBondContact O-CB 3.42Å; Y319-S322 PolarHBondContact O-N 2.98Å; Y319-S322 PolarHBondContact O-OG 3.15Å; K320-S322 PolarHBondContact O-N 2.9Å
323	A	97.9	Very high	97.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.			trans	-91.7	139.4	178.1	0	0	0	0	0	110.3	Y268 A269 I298 Y319 K320 A335 T336 F347	Y268-A323 HydrophobicContact CD1-CB 4.05Å; Y268-A323 WeakPolarHBondContact CD1-O 3.32Å; Y268-A323 HydrophobicContact CE1-CB 4.16Å; A269-A323 WeakPolarHBondContact CB-O 3.42Å; A269-A323 PolarHBondContact N-O 2.85Å; I298-A323 HydrophobicContact CD1-CB 4.24Å; Y319-A323 PolarHBondContact O-N 2.97Å; K320-A323 PolarHBondContact O-N 3.32Å; K320-A323 VanDerWaalsContact O-N 3.12Å; A323-A335 HydrophobicContact CB-CB 4.36Å; A323-T336 CarbonylContact C-O 3.55Å; A323-T336 VanDerWaalsContact CA-O 3.23Å; A323-T336 WeakPolarHBondContact CA-O 3.22Å; A323-F347 HydrophobicContact CB-CE1 4.41Å
324	G	96.2	Very high	97.9	Very high	1 Å²	1	24 Å²	24	1%	0.01	13%	0.127	C	C	.	.	S	Bend	trans	-67.4	-40.7	169.1	0	0	0	0	0	111.6	Y268 T336	Y268-G324 WeakPolarHBondContact CB-O 3.19Å; G324-T336 PolarHBondContact N-O 2.98Å
325	N	97.6	Very high	97.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	-178.3	173.5	-140.1	-77.3	0	0	0	110.5	N226 T336 Y371 L374	N226-N325 PolarHBondContact ND2-ND2 3.07Å; N226-N325 PolarHBondContact ND2-OD1 2.91Å; N325-T336 PolarHBondContact N-OG1 3.07Å; N325-T336 PolarHBondContact O-N 2.77Å; N325-T336 PolarHBondContact O-OG1 3.12Å; N325-Y371 HydrophobicContact CB-CE2 3.83Å; N325-L374 HydrophobicContact CB-CB 4.03Å; N325-L374 HydrophobicContact CB-CD2 4.18Å; N325-L374 PolarHBondContact OD1-O 2.78Å
326	A	98.3	Very high	97.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	153.9	166.8	0	0	0	0	0	111.1	Y268 I288 M333 Y334 A335	Y268-A326 HydrophobicContact CE1-CB 4.42Å; Y268-A326 WeakPolarHBondContact OH-CB 3.27Å; Y268-A326 PolarHBondContact OH-N 3.47Å; I288-A326 HydrophobicContact CD1-CB 3.95Å; I288-A326 HydrophobicContact CG2-CB 4.44Å; A326-M333 HydrophobicContact CB-CG 4.23Å; A326-M333 HydrophobicContact CB-SD 3.84Å; A326-Y334 CarbonylContact C-O 3.52Å; A326-Y334 WeakPolarHBondContact CA-O 3.14Å; A326-A335 HydrophobicContact CB-CB 4.36Å
327	F	98.6	Very high	97.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164.1	176.8	57	-91	0	0	0	110.9	I144 F147 V329 M333 Y334 T336 I346 L374 L383	I144-F327 HydrophobicContact CD1-CE2 3.78Å; I144-F327 HydrophobicContact CD1-CZ 4.14Å; F147-F327 HydrophobicContact CZ-CZ 4.15Å; F327-V329 HydrophobicContact CD2-CG2 3.92Å; F327-V329 HydrophobicContact CE2-CG2 3.93Å; F327-M333 CarbonylContact O-C 3.59Å; F327-M333 WeakPolarHBondContact O-CA 3.26Å; F327-Y334 HydrophobicContact CE2-CD2 4.1Å; F327-Y334 HydrophobicContact CE2-CG 4.26Å; F327-Y334 PolarHBondContact N-O 3.49Å; F327-Y334 PolarHBondContact O-N 3.41Å; F327-T336 HydrophobicContact CE1-CG2 3.96Å; F327-I346 HydrophobicContact CZ-CD1 3.89Å; F327-I346 HydrophobicContact CZ-CG1 4.39Å; F327-L374 HydrophobicContact CD1-CD2 4.45Å; F327-L374 HydrophobicContact CE1-CD2 4.42Å; F327-L383 HydrophobicContact CD1-CD1 3.81Å; F327-L383 HydrophobicContact CD2-CD1 4.15Å; F327-L383 HydrophobicContact CE1-CD1 3.9Å; F327-L383 HydrophobicContact CE1-CD2 4.22Å; F327-L383 HydrophobicContact CE2-CD1 4.23Å; F327-L383 HydrophobicContact CG-CD1 3.94Å; F327-L383 HydrophobicContact CZ-CD1 4.11Å; F327-L383 HydrophobicContact CZ-CD2 4.39Å
328	M	98.6	Very high	97.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	138.7	-178.9	-62.4	-62.6	-64.3	0	0	110.8	A279 D281 W286 I288 I300 V332 M333 T352 Y376	A279-M328 HydrophobicContact CB-CB 4.19Å; A279-M328 HydrophobicContact CB-CG 3.81Å; D281-M328 HydrophobicContact CB-CB 3.98Å; W286-M328 HydrophobicContact CB-CG 3.9Å; W286-M328 HydrophobicContact CD2-CE 3.75Å; W286-M328 HydrophobicContact CD2-CG 4.26Å; W286-M328 HydrophobicContact CE3-CE 3.92Å; W286-M328 HydrophobicContact CG-CB 4.4Å; W286-M328 HydrophobicContact CG-CE 4.25Å; W286-M328 HydrophobicContact CG-CG 3.74Å; W286-M328 HydrophobicContact CH2-CE 4.08Å; W286-M328 HydrophobicContact CZ2-CE 3.91Å; W286-M328 HydrophobicContact CZ3-CE 4.07Å; I288-M328 HydrophobicContact CD1-CG 4.36Å; I288-M328 HydrophobicContact CD1-SD 4.43Å; I300-M328 HydrophobicContact CG2-CE 4.09Å; I300-M328 HydrophobicContact CG2-SD 3.9Å; M328-V332 WeakPolarHBondContact CA-O 3.36Å; M328-M333 HydrophobicContact CE-CB 4.41Å; M328-M333 VanDerWaalsContact SD-CA 3.57Å; M328-M333 HydrophobicContact SD-CB 3.49Å; M328-M333 WeakPolarHBondContact SD-CB 3.49Å; M328-M333 HydrophobicContact SD-CG 3.98Å; M328-T352 HydrophobicContact CE-CG2 4.2Å; M328-Y376 WeakPolarHBondContact O-CD1 3.44Å
329	V	98.1	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	126.8	165.1	-171.9	0	0	0	0	109.1	I144 F327 G331 V332 Y334 Y376 F398	I144-V329 HydrophobicContact CD1-CG2 4.21Å; F327-V329 HydrophobicContact CD2-CG2 3.92Å; F327-V329 HydrophobicContact CE2-CG2 3.93Å; V329-G331 PolarHBondContact O-N 3.04Å; V329-G331 VanDerWaalsContact O-N 3.13Å; V329-V332 PolarHBondContact N-O 2.91Å; V329-V332 WeakPolarHBondContact O-CB 3.36Å; V329-V332 PolarHBondContact O-N 2.79Å; V329-Y334 HydrophobicContact CB-CD2 4.39Å; V329-Y334 HydrophobicContact CB-CE2 3.95Å; V329-Y334 HydrophobicContact CG2-CD2 4.23Å; V329-Y334 HydrophobicContact CG2-CE2 4.21Å; V329-Y376 HydrophobicContact CB-CD1 4.49Å; V329-Y376 HydrophobicContact CB-CE1 4.27Å; V329-Y376 HydrophobicContact CG1-CE1 3.91Å; V329-Y376 HydrophobicContact CG1-CE2 4.35Å; V329-Y376 HydrophobicContact CG2-CD1 3.84Å; V329-Y376 HydrophobicContact CG2-CD2 3.86Å; V329-Y376 HydrophobicContact CG2-CE1 3.97Å; V329-Y376 HydrophobicContact CG2-CE2 4.01Å; V329-Y376 HydrophobicContact CG2-CG 3.76Å; V329-F398 HydrophobicContact CG1-CE1 3.62Å; V329-F398 HydrophobicContact CG1-CZ 3.73Å
330	C	97.1	Very high	97.4	Very high	22 Å²	22	25.6 Å²	25.6	15%	0.149	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	38.3	177	-69.6	0	0	0	0	115.5	C139 H141 D281 E282 V332	C139-C330 WeakPolarHBondContact CA-SG 3.44Å; C139-C330 HydrophobicContact CB-CB 3.59Å; C139-C330 WeakPolarHBondContact CB-SG 3.2Å; C139-C330 VanDerWaalsContact SG-CA 3.56Å; C139-C330 WeakPolarHBondContact SG-CB 3.37Å; C139-C330 CovalentContact SG-SG 2.04Å; C139-C330 PolarHBondContact SG-SG 3.15Å; H141-C330 PolarHBondContact NE2-SG 3.04Å; D281-C330 PolarHBondContact OD2-N 2.85Å; E282-C330 PolarHBondContact OE2-N 3.36Å; E282-C330 PolarHBondContact OE2-SG 2.99Å; E282-C330 VanDerWaalsContact OE2-SG 3.37Å; C330-V332 VanDerWaalsContact C-N 3.31Å; C330-V332 PolarHBondContact O-N 3.07Å
331	G	97.9	Very high	96.8	Very high	6 Å²	6	30.5 Å²	30.5	6%	0.062	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	9.7	-178.8	0	0	0	0	0	114.4	D281 V329 T352	D281-G331 WeakPolarHBondContact OD2-CA 3.47Å; D281-G331 PolarHBondContact OD2-N 2.79Å; V329-G331 PolarHBondContact O-N 3.04Å; V329-G331 VanDerWaalsContact O-N 3.13Å; G331-T352 WeakPolarHBondContact O-CB 3.46Å; G331-T352 WeakPolarHBondContact O-CG2 3.22Å; G331-T352 PolarHBondContact O-N 3.32Å; G331-T352 PolarHBondContact O-OG1 3.5Å
332	V	98.6	Very high	96.3	Very high	13 Å²	13	29.6 Å²	29.6	8%	0.079	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.5	176.4	-177.2	0	0	0	0	109.1	M328 V329 C330 Y334 A349 Y350 D351	M328-V332 WeakPolarHBondContact CA-O 3.36Å; V329-V332 PolarHBondContact N-O 2.91Å; V329-V332 WeakPolarHBondContact O-CB 3.36Å; V329-V332 PolarHBondContact O-N 2.79Å; C330-V332 VanDerWaalsContact C-N 3.31Å; C330-V332 PolarHBondContact O-N 3.07Å; V332-Y334 HydrophobicContact CB-CE2 3.78Å; V332-Y334 HydrophobicContact CG1-CD2 4.29Å; V332-Y334 HydrophobicContact CG1-CE1 4.13Å; V332-Y334 HydrophobicContact CG1-CE2 3.67Å; V332-Y334 WeakPolarHBondContact O-CD2 3.14Å; V332-Y334 WeakPolarHBondContact O-CE2 3.41Å; V332-A349 HydrophobicContact CG1-CB 3.99Å; V332-Y350 CarbonylContact C-O 3.58Å; V332-Y350 WeakPolarHBondContact CA-O 3.49Å; V332-D351 HydrophobicContact CG2-CB 4.06Å
333	M	98.7	Very high	96.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	136.5	171	-175	-87	-74	0	0	109.5	I288 I298 I300 T316 A326 F327 M328 A335 Y348 A349 Y350	I288-M333 HydrophobicContact CD1-CG 4.21Å; I298-M333 HydrophobicContact CG2-CE 3.98Å; I300-M333 HydrophobicContact CD1-CB 3.39Å; I300-M333 HydrophobicContact CD1-CE 4Å; I300-M333 HydrophobicContact CD1-CG 3.89Å; I300-M333 HydrophobicContact CG1-CB 4.04Å; I300-M333 HydrophobicContact CG1-CE 4.4Å; I300-M333 HydrophobicContact CG1-CG 4.07Å; T316-M333 HydrophobicContact CG2-CE 3.81Å; A326-M333 HydrophobicContact CB-CG 4.23Å; A326-M333 HydrophobicContact CB-SD 3.84Å; F327-M333 CarbonylContact O-C 3.59Å; F327-M333 WeakPolarHBondContact O-CA 3.26Å; M328-M333 HydrophobicContact CE-CB 4.41Å; M328-M333 VanDerWaalsContact SD-CA 3.57Å; M328-M333 HydrophobicContact SD-CB 3.49Å; M328-M333 WeakPolarHBondContact SD-CB 3.49Å; M328-M333 HydrophobicContact SD-CG 3.98Å; M333-A335 HydrophobicContact SD-CB 3.9Å; M333-Y348 HydrophobicContact CE-CD1 3.98Å; M333-Y348 HydrophobicContact CE-CE1 3.72Å; M333-A349 CarbonylContact O-C 3.53Å; M333-A349 WeakPolarHBondContact O-CA 3.42Å; M333-Y350 PolarHBondContact N-O 3.46Å; M333-Y350 PolarHBondContact O-N 3.23Å
334	Y	98.8	Very high	96.1	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.016	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.8	172.8	-64.4	-86.2	0	0	0	109.2	G143 I144 A326 F327 V329 V332 I346 Y348 A349 L360	G143-Y334 WeakPolarHBondContact CA-OH 3.35Å; I144-Y334 HydrophobicContact CD1-CD1 4.14Å; I144-Y334 HydrophobicContact CD1-CD2 3.82Å; I144-Y334 HydrophobicContact CD1-CE1 4.1Å; I144-Y334 HydrophobicContact CD1-CE2 3.83Å; I144-Y334 HydrophobicContact CD1-CG 3.97Å; I144-Y334 HydrophobicContact CG1-CE1 4.31Å; I144-Y334 HydrophobicContact CG1-CE2 4.23Å; A326-Y334 CarbonylContact C-O 3.52Å; A326-Y334 WeakPolarHBondContact CA-O 3.14Å; F327-Y334 HydrophobicContact CE2-CD2 4.1Å; F327-Y334 HydrophobicContact CE2-CG 4.26Å; F327-Y334 PolarHBondContact N-O 3.49Å; F327-Y334 PolarHBondContact O-N 3.41Å; V329-Y334 HydrophobicContact CB-CD2 4.39Å; V329-Y334 HydrophobicContact CB-CE2 3.95Å; V329-Y334 HydrophobicContact CG2-CD2 4.23Å; V329-Y334 HydrophobicContact CG2-CE2 4.21Å; V332-Y334 HydrophobicContact CB-CE2 3.78Å; V332-Y334 HydrophobicContact CG1-CD2 4.29Å; V332-Y334 HydrophobicContact CG1-CE1 4.13Å; V332-Y334 HydrophobicContact CG1-CE2 3.67Å; V332-Y334 WeakPolarHBondContact O-CD2 3.14Å; V332-Y334 WeakPolarHBondContact O-CE2 3.41Å; Y334-I346 HydrophobicContact CD1-CD1 4.22Å; Y334-I346 HydrophobicContact CD1-CG2 3.72Å; Y334-I346 HydrophobicContact CG-CD1 4.41Å; Y334-I346 HydrophobicContact CG-CG2 4.32Å; Y334-Y348 WeakPolarHBondContact CA-O 3.09Å; Y334-A349 HydrophobicContact CD1-CB 3.7Å; Y334-A349 HydrophobicContact CE1-CB 3.81Å; Y334-L360 HydrophobicContact CD1-CD1 4.02Å; Y334-L360 HydrophobicContact CE1-CD1 3.99Å
335	A	98.6	Very high	96.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139	177	0	0	0	0	0	110.7	I298 A323 A326 M333 I346 F347 Y348	I298-A335 HydrophobicContact CD1-CB 4.48Å; A323-A335 HydrophobicContact CB-CB 4.36Å; A326-A335 HydrophobicContact CB-CB 4.36Å; M333-A335 HydrophobicContact SD-CB 3.9Å; A335-I346 WeakPolarHBondContact O-CA 3.47Å; A335-F347 HydrophobicContact CB-CE1 3.94Å; A335-F347 HydrophobicContact CB-CZ 4.3Å; A335-F347 VanDerWaalsContact O-CD1 3.29Å; A335-F347 WeakPolarHBondContact O-CD1 3.24Å; A335-F347 PolarHBondContact O-N 3.25Å; A335-Y348 HydrophobicContact CB-CD1 4.31Å; A335-Y348 PolarHBondContact N-O 3.25Å
336	T	98.2	Very high	96.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	154	-177.6	59.5	0	0	0	0	112.1	A323 G324 N325 F327 E344 E345 I346 F347 F364 Y371 L374	A323-T336 CarbonylContact C-O 3.55Å; A323-T336 VanDerWaalsContact CA-O 3.23Å; A323-T336 WeakPolarHBondContact CA-O 3.22Å; G324-T336 PolarHBondContact N-O 2.98Å; N325-T336 PolarHBondContact N-OG1 3.07Å; N325-T336 PolarHBondContact O-N 2.77Å; N325-T336 PolarHBondContact O-OG1 3.12Å; F327-T336 HydrophobicContact CE1-CG2 3.96Å; T336-E344 HydrophobicContact CG2-CG 4.45Å; T336-E345 CarbonylContact C-O 3.54Å; T336-E345 WeakPolarHBondContact CA-O 3.36Å; T336-I346 HydrophobicContact CG2-CG1 4.32Å; T336-F347 VanDerWaalsContact O-CE1 3.32Å; T336-F347 WeakPolarHBondContact O-CE1 3.49Å; T336-F364 HydrophobicContact CG2-CE1 4.13Å; T336-F364 HydrophobicContact CG2-CZ 4.2Å; T336-Y371 PolarHBondContact OG1-OH 3.19Å; T336-L374 HydrophobicContact CG2-CD2 3.94Å
337	R	97.3	Very high	96.2	Very high	111 Å²	111	29.1 Å²	29.1	42%	0.419	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	158	166.1	71.2	-177.2	-179.2	-171.9	-2.5	111.3	E344 E345 F347	R337-E344 WeakPolarHBondContact CA-OE1 3.4Å; R337-E344 PolarHBondContact N-OE1 3.4Å; R337-E344 VanDerWaalsContact N-OE1 3.09Å; R337-E344 VanDerWaalsContact O-CD 3.31Å; R337-E345 HydrophobicContact CG-CG 3.9Å; R337-E345 IonicContact CZ-OE1 3.15Å; R337-E345 PolarHBondContact N-O 2.98Å; R337-E345 IonicContact NE-OE1 2.71Å; R337-E345 PolarHBondContact NE-OE1 3.3Å; R337-E345 IonicContact NH2-OE1 2.74Å; R337-E345 PolarHBondContact NH2-OE1 3.09Å; R337-E345 PolarHBondContact O-N 3.05Å; R337-F347 HydrophobicContact CB-CD1 3.67Å; R337-F347 HydrophobicContact CB-CE1 3.79Å; R337-F347 HydrophobicContact CB-CG 4.45Å; R337-F347 HydrophobicContact CG-CB 4Å; R337-F347 HydrophobicContact CG-CD1 3.48Å; R337-F347 VanDerWaalsContact CG-CD1 3.48Å; R337-F347 HydrophobicContact CG-CE1 4.09Å; R337-F347 HydrophobicContact CG-CG 3.83Å
338	T	96.4	Very high	96.2	Very high	73 Å²	73	29.3 Å²	29.3	45%	0.448	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	134.5	175.1	-159.7	0	0	0	0	110.8	Y270 D340 E344 K366	Y270-T338 VanDerWaalsContact OH-CB 3.25Å; Y270-T338 WeakPolarHBondContact OH-CB 3.31Å; Y270-T338 PolarHBondContact OH-OG1 3.49Å; T338-D340 PolarHBondContact OG1-O 2.91Å; T338-E344 PolarHBondContact N-OE1 3Å; T338-K366 PolarHBondContact OG1-NZ 3.3Å
339	V	96.1	Very high	96.2	Very high	65 Å²	65	29.3 Å²	29.3	39%	0.394	16%	0.155	S	C	.	.	S	Bend	trans	-97	-46.3	166.6	177.8	0	0	0	0	109.1	T343 E345 Q363	V339-T343 HydrophobicContact CB-CG2 4.14Å; V339-T343 HydrophobicContact CG2-CG2 4.38Å; V339-T343 PolarHBondContact N-O 3.46Å; V339-E345 HydrophobicContact CG2-CB 3.71Å; V339-E345 VanDerWaalsContact CG2-CD 3.49Å; V339-E345 HydrophobicContact CG2-CG 3.56Å; V339-Q363 HydrophobicContact CG2-CG 4.45Å
340	D	91.7	Very high	96.3	Very high	71 Å²	71	30.1 Å²	30.1	38%	0.38	16%	0.158	S	C	.	.	S	Bend	trans	-152.2	-173.3	175.8	65.3	56.7	0	0	0	110.6	T338 N342 T343 K366	T338-D340 PolarHBondContact OG1-O 2.91Å; D340-N342 PolarHBondContact O-N 3.27Å; D340-N342 WeakPolarHBondContact OD1-CA 3.31Å; D340-N342 PolarHBondContact OD1-N 3.4Å; D340-T343 PolarHBondContact N-O 2.94Å; D340-T343 PolarHBondContact O-N 2.98Å; D340-T343 WeakPolarHBondContact OD1-CB 3.28Å; D340-T343 PolarHBondContact OD1-N 3.47Å; D340-T343 PolarHBondContact OD1-OG1 3.46Å; D340-T343 VanDerWaalsContact OD1-OG1 3.12Å; D340-T343 WeakPolarHBondContact OD2-CB 3.37Å; D340-T343 PolarHBondContact OD2-OG1 2.99Å; D340-K366 WeakPolarHBondContact O-CE 3.49Å; D340-K366 PolarHBondContact O-NZ 2.89Å
341	I	85.5	Confident	96.3	Very high	103 Å²	103	30.5 Å²	30.5	53%	0.528	16%	0.158	S	C	.	.	S	Bend	trans	-59.3	-27.7	-178.7	59.7	167.1	0	0	0	113.7	K366 E369	I341-K366 WeakPolarHBondContact O-CE 3.04Å; I341-E369 WeakPolarHBondContact O-CA 3.08Å
342	N	85.3	Confident	96.3	Very high	89 Å²	89	30.9 Å²	30.9	48%	0.476	16%	0.159	S	C	.	.	S	Bend	trans	-114.2	-5.1	-174.9	-61.5	-40.5	0	0	0	113.1	D340 K365 K366	D340-N342 PolarHBondContact O-N 3.27Å; D340-N342 WeakPolarHBondContact OD1-CA 3.31Å; D340-N342 PolarHBondContact OD1-N 3.4Å; N342-K365 CarbonylContact O-C 3.46Å; N342-K365 WeakPolarHBondContact O-CA 3.42Å; N342-K366 PolarHBondContact O-N 3.45Å
343	T	93.9	Very high	96.2	Very high	22 Å²	22	39.5 Å²	39.5	14%	0.135	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	127.1	-171.9	-48.4	0	0	0	0	111	V339 D340 Q363	V339-T343 HydrophobicContact CB-CG2 4.14Å; V339-T343 HydrophobicContact CG2-CG2 4.38Å; V339-T343 PolarHBondContact N-O 3.46Å; D340-T343 PolarHBondContact N-O 2.94Å; D340-T343 PolarHBondContact O-N 2.98Å; D340-T343 WeakPolarHBondContact OD1-CB 3.28Å; D340-T343 PolarHBondContact OD1-N 3.47Å; D340-T343 PolarHBondContact OD1-OG1 3.46Å; D340-T343 VanDerWaalsContact OD1-OG1 3.12Å; D340-T343 WeakPolarHBondContact OD2-CB 3.37Å; D340-T343 PolarHBondContact OD2-OG1 2.99Å; T343-Q363 HydrophobicContact CG2-CB 3.98Å; T343-Q363 HydrophobicContact CG2-CG 4.11Å
344	E	96.8	Very high	96.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	152	168.4	-165.7	80.1	-157.4	0	0	108	Y270 T336 R337 T338 Q363 F364 K366 Y371	Y270-E344 PolarHBondContact OH-OE2 3.44Å; T336-E344 HydrophobicContact CG2-CG 4.45Å; R337-E344 WeakPolarHBondContact CA-OE1 3.4Å; R337-E344 PolarHBondContact N-OE1 3.4Å; R337-E344 VanDerWaalsContact N-OE1 3.09Å; R337-E344 VanDerWaalsContact O-CD 3.31Å; T338-E344 PolarHBondContact N-OE1 3Å; E344-Q363 CarbonylContact O-C 3.44Å; E344-Q363 WeakPolarHBondContact O-CA 3.16Å; E344-F364 HydrophobicContact CB-CD1 4.37Å; E344-F364 HydrophobicContact CB-CD2 4.37Å; E344-F364 HydrophobicContact CB-CE1 3.85Å; E344-F364 HydrophobicContact CB-CE2 3.85Å; E344-F364 HydrophobicContact CB-CZ 3.57Å; E344-F364 HydrophobicContact CG-CE1 3.87Å; E344-F364 HydrophobicContact CG-CE2 4.23Å; E344-F364 HydrophobicContact CG-CZ 3.53Å; E344-F364 PolarHBondContact N-O 3.22Å; E344-F364 PolarHBondContact O-N 2.99Å; E344-F364 VanDerWaalsContact O-O 3.07Å; E344-K366 HydrophobicContact CB-CD 4.04Å; E344-K366 HydrophobicContact CB-CG 3.77Å; E344-K366 WeakPolarHBondContact OE2-CD 3.25Å; E344-K366 IonicContact OE2-NZ 3.5Å; E344-Y371 HydrophobicContact CG-CE1 4.29Å; E344-Y371 PolarHBondContact OE1-OH 3.36Å; E344-Y371 WeakPolarHBondContact OE2-CE1 3.36Å
345	E	97.9	Very high	96.1	Very high	13 Å²	13	49.4 Å²	49.4	6%	0.061	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	148.7	172.2	71.6	-179.6	171.9	0	0	112.1	T336 R337 V339 F347 S361 I362 Q363	T336-E345 CarbonylContact C-O 3.54Å; T336-E345 WeakPolarHBondContact CA-O 3.36Å; R337-E345 HydrophobicContact CG-CG 3.9Å; R337-E345 IonicContact CZ-OE1 3.15Å; R337-E345 PolarHBondContact N-O 2.98Å; R337-E345 IonicContact NE-OE1 2.71Å; R337-E345 PolarHBondContact NE-OE1 3.3Å; R337-E345 IonicContact NH2-OE1 2.74Å; R337-E345 PolarHBondContact NH2-OE1 3.09Å; R337-E345 PolarHBondContact O-N 3.05Å; V339-E345 HydrophobicContact CG2-CB 3.71Å; V339-E345 VanDerWaalsContact CG2-CD 3.49Å; V339-E345 HydrophobicContact CG2-CG 3.56Å; E345-F347 HydrophobicContact CG-CB 4.07Å; E345-F347 PolarHBondContact O-N 2.64Å; E345-S361 PolarHBondContact OE2-OG 3.43Å; E345-I362 CarbonylContact C-O 3.56Å; E345-I362 VanDerWaalsContact CA-O 3.28Å; E345-I362 WeakPolarHBondContact CA-O 3.38Å; E345-Q363 HydrophobicContact CB-CG 3.84Å
346	I	98.4	Very high	96	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	109.4	156	-58.5	177	0	0	0	107	I144 F147 F327 Y334 A335 T336 L360 S361 I362	I144-I346 HydrophobicContact CD1-CD1 3.81Å; I144-I346 HydrophobicContact CG2-CD1 4.35Å; F147-I346 HydrophobicContact CE2-CD1 3.56Å; F147-I346 HydrophobicContact CE2-CG1 4.19Å; F147-I346 HydrophobicContact CZ-CD1 3.69Å; F327-I346 HydrophobicContact CZ-CD1 3.89Å; F327-I346 HydrophobicContact CZ-CG1 4.39Å; Y334-I346 HydrophobicContact CD1-CD1 4.22Å; Y334-I346 HydrophobicContact CD1-CG2 3.72Å; Y334-I346 HydrophobicContact CG-CD1 4.41Å; Y334-I346 HydrophobicContact CG-CG2 4.32Å; A335-I346 WeakPolarHBondContact O-CA 3.47Å; T336-I346 HydrophobicContact CG2-CG1 4.32Å; I346-L360 HydrophobicContact CG2-CB 4.32Å; I346-L360 HydrophobicContact CG2-CD1 3.81Å; I346-L360 CarbonylContact O-C 3.39Å; I346-L360 VanDerWaalsContact O-C 3.3Å; I346-L360 WeakPolarHBondContact O-CB 3.45Å; I346-S361 PolarHBondContact O-N 3.5Å; I346-I362 HydrophobicContact CB-CB 4.17Å; I346-I362 HydrophobicContact CD1-CD1 4.46Å; I346-I362 PolarHBondContact N-O 2.99Å; I346-I362 PolarHBondContact O-N 2.9Å; I346-I362 VanDerWaalsContact O-N 3.12Å
347	F	98.5	Very high	96	Very high	20 Å²	20	59.9 Å²	59.9	9%	0.088	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-14.9	-179.5	75.4	-80.3	0	0	0	113.1	V318 A323 A335 T336 R337 E345 N359 L360	V318-F347 HydrophobicContact CG1-CE2 4.13Å; V318-F347 HydrophobicContact CG1-CZ 3.63Å; V318-F347 HydrophobicContact CG2-CE2 3.97Å; V318-F347 HydrophobicContact CG2-CZ 4.23Å; A323-F347 HydrophobicContact CB-CE1 4.41Å; A335-F347 HydrophobicContact CB-CE1 3.94Å; A335-F347 HydrophobicContact CB-CZ 4.3Å; A335-F347 VanDerWaalsContact O-CD1 3.29Å; A335-F347 WeakPolarHBondContact O-CD1 3.24Å; A335-F347 PolarHBondContact O-N 3.25Å; T336-F347 VanDerWaalsContact O-CE1 3.32Å; T336-F347 WeakPolarHBondContact O-CE1 3.49Å; R337-F347 HydrophobicContact CB-CD1 3.67Å; R337-F347 HydrophobicContact CB-CE1 3.79Å; R337-F347 HydrophobicContact CB-CG 4.45Å; R337-F347 HydrophobicContact CG-CB 4Å; R337-F347 HydrophobicContact CG-CD1 3.48Å; R337-F347 VanDerWaalsContact CG-CD1 3.48Å; R337-F347 HydrophobicContact CG-CE1 4.09Å; R337-F347 HydrophobicContact CG-CG 3.83Å; E345-F347 HydrophobicContact CG-CB 4.07Å; E345-F347 PolarHBondContact O-N 2.64Å; F347-N359 WeakPolarHBondContact O-CA 3.37Å; F347-L360 WeakPolarHBondContact CA-O 3.18Å; F347-L360 PolarHBondContact O-N 3.4Å
348	Y	98.6	Very high	96	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	143.3	-172.7	178.9	-92.3	0	0	0	111.6	G317 V318 M333 Y334 A335 E357 R358	G317-Y348 PolarHBondContact N-OH 3.13Å; V318-Y348 HydrophobicContact CB-CD1 4.35Å; V318-Y348 HydrophobicContact CB-CE1 4.44Å; V318-Y348 HydrophobicContact CG2-CD1 3.58Å; V318-Y348 HydrophobicContact CG2-CD2 3.4Å; V318-Y348 HydrophobicContact CG2-CE1 3.85Å; V318-Y348 HydrophobicContact CG2-CE2 3.66Å; V318-Y348 HydrophobicContact CG2-CG 3.33Å; M333-Y348 HydrophobicContact CE-CD1 3.98Å; M333-Y348 HydrophobicContact CE-CE1 3.72Å; Y334-Y348 WeakPolarHBondContact CA-O 3.09Å; A335-Y348 HydrophobicContact CB-CD1 4.31Å; A335-Y348 PolarHBondContact N-O 3.25Å; Y348-E357 HydrophobicContact CE2-CB 3.83Å; Y348-E357 HydrophobicContact CE2-CG 4.43Å; Y348-E357 VanDerWaalsContact OH-CG 3.28Å; Y348-E357 WeakPolarHBondContact OH-CG 3.4Å; Y348-E357 PolarHBondContact OH-OE1 3.28Å; Y348-E357 PolarHBondContact OH-OE2 3.09Å; Y348-R358 CarbonylContact C-O 3.3Å; Y348-R358 WeakPolarHBondContact CA-O 3.32Å
349	A	98.5	Very high	96	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147	169.5	0	0	0	0	0	112.3	V332 M333 Y334 E357 R358 L360	V332-A349 HydrophobicContact CG1-CB 3.99Å; M333-A349 CarbonylContact O-C 3.53Å; M333-A349 WeakPolarHBondContact O-CA 3.42Å; Y334-A349 HydrophobicContact CD1-CB 3.7Å; Y334-A349 HydrophobicContact CE1-CB 3.81Å; A349-E357 CarbonylContact O-C 3.48Å; A349-E357 WeakPolarHBondContact O-CA 3.49Å; A349-R358 HydrophobicContact CB-CB 4.47Å; A349-R358 PolarHBondContact N-O 3.25Å; A349-R358 PolarHBondContact O-N 3.48Å; A349-L360 HydrophobicContact CB-CD1 3.57Å; A349-L360 HydrophobicContact CB-CG 4.38Å
350	Y	98.6	Very high	96.1	Very high	16 Å²	16	61.3 Å²	61.3	6%	0.063	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	117.8	173.4	-172.3	-80.4	0	0	0	110.2	I300 W314 H315 T316 V332 M333 T352 E357	I300-Y350 HydrophobicContact CD1-CD1 3.84Å; I300-Y350 HydrophobicContact CD1-CG 4.14Å; W314-Y350 HydrophobicContact CB-CD1 4.47Å; W314-Y350 HydrophobicContact CB-CE1 3.68Å; W314-Y350 AromaticContact CD1-CE1 3.74Å; W314-Y350 AromaticContact CG-CE1 3.96Å; W314-Y350 HydrophobicContact CG-CE1 3.96Å; H315-Y350 WeakPolarHBondContact O-CE2 3.41Å; T316-Y350 HydrophobicContact CG2-CD2 3.85Å; T316-Y350 HydrophobicContact CG2-CE2 4.41Å; T316-Y350 HydrophobicContact CG2-CG 3.92Å; V332-Y350 CarbonylContact C-O 3.58Å; V332-Y350 WeakPolarHBondContact CA-O 3.49Å; M333-Y350 PolarHBondContact N-O 3.46Å; M333-Y350 PolarHBondContact O-N 3.23Å; Y350-T352 HydrophobicContact CD1-CG2 4.32Å; Y350-E357 HydrophobicContact CD2-CG 3.74Å; Y350-E357 HydrophobicContact CE2-CG 3.95Å
351	D	98.3	Very high	96.3	Very high	31 Å²	31	61.8 Å²	61.8	17%	0.166	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.8	176.2	176.1	-18	0	0	0	110	V332 K353 T354 K355 Q356	V332-D351 HydrophobicContact CG2-CB 4.06Å; D351-K353 VanDerWaalsContact C-N 3.29Å; D351-K353 PolarHBondContact O-N 3.5Å; D351-K353 WeakPolarHBondContact OD1-CA 3.38Å; D351-K353 WeakPolarHBondContact OD1-CB 3.49Å; D351-K353 PolarHBondContact OD1-N 2.99Å; D351-T354 VanDerWaalsContact CB-OG1 3.28Å; D351-T354 WeakPolarHBondContact CB-OG1 3.47Å; D351-T354 PolarHBondContact OD1-N 3.47Å; D351-T354 VanDerWaalsContact OD2-CG2 3.32Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.19Å; D351-T354 PolarHBondContact OD2-OG1 2.91Å; D351-K355 WeakPolarHBondContact O-CA 3.15Å; D351-K355 PolarHBondContact O-N 3.49Å; D351-Q356 PolarHBondContact N-O 3.05Å
352	T	98.2	Very high	96.9	Very high	13 Å²	13	58.1 Å²	58.1	8%	0.08	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.6	-177	61.8	0	0	0	0	113.7	W286 I300 W314 M328 G331 Y350	W286-T352 HydrophobicContact CH2-CG2 4.1Å; W286-T352 HydrophobicContact CZ3-CG2 4.06Å; I300-T352 HydrophobicContact CD1-CG2 4.5Å; I300-T352 HydrophobicContact CG2-CG2 4.42Å; W314-T352 HydrophobicContact CD2-CG2 3.95Å; W314-T352 HydrophobicContact CE3-CG2 4.21Å; W314-T352 HydrophobicContact CG-CG2 4.23Å; W314-T352 PolarHBondContact NE1-O 2.98Å; M328-T352 HydrophobicContact CE-CG2 4.2Å; G331-T352 WeakPolarHBondContact O-CB 3.46Å; G331-T352 WeakPolarHBondContact O-CG2 3.22Å; G331-T352 PolarHBondContact O-N 3.32Å; G331-T352 PolarHBondContact O-OG1 3.5Å; Y350-T352 HydrophobicContact CD1-CG2 4.32Å
353	K	96.4	Very high	97.5	Very high	194 Å²	194	59 Å²	59	84%	0.843	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-48	179.3	-177.2	-178.3	179.1	-178.1	0	111	D351	D351-K353 VanDerWaalsContact C-N 3.29Å; D351-K353 PolarHBondContact O-N 3.5Å; D351-K353 WeakPolarHBondContact OD1-CA 3.38Å; D351-K353 WeakPolarHBondContact OD1-CB 3.49Å; D351-K353 PolarHBondContact OD1-N 2.99Å
354	T	97	Very high	97.6	Very high	68 Å²	68	58.3 Å²	58.3	42%	0.417	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-14.4	-179.3	64.2	0	0	0	0	113.1	D351 Q356	D351-T354 VanDerWaalsContact CB-OG1 3.28Å; D351-T354 WeakPolarHBondContact CB-OG1 3.47Å; D351-T354 PolarHBondContact OD1-N 3.47Å; D351-T354 VanDerWaalsContact OD2-CG2 3.32Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.19Å; D351-T354 PolarHBondContact OD2-OG1 2.91Å; T354-Q356 PolarHBondContact O-N 3.23Å
355	K	97.8	Very high	97.3	Very high	144 Å²	144	64.2 Å²	64.2	63%	0.626	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	29.4	-174.1	-54.3	-177.8	-179.8	-177.3	0	112.8	D351	D351-K355 WeakPolarHBondContact O-CA 3.15Å; D351-K355 PolarHBondContact O-N 3.49Å
356	Q	97.3	Very high	96.6	Very high	122 Å²	122	64.1 Å²	64.1	57%	0.57	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	138.5	-179.1	-66.9	-172.2	-1.9	0	0	111.5	D351 T354	D351-Q356 PolarHBondContact N-O 3.05Å; T354-Q356 PolarHBondContact O-N 3.23Å
357	E	97.6	Very high	95.9	Very high	98 Å²	98	67.5 Å²	67.5	46%	0.458	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.3	172.9	-43.3	-161.1	152.1	0	0	109.6	G317 Y348 A349 Y350	G317-E357 PolarHBondContact N-OE1 3.41Å; Y348-E357 HydrophobicContact CE2-CB 3.83Å; Y348-E357 HydrophobicContact CE2-CG 4.43Å; Y348-E357 VanDerWaalsContact OH-CG 3.28Å; Y348-E357 WeakPolarHBondContact OH-CG 3.4Å; Y348-E357 PolarHBondContact OH-OE1 3.28Å; Y348-E357 PolarHBondContact OH-OE2 3.09Å; A349-E357 CarbonylContact O-C 3.48Å; A349-E357 WeakPolarHBondContact O-CA 3.49Å; Y350-E357 HydrophobicContact CD2-CG 3.74Å; Y350-E357 HydrophobicContact CE2-CG 3.95Å
358	R	97.3	Very high	95.1	Very high	86 Å²	86	69.1 Å²	69.1	33%	0.325	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.7	177.2	-66.5	-177.8	-72.9	174.7	-2.9	109.9	T142 Y348 A349 L360	T142-R358 PolarHBondContact O-NH1 3.02Å; Y348-R358 CarbonylContact C-O 3.3Å; Y348-R358 WeakPolarHBondContact CA-O 3.32Å; A349-R358 HydrophobicContact CB-CB 4.47Å; A349-R358 PolarHBondContact N-O 3.25Å; A349-R358 PolarHBondContact O-N 3.48Å; R358-L360 HydrophobicContact CB-CD2 4.38Å
359	N	97.1	Very high	94.3	Very high	144 Å²	144	75.3 Å²	75.3	77%	0.77	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	131.3	166.3	-67.1	-34.4	0	0	0	108.9	F347	F347-N359 WeakPolarHBondContact O-CA 3.37Å
360	L	96.9	Very high	93.7	Very high	49 Å²	49	77.2 Å²	77.2	26%	0.257	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	171.9	-176	-61	178.6	0	0	0	110.1	Y334 I346 F347 A349 R358 I362	Y334-L360 HydrophobicContact CD1-CD1 4.02Å; Y334-L360 HydrophobicContact CE1-CD1 3.99Å; I346-L360 HydrophobicContact CG2-CB 4.32Å; I346-L360 HydrophobicContact CG2-CD1 3.81Å; I346-L360 CarbonylContact O-C 3.39Å; I346-L360 VanDerWaalsContact O-C 3.3Å; I346-L360 WeakPolarHBondContact O-CB 3.45Å; F347-L360 WeakPolarHBondContact CA-O 3.18Å; F347-L360 PolarHBondContact O-N 3.4Å; A349-L360 HydrophobicContact CB-CD1 3.57Å; A349-L360 HydrophobicContact CB-CG 4.38Å; R358-L360 HydrophobicContact CB-CD2 4.38Å; L360-I362 HydrophobicContact CD1-CD1 4.2Å
361	S	97.1	Very high	93.3	Very high	82 Å²	82	76.6 Å²	76.6	57%	0.573	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.8	58.5	174	176.5	0	0	0	0	108.8	E345 I346	E345-S361 PolarHBondContact OE2-OG 3.43Å; I346-S361 PolarHBondContact O-N 3.5Å
362	I	97.9	Very high	93	Very high	25 Å²	25	75.6 Å²	75.6	13%	0.128	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	103.1	179.5	-54.4	164.7	0	0	0	108	I144 F147 E345 I346 L360	I144-I362 HydrophobicContact CB-CD1 4.21Å; I144-I362 HydrophobicContact CG2-CD1 4.31Å; I144-I362 HydrophobicContact CG2-CG2 4.45Å; I144-I362 WeakPolarHBondContact O-CD1 3.24Å; F147-I362 HydrophobicContact CD2-CG2 4.32Å; F147-I362 HydrophobicContact CE2-CG2 4.21Å; E345-I362 CarbonylContact C-O 3.56Å; E345-I362 VanDerWaalsContact CA-O 3.28Å; E345-I362 WeakPolarHBondContact CA-O 3.38Å; I346-I362 HydrophobicContact CB-CB 4.17Å; I346-I362 HydrophobicContact CD1-CD1 4.46Å; I346-I362 PolarHBondContact N-O 2.99Å; I346-I362 PolarHBondContact O-N 2.9Å; I346-I362 VanDerWaalsContact O-N 3.12Å; L360-I362 HydrophobicContact CD1-CD1 4.2Å
363	Q	97.5	Very high	92.9	Very high	107 Å²	107	75 Å²	75	50%	0.5	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	145.5	-176.3	-69	178.2	10.3	0	0	112.3	V339 T343 E344 E345	V339-Q363 HydrophobicContact CG2-CG 4.45Å; T343-Q363 HydrophobicContact CG2-CB 3.98Å; T343-Q363 HydrophobicContact CG2-CG 4.11Å; E344-Q363 CarbonylContact O-C 3.44Å; E344-Q363 WeakPolarHBondContact O-CA 3.16Å; E345-Q363 HydrophobicContact CB-CG 3.84Å
364	F	95.8	Very high	92.9	Very high	9 Å²	9	65.8 Å²	65.8	4%	0.039	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	149.2	169.1	63.4	-82	0	0	0	110.7	F147 T336 E344 L374 M385 Y394	F147-F364 HydrophobicContact CB-CB 3.87Å; F147-F364 HydrophobicContact CD2-CB 3.79Å; F147-F364 AromaticContact CD2-CD1 3.89Å; F147-F364 HydrophobicContact CD2-CD1 3.89Å; F147-F364 HydrophobicContact CD2-CG 4.03Å; F147-F364 AromaticContact CE2-CD1 3.99Å; F147-F364 HydrophobicContact CE2-CD1 3.99Å; F147-F364 HydrophobicContact CG-CB 4.05Å; F147-F364 HydrophobicContact CG-CG 4.38Å; T336-F364 HydrophobicContact CG2-CE1 4.13Å; T336-F364 HydrophobicContact CG2-CZ 4.2Å; E344-F364 HydrophobicContact CB-CD1 4.37Å; E344-F364 HydrophobicContact CB-CD2 4.37Å; E344-F364 HydrophobicContact CB-CE1 3.85Å; E344-F364 HydrophobicContact CB-CE2 3.85Å; E344-F364 HydrophobicContact CB-CZ 3.57Å; E344-F364 HydrophobicContact CG-CE1 3.87Å; E344-F364 HydrophobicContact CG-CE2 4.23Å; E344-F364 HydrophobicContact CG-CZ 3.53Å; E344-F364 PolarHBondContact N-O 3.22Å; E344-F364 PolarHBondContact O-N 2.99Å; E344-F364 VanDerWaalsContact O-O 3.07Å; F364-L374 HydrophobicContact CZ-CD2 4.16Å; F364-M385 HydrophobicContact CE2-CE 3.95Å; F364-Y394 HydrophobicContact CD2-CD1 4.48Å; F364-Y394 HydrophobicContact CD2-CE1 4.02Å
365	K	90.8	Very high	92.9	Very high	124 Å²	124	63.1 Å²	63.1	54%	0.539	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.5	-178.3	-67.5	179.3	-179.6	172.3	0	110.2	P150 N342 Y394	P150-K365 HydrophobicContact CG-CB 4.3Å; N342-K365 CarbonylContact O-C 3.46Å; N342-K365 WeakPolarHBondContact O-CA 3.42Å; K365-Y394 VanDerWaalsContact O-CE1 3.23Å; K365-Y394 WeakPolarHBondContact O-CE1 3.49Å; K365-Y394 PolarHBondContact O-OH 3.01Å
366	K	84.1	Confident	93	Very high	10 Å²	10	56.6 Å²	56.6	4%	0.043	28%	0.279	C	S	.	.			trans	-76.5	150.9	165.8	-61.8	-176.9	-76.2	-170.2	0	110.1	Y270 T338 D340 I341 N342 E344 Q368 E369 Y371	Y270-K366 PolarHBondContact OH-NZ 2.81Å; T338-K366 PolarHBondContact OG1-NZ 3.3Å; D340-K366 WeakPolarHBondContact O-CE 3.49Å; D340-K366 PolarHBondContact O-NZ 2.89Å; I341-K366 WeakPolarHBondContact O-CE 3.04Å; N342-K366 PolarHBondContact O-N 3.45Å; E344-K366 HydrophobicContact CB-CD 4.04Å; E344-K366 HydrophobicContact CB-CG 3.77Å; E344-K366 WeakPolarHBondContact OE2-CD 3.25Å; E344-K366 IonicContact OE2-NZ 3.5Å; K366-Q368 VanDerWaalsContact CB-O 3.24Å; K366-Q368 WeakPolarHBondContact CB-O 3.48Å; K366-E369 PolarHBondContact NZ-O 3.31Å; K366-Y371 HydrophobicContact CD-CD1 4.43Å; K366-Y371 HydrophobicContact CD-CE1 4.5Å
367	F	82.3	Confident	93	Very high	71 Å²	71	51.2 Å²	51.2	31%	0.311	25%	0.254	S	S	.	.	S	Bend	trans	-77	-36.8	170.6	178.2	-118.5	0	0	0	112.5	V152 Y390 V392	V152-F367 HydrophobicContact CB-CE2 4.41Å; V152-F367 HydrophobicContact CG1-CE1 4.25Å; V152-F367 HydrophobicContact CG1-CE2 4.24Å; V152-F367 HydrophobicContact CG1-CZ 4.01Å; V152-F367 HydrophobicContact CG2-CD1 4.34Å; V152-F367 HydrophobicContact CG2-CD2 3.26Å; V152-F367 HydrophobicContact CG2-CE1 4.44Å; V152-F367 HydrophobicContact CG2-CE2 3.39Å; V152-F367 HydrophobicContact CG2-CG 3.79Å; V152-F367 HydrophobicContact CG2-CZ 4Å; F367-Y390 HydrophobicContact CD1-CD2 4.44Å; F367-Y390 HydrophobicContact CD1-CG 4.17Å; F367-Y390 AromaticContact CE1-CD1 3.76Å; F367-Y390 HydrophobicContact CE1-CD1 3.76Å; F367-Y390 AromaticContact CE1-CD2 3.71Å; F367-Y390 HydrophobicContact CE1-CD2 3.71Å; F367-Y390 HydrophobicContact CE1-CE1 4.19Å; F367-Y390 HydrophobicContact CE1-CE2 4.14Å; F367-Y390 AromaticContact CE1-CG 3.49Å; F367-Y390 HydrophobicContact CE1-CG 3.49Å; F367-Y390 VanDerWaalsContact CE1-CG 3.49Å; F367-Y390 HydrophobicContact CZ-CD1 4.25Å; F367-Y390 HydrophobicContact CZ-CE1 4.37Å; F367-Y390 HydrophobicContact CZ-CG 4.41Å; F367-V392 HydrophobicContact CB-CG1 4.39Å; F367-V392 HydrophobicContact CB-CG2 3.87Å; F367-V392 HydrophobicContact CD1-CG2 4Å; F367-V392 HydrophobicContact CG-CG2 4.09Å
368	Q	82.1	Confident	92.9	Very high	54 Å²	54	47.1 Å²	47.1	25%	0.252	24%	0.236	S	C	.	.	S	Bend	trans	-140.9	176.7	172.5	-42.3	-172.4	-18.2	0	0	110.9	K366 S370 N387 N388	K366-Q368 VanDerWaalsContact CB-O 3.24Å; K366-Q368 WeakPolarHBondContact CB-O 3.48Å; Q368-S370 PolarHBondContact O-N 3.36Å; Q368-N387 WeakPolarHBondContact CB-ND2 3.37Å; Q368-N387 WeakPolarHBondContact CB-OD1 3.25Å; Q368-N387 PolarHBondContact N-ND2 3.33Å; Q368-N387 VanDerWaalsContact N-ND2 3.14Å; Q368-N387 PolarHBondContact O-ND2 3.35Å; Q368-N387 PolarHBondContact OE1-OD1 2.95Å; Q368-N388 VanDerWaalsContact OE1-CB 3.22Å; Q368-N388 PolarHBondContact OE1-ND2 3.37Å
369	E	82.1	Confident	92.7	Very high	135 Å²	135	44.2 Å²	44.2	63%	0.631	23%	0.228	S	C	*	.	S	Bend	trans	-54.9	-43.8	-170.5	-173	177	173	0	0	115	I341 K366	I341-E369 WeakPolarHBondContact O-CA 3.08Å; K366-E369 PolarHBondContact NZ-O 3.31Å
370	S	84.9	Confident	92.6	Very high	39 Å²	39	38.5 Å²	38.5	27%	0.273	20%	0.198	S	C	.	.			trans	-128.5	165.3	-179.9	60.4	0	0	0	0	110.3	Q368 N387	Q368-S370 PolarHBondContact O-N 3.36Å; S370-N387 PolarHBondContact O-ND2 3.41Å; S370-N387 PolarHBondContact O-OD1 3.34Å
371	Y	91.9	Very high	92.4	Very high	3 Å²	3	36.4 Å²	36.4	1%	0.012	19%	0.187	C	C	.	.			trans	-138.5	153.7	171	55.3	-93.7	0	0	0	109	Y270 N325 T336 E344 K366 L374 M385 Y386	Y270-Y371 HydrophobicContact CD2-CD1 4.31Å; Y270-Y371 AromaticContact CD2-CE1 3.89Å; Y270-Y371 HydrophobicContact CD2-CE1 3.89Å; Y270-Y371 HydrophobicContact CD2-CE2 4.1Å; Y270-Y371 AromaticContact CD2-CZ 3.75Å; Y270-Y371 HydrophobicContact CE2-CD1 4.02Å; Y270-Y371 AromaticContact CE2-CE1 3.38Å; Y270-Y371 HydrophobicContact CE2-CE1 3.38Å; Y270-Y371 HydrophobicContact CE2-CE2 4.35Å; Y270-Y371 AromaticContact CE2-CZ 3.55Å; N325-Y371 HydrophobicContact CB-CE2 3.83Å; T336-Y371 PolarHBondContact OG1-OH 3.19Å; E344-Y371 HydrophobicContact CG-CE1 4.29Å; E344-Y371 PolarHBondContact OE1-OH 3.36Å; E344-Y371 WeakPolarHBondContact OE2-CE1 3.36Å; K366-Y371 HydrophobicContact CD-CD1 4.43Å; K366-Y371 HydrophobicContact CD-CE1 4.5Å; Y371-L374 HydrophobicContact CD2-CB 3.9Å; Y371-L374 HydrophobicContact CE2-CB 3.53Å; Y371-L374 HydrophobicContact CE2-CD2 4.02Å; Y371-L374 HydrophobicContact CE2-CG 4.33Å; Y371-M385 HydrophobicContact CD1-CE 3.71Å; Y371-M385 HydrophobicContact CD1-SD 4.3Å; Y371-M385 HydrophobicContact CE1-CE 4.14Å; Y371-M385 HydrophobicContact CG-CE 4Å; Y371-M385 HydrophobicContact CG-CG 4.18Å; Y371-M385 HydrophobicContact CG-SD 4.27Å; Y371-Y386 WeakPolarHBondContact CB-O 3.26Å
372	S	91.9	Very high	92.3	Very high	10 Å²	10	34.2 Å²	34.2	7%	0.07	17%	0.167	C	C	.	.	S	Bend	trans	-96.2	-20.5	179.3	73.1	0	0	0	0	112.7	G166 N225 Q274 Y386	G166-S372 PolarHBondContact N-OG 3.45Å; G166-S372 PolarHBondContact O-OG 2.89Å; N225-S372 WeakPolarHBondContact CB-O 3.37Å; Q274-S372 PolarHBondContact NE2-O 2.75Å; S372-Y386 PolarHBondContact N-O 3.32Å; S372-Y386 VanDerWaalsContact OG-CD1 3.32Å; S372-Y386 WeakPolarHBondContact OG-CD1 3.45Å
373	N	95.2	Very high	92.3	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	144	-180	172.8	-111.6	0	0	0	110.4	G166 N225 N226 D375 M385 Y386	G166-N373 WeakPolarHBondContact O-CB 3.36Å; N225-N373 HydrophobicContact CB-CB 4.4Å; N225-N373 PolarHBondContact O-ND2 3.4Å; N225-N373 VanDerWaalsContact O-ND2 3.12Å; N226-N373 PolarHBondContact OD1-ND2 3.27Å; N226-N373 VanDerWaalsContact OD1-ND2 3.08Å; N373-D375 PolarHBondContact ND2-OD2 3.2Å; N373-M385 VanDerWaalsContact O-CA 3.29Å; N373-M385 WeakPolarHBondContact O-CA 3.3Å; N373-Y386 PolarHBondContact N-O 2.97Å; N373-Y386 PolarHBondContact O-N 2.82Å
374	L	97.1	Very high	92.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	104.7	178.5	-172.9	69.2	0	0	0	109.8	N325 F327 T336 F364 Y371 L383 Y384 M385	N325-L374 HydrophobicContact CB-CB 4.03Å; N325-L374 HydrophobicContact CB-CD2 4.18Å; N325-L374 PolarHBondContact OD1-O 2.78Å; F327-L374 HydrophobicContact CD1-CD2 4.45Å; F327-L374 HydrophobicContact CE1-CD2 4.42Å; T336-L374 HydrophobicContact CG2-CD2 3.94Å; F364-L374 HydrophobicContact CZ-CD2 4.16Å; Y371-L374 HydrophobicContact CD2-CB 3.9Å; Y371-L374 HydrophobicContact CE2-CB 3.53Å; Y371-L374 HydrophobicContact CE2-CD2 4.02Å; Y371-L374 HydrophobicContact CE2-CG 4.33Å; L374-L383 HydrophobicContact CD1-CD1 4.17Å; L374-L383 HydrophobicContact CD1-CD2 3.6Å; L374-L383 HydrophobicContact CD1-CG 3.62Å; L374-L383 HydrophobicContact CD2-CD2 4.23Å; L374-L383 HydrophobicContact CG-CD1 4.07Å; L374-L383 HydrophobicContact CG-CD2 4.03Å; L374-L383 HydrophobicContact CG-CG 4.07Å; L374-Y384 CarbonylContact C-O 3.5Å; L374-Y384 VanDerWaalsContact CA-O 3.26Å; L374-Y384 WeakPolarHBondContact CA-O 3.41Å; L374-M385 HydrophobicContact CD1-CB 3.77Å; L374-M385 HydrophobicContact CD1-CE 3.62Å; L374-M385 HydrophobicContact CD1-CG 4.23Å
375	D	97.1	Very high	92.3	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.064	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135.5	-170.4	-95	-62.8	0	0	0	112.7	N373 L383 Y384	N373-D375 PolarHBondContact ND2-OD2 3.2Å; D375-L383 CarbonylContact O-C 3.59Å; D375-Y384 PolarHBondContact N-O 2.83Å; D375-Y384 PolarHBondContact O-N 2.95Å
376	Y	98.3	Very high	92.5	Very high	8 Å²	8	21.9 Å²	21.9	3%	0.031	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	139.1	172.2	176.7	-106.1	0	0	0	110.6	D281 E282 M328 V329 P378 Q381 V396 F398	D281-Y376 HydrophobicContact CB-CD1 4.5Å; D281-Y376 HydrophobicContact CB-CE1 4.5Å; E282-Y376 WeakPolarHBondContact OE1-CE1 3.48Å; E282-Y376 PolarHBondContact OE1-OH 2.91Å; M328-Y376 WeakPolarHBondContact O-CD1 3.44Å; V329-Y376 HydrophobicContact CB-CD1 4.49Å; V329-Y376 HydrophobicContact CB-CE1 4.27Å; V329-Y376 HydrophobicContact CG1-CE1 3.91Å; V329-Y376 HydrophobicContact CG1-CE2 4.35Å; V329-Y376 HydrophobicContact CG2-CD1 3.84Å; V329-Y376 HydrophobicContact CG2-CD2 3.86Å; V329-Y376 HydrophobicContact CG2-CE1 3.97Å; V329-Y376 HydrophobicContact CG2-CE2 4.01Å; V329-Y376 HydrophobicContact CG2-CG 3.76Å; Y376-P378 HydrophobicContact CE1-CB 3.91Å; Y376-Q381 HydrophobicContact CE2-CB 4.3Å; Y376-Q381 WeakPolarHBondContact OH-CG 3.22Å; Y376-V396 HydrophobicContact CD2-CG2 4.25Å; Y376-V396 HydrophobicContact CE2-CG2 4.15Å; Y376-F398 HydrophobicContact CE2-CZ 4.32Å
377	N	97.4	Very high	92.6	Very high	9 Å²	9	21.4 Å²	21.4	5%	0.048	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	114.6	173	-160.5	-58.8	0	0	0	111.1	K170 S379 Q381 K382 Y384	K170-N377 PolarHBondContact O-ND2 3.25Å; N377-S379 PolarHBondContact O-N 2.75Å; N377-S379 WeakPolarHBondContact OD1-CB 3.48Å; N377-S379 PolarHBondContact OD1-N 2.9Å; N377-S379 PolarHBondContact OD1-OG 2.92Å; N377-Q381 VanDerWaalsContact O-CA 3.27Å; N377-Q381 WeakPolarHBondContact O-CA 3.32Å; N377-Q381 PolarHBondContact O-N 3.04Å; N377-K382 PolarHBondContact N-O 3.28Å; N377-K382 PolarHBondContact O-N 2.96Å; N377-Y384 HydrophobicContact CB-CD2 3.84Å; N377-Y384 HydrophobicContact CB-CE2 3.6Å
378	P	96.3	Very high	92.5	Very high	12 Å²	12	20.5 Å²	20.5	8%	0.078	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-16.9	-179.1	29.3	-35.9	0	0	0	113	A280 E282 Y376 D380	A280-P378 WeakPolarHBondContact O-CD 3.35Å; E282-P378 HydrophobicContact CG-CB 4.16Å; Y376-P378 HydrophobicContact CE1-CB 3.91Å; P378-D380 PolarHBondContact O-N 3.07Å
379	S	94.1	Very high	92.5	Very high	24 Å²	24	17.9 Å²	17.9	17%	0.168	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-22.5	-178.8	77.9	0	0	0	0	113.4	N377	N377-S379 PolarHBondContact O-N 2.75Å; N377-S379 WeakPolarHBondContact OD1-CB 3.48Å; N377-S379 PolarHBondContact OD1-N 2.9Å; N377-S379 PolarHBondContact OD1-OG 2.92Å
380	D	93.1	Very high	92.6	Very high	24 Å²	24	14.9 Å²	14.9	13%	0.128	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.7	8.4	176.1	60.8	7.3	0	0	0	114.5	K170 P378 K382 Y384	K170-D380 WeakPolarHBondContact CD-OD2 3.4Å; K170-D380 IonicContact NZ-OD2 3.86Å; P378-D380 PolarHBondContact O-N 3.07Å; D380-K382 VanDerWaalsContact C-N 3.27Å; D380-K382 PolarHBondContact O-N 3.12Å; D380-Y384 PolarHBondContact OD2-OH 3.5Å
381	Q	93.6	Very high	92.9	Very high	5 Å²	5	13 Å²	13	2%	0.023	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	43.2	177.9	-53.9	-170.5	-39.6	0	0	113.1	P134 D135 Y376 N377 V396 F398	P134-Q381 VanDerWaalsContact CA-OE1 3.29Å; P134-Q381 HydrophobicContact CB-CB 3.92Å; P134-Q381 HydrophobicContact CB-CG 4.15Å; D135-Q381 VanDerWaalsContact N-OE1 3.12Å; D135-Q381 PolarHBondContact O-NE2 3.39Å; Y376-Q381 HydrophobicContact CE2-CB 4.3Å; Y376-Q381 WeakPolarHBondContact OH-CG 3.22Å; N377-Q381 VanDerWaalsContact O-CA 3.27Å; N377-Q381 WeakPolarHBondContact O-CA 3.32Å; N377-Q381 PolarHBondContact O-N 3.04Å; Q381-V396 WeakPolarHBondContact O-CG2 3.31Å; Q381-V396 PolarHBondContact O-N 3.49Å; Q381-F398 HydrophobicContact CB-CE2 4.23Å; Q381-F398 HydrophobicContact CG-CE2 4.49Å
382	K	95.1	Very high	92.9	Very high	37 Å²	37	12.9 Å²	12.9	16%	0.161	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	150.7	175.8	-68.8	-175	178.5	-171.2	0	111.6	N377 D380 Y384 Y394 N395	N377-K382 PolarHBondContact N-O 3.28Å; N377-K382 PolarHBondContact O-N 2.96Å; D380-K382 VanDerWaalsContact C-N 3.27Å; D380-K382 PolarHBondContact O-N 3.12Å; K382-Y384 HydrophobicContact CB-CD2 4.24Å; K382-Y384 HydrophobicContact CB-CE2 3.76Å; K382-Y394 WeakPolarHBondContact CA-O 3.47Å; K382-N395 VanDerWaalsContact CE-OD1 3.28Å; K382-N395 WeakPolarHBondContact CE-OD1 3.44Å
383	L	97.1	Very high	92.9	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.6	166	-167.3	69.3	0	0	0	108.3	F147 F327 L374 D375 S393 Y394 V396	F147-L383 HydrophobicContact CD1-CD2 4.29Å; F147-L383 HydrophobicContact CE1-CB 4.18Å; F147-L383 HydrophobicContact CE1-CD2 3.71Å; F147-L383 HydrophobicContact CZ-CD2 4.17Å; F327-L383 HydrophobicContact CD1-CD1 3.81Å; F327-L383 HydrophobicContact CD2-CD1 4.15Å; F327-L383 HydrophobicContact CE1-CD1 3.9Å; F327-L383 HydrophobicContact CE1-CD2 4.22Å; F327-L383 HydrophobicContact CE2-CD1 4.23Å; F327-L383 HydrophobicContact CG-CD1 3.94Å; F327-L383 HydrophobicContact CZ-CD1 4.11Å; F327-L383 HydrophobicContact CZ-CD2 4.39Å; L374-L383 HydrophobicContact CD1-CD1 4.17Å; L374-L383 HydrophobicContact CD1-CD2 3.6Å; L374-L383 HydrophobicContact CD1-CG 3.62Å; L374-L383 HydrophobicContact CD2-CD2 4.23Å; L374-L383 HydrophobicContact CG-CD1 4.07Å; L374-L383 HydrophobicContact CG-CD2 4.03Å; L374-L383 HydrophobicContact CG-CG 4.07Å; D375-L383 CarbonylContact O-C 3.59Å; L383-S393 CarbonylContact O-C 3.57Å; L383-S393 VanDerWaalsContact O-CA 3.24Å; L383-S393 WeakPolarHBondContact O-CA 3.36Å; L383-Y394 HydrophobicContact CB-CD2 4.31Å; L383-Y394 HydrophobicContact CD2-CD2 4.4Å; L383-Y394 PolarHBondContact N-O 3.03Å; L383-Y394 PolarHBondContact O-N 3.31Å; L383-V396 HydrophobicContact CB-CG2 4.27Å
384	Y	97.6	Very high	92.8	Very high	6 Å²	6	12.4 Å²	12.4	2%	0.024	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	133.3	177.4	-73	-92.7	0	0	0	109.6	W168 K170 L374 D375 N377 D380 K382	W168-Y384 AromaticContact CD2-CD1 3.96Å; W168-Y384 HydrophobicContact CD2-CD1 3.96Å; W168-Y384 HydrophobicContact CD2-CE1 4.47Å; W168-Y384 AromaticContact CE2-CD1 3.67Å; W168-Y384 HydrophobicContact CE3-CD1 4Å; W168-Y384 HydrophobicContact CE3-CE1 4.06Å; W168-Y384 AromaticContact CH2-CD1 3.55Å; W168-Y384 HydrophobicContact CH2-CD1 3.55Å; W168-Y384 AromaticContact CH2-CE1 3.43Å; W168-Y384 HydrophobicContact CH2-CE1 3.43Å; W168-Y384 VanDerWaalsContact CH2-CE1 3.43Å; W168-Y384 AromaticContact CZ2-CD1 3.49Å; W168-Y384 HydrophobicContact CZ2-CD1 3.49Å; W168-Y384 VanDerWaalsContact CZ2-CD1 3.49Å; W168-Y384 AromaticContact CZ2-CE1 3.91Å; W168-Y384 HydrophobicContact CZ2-CE1 3.91Å; W168-Y384 AromaticContact CZ3-CD1 3.82Å; W168-Y384 HydrophobicContact CZ3-CD1 3.82Å; W168-Y384 AromaticContact CZ3-CE1 3.53Å; W168-Y384 HydrophobicContact CZ3-CE1 3.53Å; K170-Y384 VanDerWaalsContact CD-OH 3.29Å; K170-Y384 WeakPolarHBondContact CD-OH 3.38Å; L374-Y384 CarbonylContact C-O 3.5Å; L374-Y384 VanDerWaalsContact CA-O 3.26Å; L374-Y384 WeakPolarHBondContact CA-O 3.41Å; D375-Y384 PolarHBondContact N-O 2.83Å; D375-Y384 PolarHBondContact O-N 2.95Å; N377-Y384 HydrophobicContact CB-CD2 3.84Å; N377-Y384 HydrophobicContact CB-CE2 3.6Å; D380-Y384 PolarHBondContact OD2-OH 3.5Å; K382-Y384 HydrophobicContact CB-CD2 4.24Å; K382-Y384 HydrophobicContact CB-CE2 3.76Å
385	M	96.4	Very high	92.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136	179.2	175.2	-174.3	-75.6	0	0	109.5	W168 F364 Y371 N373 L374 N387 V392 Y394	W168-M385 PolarHBondContact NE1-O 3.25Å; F364-M385 HydrophobicContact CE2-CE 3.95Å; Y371-M385 HydrophobicContact CD1-CE 3.71Å; Y371-M385 HydrophobicContact CD1-SD 4.3Å; Y371-M385 HydrophobicContact CE1-CE 4.14Å; Y371-M385 HydrophobicContact CG-CE 4Å; Y371-M385 HydrophobicContact CG-CG 4.18Å; Y371-M385 HydrophobicContact CG-SD 4.27Å; N373-M385 VanDerWaalsContact O-CA 3.29Å; N373-M385 WeakPolarHBondContact O-CA 3.3Å; L374-M385 HydrophobicContact CD1-CB 3.77Å; L374-M385 HydrophobicContact CD1-CE 3.62Å; L374-M385 HydrophobicContact CD1-CG 4.23Å; M385-N387 HydrophobicContact CG-CB 4.38Å; M385-N387 HydrophobicContact SD-CB 4.42Å; M385-V392 HydrophobicContact CB-CB 4.1Å; M385-V392 HydrophobicContact CG-CB 4.45Å; M385-V392 PolarHBondContact N-O 2.96Å; M385-V392 PolarHBondContact O-N 2.8Å; M385-V392 HydrophobicContact SD-CB 4.49Å; M385-Y394 HydrophobicContact CB-CE2 4.02Å; M385-Y394 HydrophobicContact CE-CE2 3.87Å; M385-Y394 HydrophobicContact SD-CE2 4.12Å; M385-Y394 PolarHBondContact SD-OH 3.43Å
386	Y	95.3	Very high	92.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.8	166.3	-167.7	-106.2	0	0	0	110.1	N156 Y163 G166 Y184 A186 Y371 S372 N373 G389 Y390 Y391	N156-Y386 HydrophobicContact CB-CE2 4.24Å; N156-Y386 VanDerWaalsContact CB-OH 3.31Å; N156-Y386 WeakPolarHBondContact CB-OH 3.44Å; Y163-Y386 WeakPolarHBondContact O-CE1 3.35Å; Y163-Y386 PolarHBondContact O-OH 2.79Å; G166-Y386 VanDerWaalsContact C-CD1 3.42Å; G166-Y386 WeakPolarHBondContact O-CB 3.22Å; G166-Y386 WeakPolarHBondContact O-CD1 3.39Å; Y184-Y386 HydrophobicContact CE2-CE2 4.09Å; A186-Y386 HydrophobicContact CB-CE1 3.96Å; A186-Y386 WeakPolarHBondContact CB-OH 3.17Å; Y371-Y386 WeakPolarHBondContact CB-O 3.26Å; S372-Y386 PolarHBondContact N-O 3.32Å; S372-Y386 VanDerWaalsContact OG-CD1 3.32Å; S372-Y386 WeakPolarHBondContact OG-CD1 3.45Å; N373-Y386 PolarHBondContact N-O 2.97Å; N373-Y386 PolarHBondContact O-N 2.82Å; Y386-G389 WeakPolarHBondContact OH-CA 3.39Å; Y386-Y390 WeakPolarHBondContact CA-O 3.48Å; Y386-Y390 WeakPolarHBondContact CD2-O 3.21Å; Y386-Y391 AromaticContact CD2-CD1 3.72Å; Y386-Y391 HydrophobicContact CD2-CD1 3.72Å; Y386-Y391 HydrophobicContact CD2-CE1 4.03Å; Y386-Y391 AromaticContact CE2-CD1 3.64Å; Y386-Y391 HydrophobicContact CE2-CD1 3.64Å; Y386-Y391 AromaticContact CE2-CE1 3.57Å; Y386-Y391 HydrophobicContact CE2-CE1 3.57Å
387	N	85.1	Confident	91.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	106.6	-172.3	-176.2	-23.8	0	0	0	110.1	Q368 S370 M385 G389 Y390	Q368-N387 WeakPolarHBondContact CB-ND2 3.37Å; Q368-N387 WeakPolarHBondContact CB-OD1 3.25Å; Q368-N387 PolarHBondContact N-ND2 3.33Å; Q368-N387 VanDerWaalsContact N-ND2 3.14Å; Q368-N387 PolarHBondContact O-ND2 3.35Å; Q368-N387 PolarHBondContact OE1-OD1 2.95Å; S370-N387 PolarHBondContact O-ND2 3.41Å; S370-N387 PolarHBondContact O-OD1 3.34Å; M385-N387 HydrophobicContact CG-CB 4.38Å; M385-N387 HydrophobicContact SD-CB 4.42Å; N387-G389 PolarHBondContact O-N 3.16Å; N387-G389 VanDerWaalsContact O-N 3.08Å; N387-Y390 PolarHBondContact N-O 3.46Å; N387-Y390 VanDerWaalsContact N-O 3.1Å; N387-Y390 WeakPolarHBondContact O-CB 3.36Å; N387-Y390 PolarHBondContact O-N 2.99Å
388	N	80.7	Confident	91.7	Very high	51 Å²	51	19.7 Å²	19.7	27%	0.273	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.5	48.2	174.3	-61.4	-28.3	0	0	0	113.7	Q368	Q368-N388 VanDerWaalsContact OE1-CB 3.22Å; Q368-N388 PolarHBondContact OE1-ND2 3.37Å
389	G	81.3	Confident	91.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	-0.1	-179.2	0	0	0	0	0	115.7	F155 N156 Y386 N387	F155-G389 CarbonylContact C-O 3.57Å; F155-G389 VanDerWaalsContact CD2-O 3.23Å; F155-G389 WeakPolarHBondContact CD2-O 3.29Å; N156-G389 WeakPolarHBondContact CA-O 3.47Å; N156-G389 WeakPolarHBondContact CB-O 3.17Å; N156-G389 PolarHBondContact N-O 3.31Å; N156-G389 WeakPolarHBondContact ND2-CA 3.4Å; N156-G389 PolarHBondContact ND2-O 2.97Å; Y386-G389 WeakPolarHBondContact OH-CA 3.39Å; N387-G389 PolarHBondContact O-N 3.16Å; N387-G389 VanDerWaalsContact O-N 3.08Å
390	Y	84.9	Confident	90.7	Very high	71 Å²	71	29.7 Å²	29.7	28%	0.278	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.8	179.6	-68.8	-92.2	0	0	0	113	V152 F155 F367 Y386 N387	V152-Y390 HydrophobicContact CG1-CD1 4.02Å; F155-Y390 HydrophobicContact CB-CE1 4.27Å; F155-Y390 HydrophobicContact CD2-CD1 4.11Å; F155-Y390 HydrophobicContact CD2-CD2 4.08Å; F155-Y390 AromaticContact CD2-CE1 3.8Å; F155-Y390 HydrophobicContact CD2-CE1 3.8Å; F155-Y390 AromaticContact CD2-CE2 3.77Å; F155-Y390 HydrophobicContact CD2-CE2 3.77Å; F155-Y390 HydrophobicContact CD2-CG 4.24Å; F155-Y390 AromaticContact CD2-CZ 3.63Å; F155-Y390 HydrophobicContact CE2-CD2 4.32Å; F155-Y390 AromaticContact CE2-CE2 3.85Å; F155-Y390 HydrophobicContact CE2-CE2 3.85Å; F155-Y390 HydrophobicContact CG-CE1 4.47Å; F367-Y390 HydrophobicContact CD1-CD2 4.44Å; F367-Y390 HydrophobicContact CD1-CG 4.17Å; F367-Y390 AromaticContact CE1-CD1 3.76Å; F367-Y390 HydrophobicContact CE1-CD1 3.76Å; F367-Y390 AromaticContact CE1-CD2 3.71Å; F367-Y390 HydrophobicContact CE1-CD2 3.71Å; F367-Y390 HydrophobicContact CE1-CE1 4.19Å; F367-Y390 HydrophobicContact CE1-CE2 4.14Å; F367-Y390 AromaticContact CE1-CG 3.49Å; F367-Y390 HydrophobicContact CE1-CG 3.49Å; F367-Y390 VanDerWaalsContact CE1-CG 3.49Å; F367-Y390 HydrophobicContact CZ-CD1 4.25Å; F367-Y390 HydrophobicContact CZ-CE1 4.37Å; F367-Y390 HydrophobicContact CZ-CG 4.41Å; Y386-Y390 WeakPolarHBondContact CA-O 3.48Å; Y386-Y390 WeakPolarHBondContact CD2-O 3.21Å; N387-Y390 PolarHBondContact N-O 3.46Å; N387-Y390 VanDerWaalsContact N-O 3.1Å; N387-Y390 WeakPolarHBondContact O-CB 3.36Å; N387-Y390 PolarHBondContact O-N 2.99Å
391	Y	91.9	Very high	89.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.3	170.2	-62.7	-2.9	0	0	0	108.2	V153 Q154 N156 G157 W168 Y184 L205 Y386	V153-Y391 WeakPolarHBondContact CB-O 3.35Å; V153-Y391 HydrophobicContact CG1-CD2 4.47Å; V153-Y391 PolarHBondContact N-O 3.44Å; Q154-Y391 HydrophobicContact CG-CD2 3.54Å; Q154-Y391 HydrophobicContact CG-CE2 3.87Å; Q154-Y391 HydrophobicContact CG-CG 4.25Å; Q154-Y391 VanDerWaalsContact NE2-CE2 3.29Å; Q154-Y391 PolarHBondContact O-N 2.95Å; N156-Y391 HydrophobicContact CB-CE1 4.12Å; G157-Y391 PolarHBondContact N-OH 3.01Å; W168-Y391 HydrophobicContact CB-CD1 4.07Å; W168-Y391 HydrophobicContact CB-CE1 4.19Å; W168-Y391 HydrophobicContact CB-CG 4.37Å; W168-Y391 AromaticContact CD1-CD1 3.82Å; W168-Y391 HydrophobicContact CD2-CD1 4.24Å; W168-Y391 HydrophobicContact CD2-CD2 4.1Å; W168-Y391 AromaticContact CD2-CG 3.75Å; W168-Y391 HydrophobicContact CD2-CG 3.75Å; W168-Y391 VanDerWaalsContact CE2-CB 3.44Å; W168-Y391 HydrophobicContact CE3-CD2 4.14Å; W168-Y391 HydrophobicContact CE3-CG 4.25Å; W168-Y391 AromaticContact CG-CD1 3.74Å; W168-Y391 HydrophobicContact CG-CD1 3.74Å; W168-Y391 HydrophobicContact CG-CD2 4.32Å; W168-Y391 HydrophobicContact CG-CE1 4.35Å; W168-Y391 AromaticContact CG-CG 3.76Å; W168-Y391 HydrophobicContact CG-CG 3.76Å; Y184-Y391 WeakPolarHBondContact CD1-OH 3.17Å; Y184-Y391 AromaticContact CD2-CE1 3.45Å; Y184-Y391 HydrophobicContact CD2-CE1 3.45Å; Y184-Y391 VanDerWaalsContact CD2-CE1 3.45Å; Y184-Y391 AromaticContact CD2-CZ 3.49Å; Y184-Y391 VanDerWaalsContact CD2-CZ 3.49Å; Y184-Y391 WeakPolarHBondContact CD2-OH 3.41Å; Y184-Y391 AromaticContact CE2-CE1 3.56Å; Y184-Y391 HydrophobicContact CE2-CE1 3.56Å; Y184-Y391 AromaticContact CE2-CZ 3.82Å; Y184-Y391 VanDerWaalsContact CE2-OH 3.22Å; Y184-Y391 WeakPolarHBondContact CE2-OH 3.36Å; Y184-Y391 HydrophobicContact CG-CE1 4.28Å; Y184-Y391 AromaticContact CG-CZ 3.85Å; L205-Y391 HydrophobicContact CD1-CD2 4.45Å; L205-Y391 HydrophobicContact CD1-CE2 3.83Å; L205-Y391 HydrophobicContact CD2-CD2 4.36Å; L205-Y391 HydrophobicContact CG-CE2 4.25Å; Y386-Y391 AromaticContact CD2-CD1 3.72Å; Y386-Y391 HydrophobicContact CD2-CD1 3.72Å; Y386-Y391 HydrophobicContact CD2-CE1 4.03Å; Y386-Y391 AromaticContact CE2-CD1 3.64Å; Y386-Y391 HydrophobicContact CE2-CD1 3.64Å; Y386-Y391 AromaticContact CE2-CE1 3.57Å; Y386-Y391 HydrophobicContact CE2-CE1 3.57Å
392	V	91	Very high	88.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.1	179.2	-175.9	0	0	0	0	109.2	P150 L151 V152 W168 F367 M385 Y394	P150-V392 HydrophobicContact CB-CG1 3.73Å; L151-V392 CarbonylContact O-C 3.51Å; L151-V392 WeakPolarHBondContact O-CA 3.3Å; V152-V392 HydrophobicContact CG2-CG2 4.49Å; W168-V392 WeakPolarHBondContact CZ2-O 3.41Å; W168-V392 PolarHBondContact NE1-O 3.16Å; F367-V392 HydrophobicContact CB-CG1 4.39Å; F367-V392 HydrophobicContact CB-CG2 3.87Å; F367-V392 HydrophobicContact CD1-CG2 4Å; F367-V392 HydrophobicContact CG-CG2 4.09Å; M385-V392 HydrophobicContact CB-CB 4.1Å; M385-V392 HydrophobicContact CG-CB 4.45Å; M385-V392 PolarHBondContact N-O 2.96Å; M385-V392 PolarHBondContact O-N 2.8Å; M385-V392 HydrophobicContact SD-CB 4.49Å; V392-Y394 HydrophobicContact CG1-CE2 3.85Å
393	S	93.3	Very high	88.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	157.8	174	63.5	0	0	0	0	112.3	L151 L383	L151-S393 WeakPolarHBondContact CB-O 3.26Å; L151-S393 PolarHBondContact N-O 2.88Å; L151-S393 PolarHBondContact O-N 3.22Å; L383-S393 CarbonylContact O-C 3.57Å; L383-S393 VanDerWaalsContact O-CA 3.24Å; L383-S393 WeakPolarHBondContact O-CA 3.36Å
394	Y	93.1	Very high	88.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135.2	177.3	-51.9	-98.5	0	0	0	109.5	F147 P150 F364 K365 K382 L383 M385 V392	F147-Y394 HydrophobicContact CB-CD1 4.45Å; P150-Y394 VanDerWaalsContact CA-CE1 3.45Å; P150-Y394 HydrophobicContact CB-CD1 4.34Å; P150-Y394 HydrophobicContact CB-CE1 3.5Å; P150-Y394 HydrophobicContact CG-CE1 4.26Å; F364-Y394 HydrophobicContact CD2-CD1 4.48Å; F364-Y394 HydrophobicContact CD2-CE1 4.02Å; K365-Y394 VanDerWaalsContact O-CE1 3.23Å; K365-Y394 WeakPolarHBondContact O-CE1 3.49Å; K365-Y394 PolarHBondContact O-OH 3.01Å; K382-Y394 WeakPolarHBondContact CA-O 3.47Å; L383-Y394 HydrophobicContact CB-CD2 4.31Å; L383-Y394 HydrophobicContact CD2-CD2 4.4Å; L383-Y394 PolarHBondContact N-O 3.03Å; L383-Y394 PolarHBondContact O-N 3.31Å; M385-Y394 HydrophobicContact CB-CE2 4.02Å; M385-Y394 HydrophobicContact CE-CE2 3.87Å; M385-Y394 HydrophobicContact SD-CE2 4.12Å; M385-Y394 PolarHBondContact SD-OH 3.43Å; V392-Y394 HydrophobicContact CG1-CE2 3.85Å
395	N	90	Very high	87.5	Confident	62 Å²	62	44.3 Å²	44.3	33%	0.332	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	130.6	166.2	-63	-34.2	0	0	0	108.4	I132 F147 S148 K382	I132-N395 HydrophobicContact CD1-CB 4.18Å; F147-N395 WeakPolarHBondContact CA-O 3.37Å; S148-N395 PolarHBondContact N-O 3.4Å; S148-N395 PolarHBondContact OG-N 3.47Å; K382-N395 VanDerWaalsContact CE-OD1 3.28Å; K382-N395 WeakPolarHBondContact CE-OD1 3.44Å
396	V	92.2	Very high	86.9	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.2	177.7	-169.2	0	0	0	0	109.1	I132 I144 F147 Y376 Q381 L383 F398	I132-V396 WeakPolarHBondContact CG2-O 3.38Å; I144-V396 HydrophobicContact CD1-CG1 4.28Å; I144-V396 HydrophobicContact CG1-CG1 3.93Å; I144-V396 HydrophobicContact CG2-CG1 4.01Å; F147-V396 HydrophobicContact CD1-CG2 4.07Å; F147-V396 HydrophobicContact CE1-CB 4.37Å; F147-V396 HydrophobicContact CE1-CG1 4.07Å; F147-V396 HydrophobicContact CE1-CG2 3.73Å; Y376-V396 HydrophobicContact CD2-CG2 4.25Å; Y376-V396 HydrophobicContact CE2-CG2 4.15Å; Q381-V396 WeakPolarHBondContact O-CG2 3.31Å; Q381-V396 PolarHBondContact O-N 3.49Å; L383-V396 HydrophobicContact CB-CG2 4.27Å; V396-F398 HydrophobicContact CB-CE2 4.25Å; V396-F398 HydrophobicContact CB-CZ 4Å; V396-F398 HydrophobicContact CG1-CD1 4.3Å; V396-F398 HydrophobicContact CG1-CE1 3.65Å; V396-F398 HydrophobicContact CG1-CE2 4.11Å; V396-F398 HydrophobicContact CG1-CZ 3.54Å
397	K	90.9	Very high	86.4	Confident	87 Å²	87	50.2 Å²	50.2	38%	0.378	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.5	173.1	-166.7	174.4	-178.7	175.4	0	109	I132 L145 S146	I132-K397 HydrophobicContact CD1-CB 3.85Å; I132-K397 HydrophobicContact CD1-CD 4.26Å; I132-K397 HydrophobicContact CD1-CG 4.27Å; I132-K397 HydrophobicContact CG1-CB 4.29Å; I132-K397 HydrophobicContact CG1-CD 4.19Å; I132-K397 HydrophobicContact CG1-CG 4.2Å; L145-K397 WeakPolarHBondContact CB-O 3.35Å; L145-K397 HydrophobicContact CD2-CD 4.03Å; L145-K397 HydrophobicContact CD2-CG 4.25Å; L145-K397 PolarHBondContact N-O 3.01Å; S146-K397 PolarHBondContact N-O 3.43Å; S146-K397 WeakPolarHBondContact O-CB 3.49Å; S146-K397 PolarHBondContact O-N 3.19Å
398	F	92	Very high	86.5	Confident	31 Å²	31	53.8 Å²	53.8	14%	0.136	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	153.5	177.2	-59.3	-72.6	0	0	0	112	H141 G143 I144 V329 Y376 Q381 V396	H141-F398 HydrophobicContact CB-CB 3.77Å; H141-F398 AromaticContact CD2-CD1 3.67Å; H141-F398 AromaticContact CD2-CD2 3.99Å; H141-F398 AromaticContact CD2-CG 3.49Å; H141-F398 VanDerWaalsContact CD2-CG 3.49Å; H141-F398 WeakPolarHBondContact CD2-CG 3.49Å; H141-F398 AromaticContact CE1-CD1 3.74Å; H141-F398 AromaticContact CG-CD1 3.99Å; H141-F398 AromaticContact CG-CG 3.95Å; H141-F398 AromaticContact NE2-CD1 3.5Å; H141-F398 AromaticContact NE2-CE1 3.73Å; H141-F398 AromaticContact NE2-CG 3.78Å; G143-F398 WeakPolarHBondContact O-CA 3.45Å; I144-F398 HydrophobicContact CG1-CD1 4.09Å; I144-F398 HydrophobicContact CG1-CE1 3.76Å; V329-F398 HydrophobicContact CG1-CE1 3.62Å; V329-F398 HydrophobicContact CG1-CZ 3.73Å; Y376-F398 HydrophobicContact CE2-CZ 4.32Å; Q381-F398 HydrophobicContact CB-CE2 4.23Å; Q381-F398 HydrophobicContact CG-CE2 4.49Å; V396-F398 HydrophobicContact CB-CE2 4.25Å; V396-F398 HydrophobicContact CB-CZ 4Å; V396-F398 HydrophobicContact CG1-CD1 4.3Å; V396-F398 HydrophobicContact CG1-CE1 3.65Å; V396-F398 HydrophobicContact CG1-CE2 4.11Å; V396-F398 HydrophobicContact CG1-CZ 3.54Å
399	N	88.1	Confident	86.9	Confident	49 Å²	49	54 Å²	54	26%	0.262	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-65.7	136.3	168.7	-73.1	-47.1	0	0	0	110	H141 T142 G143 L145	H141-N399 WeakPolarHBondContact CA-O 3.29Å; H141-N399 WeakPolarHBondContact CB-O 3.38Å; T142-N399 WeakPolarHBondContact OG1-CB 3.49Å; G143-N399 PolarHBondContact O-N 3.02Å; L145-N399 WeakPolarHBondContact CB-OD1 3.26Å; L145-N399 WeakPolarHBondContact CD1-OD1 3.5Å
400	K	81.2	Confident	87.4	Confident	197 Å²	197	58.5 Å²	58.5	86%	0.857	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-80.1	143.8	167.8	-62.8	-176	179.1	-176.7	0	108.7
401	E	60.1	Low	87.6	Confident	201 Å²	201	57.4 Å²	57.4	94%	0.939	27%	0.266	S	S	*	.			trans	-63.3	0	165.1	-75.5	-171.7	160.7	0	0	112.1	T142	T142-E401 HydrophobicContact CG2-CG 4.41Å

Retrieved 401 of 401 residues in 149 ms (Link to these results)

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