A0A087X5Z6_POEFO Loading...

LLGL scribble cell polarity complex component 2

AlphaFold DB , UniProt , Accession A0A087X5Z6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 703 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	85.1	Confident	90.3	Very high	95 Å²	95	91.7 Å²	91.7	47%	0.468	50%	0.504	S	S	.	.				0	150.4	0	-67	-49.6	166.7	0	0	110.9	R3 Y6 C11 A22 P183 F185	M1-R3 PolarHBondContact O-N 2.96Å; M1-R3 VanDerWaalsContact O-N 3.11Å; M1-Y6 WeakPolarHBondContact CB-O 3.35Å; M1-C11 HydrophobicContact CE-CB 3.43Å; M1-C11 VanDerWaalsContact CE-CB 3.43Å; M1-C11 HydrophobicContact CG-CB 4.49Å; M1-A22 HydrophobicContact CE-CB 3.78Å; M1-P183 HydrophobicContact SD-CB 4.37Å; M1-P183 HydrophobicContact SD-CG 4.06Å; M1-F185 HydrophobicContact CE-CE1 4Å; M1-F185 HydrophobicContact SD-CE1 3.99Å; M1-F185 HydrophobicContact SD-CZ 4.15Å
2	P	86.8	Confident	90.9	Very high	66 Å²	66	85.5 Å²	85.5	43%	0.429	47%	0.469	S	S	.	.			trans	-53.9	113.3	173	-24.9	33	0	0	0	111.1	A4 S5 Y6	P2-A4 PolarHBondContact O-N 2.95Å; P2-A4 VanDerWaalsContact O-N 3.16Å; P2-S5 PolarHBondContact O-N 2.79Å; P2-Y6 HydrophobicContact CB-CD2 4.19Å; P2-Y6 HydrophobicContact CG-CD2 4.05Å; P2-Y6 PolarHBondContact O-N 2.8Å
3	R	88.8	Confident	91.3	Very high	233 Å²	233	83.6 Å²	83.6	88%	0.879	46%	0.462	S	S	*	.	H	α-helix	trans	-58.5	-33.8	-169.8	-174.2	179.9	-72.3	179.7	-2.2	113.4	M1	M1-R3 PolarHBondContact O-N 2.96Å; M1-R3 VanDerWaalsContact O-N 3.11Å
4	A	89.8	Confident	91.6	Very high	105 Å²	105	79.4 Å²	79.4	87%	0.868	44%	0.44	S	S	*	.	H	α-helix	trans	-73.9	-32.4	-177	0	0	0	0	0	113.6	P2	P2-A4 PolarHBondContact O-N 2.95Å; P2-A4 VanDerWaalsContact O-N 3.16Å
5	S	88.6	Confident	91.8	Very high	80 Å²	80	82 Å²	82	56%	0.559	45%	0.451	S	S	*	.	H	α-helix	trans	-108.5	-26	-171.2	-54.1	0	0	0	0	113.5	P2	P2-S5 PolarHBondContact O-N 2.79Å
6	Y	91.3	Very high	91.8	Very high	54 Å²	54	85.9 Å²	85.9	21%	0.212	46%	0.458	C	S	.	.	H	α-helix	trans	-145.1	31.4	-169.3	-53.4	-70.5	0	0	0	111.7	M1 P2 D8 R9 F185	M1-Y6 WeakPolarHBondContact CB-O 3.35Å; P2-Y6 HydrophobicContact CB-CD2 4.19Å; P2-Y6 HydrophobicContact CG-CD2 4.05Å; P2-Y6 PolarHBondContact O-N 2.8Å; Y6-D8 PolarHBondContact O-N 2.94Å; Y6-R9 HydrophobicContact CD1-CG 4.24Å; Y6-R9 PolarHBondContact O-N 2.82Å; Y6-F185 AromaticContact CD1-CE2 3.69Å; Y6-F185 HydrophobicContact CD1-CE2 3.69Å; Y6-F185 AromaticContact CD1-CZ 3.76Å; Y6-F185 HydrophobicContact CD1-CZ 3.76Å; Y6-F185 HydrophobicContact CD2-CE2 4.31Å; Y6-F185 HydrophobicContact CD2-CZ 4.18Å; Y6-F185 HydrophobicContact CE1-CD2 4.5Å; Y6-F185 AromaticContact CE1-CE2 3.55Å; Y6-F185 HydrophobicContact CE1-CE2 3.55Å; Y6-F185 HydrophobicContact CE1-CZ 4.12Å; Y6-F185 HydrophobicContact CE2-CE2 4.2Å; Y6-F185 HydrophobicContact CG-CE2 4.06Å; Y6-F185 AromaticContact CG-CZ 3.78Å; Y6-F185 HydrophobicContact CG-CZ 3.78Å; Y6-F185 AromaticContact CZ-CE2 3.83Å
7	G	89.4	Confident	91.7	Very high	58 Å²	58	87.4 Å²	87.4	60%	0.598	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-16.1	-178.4	0	0	0	0	0	114.1
8	D	89.8	Confident	91.6	Very high	119 Å²	119	93.8 Å²	93.8	64%	0.636	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-14.3	178.8	59.9	-31.7	0	0	0	113.6	Y6	Y6-D8 PolarHBondContact O-N 2.94Å
9	R	91.9	Very high	91.5	Very high	107 Å²	107	92.9 Å²	92.9	40%	0.404	50%	0.498	S	S	.	.			trans	-74.1	141.6	179.9	-65.3	-80.3	-177.6	151.3	5.9	111.8	Y6 D24	Y6-R9 HydrophobicContact CD1-CG 4.24Å; Y6-R9 PolarHBondContact O-N 2.82Å; R9-D24 WeakPolarHBondContact CD-OD1 3.49Å; R9-D24 WeakPolarHBondContact CD-OD2 3.43Å; R9-D24 IonicContact CZ-OD2 2.76Å; R9-D24 IonicContact NE-OD2 2.86Å; R9-D24 IonicContact NH1-OD2 2.99Å; R9-D24 PolarHBondContact NH1-OD2 3.19Å
10	H	95.4	Very high	91.6	Very high	62 Å²	62	91.7 Å²	91.7	29%	0.287	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	102	176.7	-59.8	-46.9	0	0	0	108.4	F25 S27 R28 I29	H10-F25 HydrophobicContact CB-CB 4.39Å; H10-F25 WeakPolarHBondContact O-CD2 3.11Å; H10-F25 PolarHBondContact O-N 3.18Å; H10-S27 WeakPolarHBondContact CB-O 3.38Å; H10-S27 PolarHBondContact CD2-O 3.43Å; H10-S27 VanDerWaalsContact CD2-O 3.23Å; H10-R28 PolarHBondContact CD2-N 2.86Å; H10-I29 HydrophobicContact CB-CD1 4.33Å; H10-I29 HydrophobicContact CB-CG1 4.35Å
11	C	96.5	Very high	91.8	Very high	30 Å²	30	88.4 Å²	88.4	20%	0.203	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.1	-171.3	-43	0	0	0	0	115	M1 F23 D24	M1-C11 HydrophobicContact CE-CB 3.43Å; M1-C11 VanDerWaalsContact CE-CB 3.43Å; M1-C11 HydrophobicContact CG-CB 4.49Å; C11-F23 CarbonylContact C-O 3.56Å; C11-F23 WeakPolarHBondContact CA-O 3.39Å; C11-F23 WeakPolarHBondContact CB-O 3.19Å; C11-D24 PolarHBondContact SG-OD1 3.27Å
12	I	97.1	Very high	92.3	Very high	17 Å²	17	83.9 Å²	83.9	9%	0.087	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.6	164.7	-61.7	178.6	0	0	0	107.9	F23 F25 I29 F32 L48 V50	I12-F23 PolarHBondContact N-O 3.2Å; I12-F23 PolarHBondContact O-N 3.47Å; I12-F25 HydrophobicContact CB-CE2 4.3Å; I12-F25 HydrophobicContact CD1-CE2 4.29Å; I12-F25 HydrophobicContact CG1-CE2 4.14Å; I12-I29 HydrophobicContact CD1-CD1 4.22Å; I12-I29 HydrophobicContact CD1-CG2 4.36Å; I12-I29 HydrophobicContact CG1-CD1 3.68Å; I12-F32 HydrophobicContact CD1-CB 3.77Å; I12-F32 HydrophobicContact CD1-CD1 3.67Å; I12-F32 HydrophobicContact CD1-CD2 4.04Å; I12-F32 HydrophobicContact CD1-CE1 4.25Å; I12-F32 HydrophobicContact CD1-CG 3.54Å; I12-L48 HydrophobicContact CG2-CD2 4.03Å; I12-V50 HydrophobicContact CD1-CB 4.33Å; I12-V50 HydrophobicContact CD1-CG1 3.61Å; I12-V50 HydrophobicContact CD1-CG2 3.74Å
13	T	96.3	Very high	92.8	Very high	61 Å²	61	80.8 Å²	80.8	37%	0.374	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.5	178.1	-54.7	0	0	0	0	110.3	I15 Q20 V21	T13-I15 HydrophobicContact CG2-CD1 4.43Å; T13-I15 HydrophobicContact CG2-CG1 4.02Å; T13-Q20 HydrophobicContact CG2-CG 3.96Å; T13-V21 WeakPolarHBondContact CA-O 3.36Å
14	V	96.3	Very high	93.1	Very high	25 Å²	25	70.2 Å²	70.2	15%	0.152	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.9	170.4	179.7	0	0	0	0	108.5	Q20 V21 F23 L48 L61 W66	V14-Q20 WeakPolarHBondContact O-CA 3.16Å; V14-V21 PolarHBondContact N-O 3.21Å; V14-V21 PolarHBondContact O-N 2.96Å; V14-V21 VanDerWaalsContact O-N 3.07Å; V14-F23 HydrophobicContact CB-CE2 4.15Å; V14-F23 HydrophobicContact CG2-CD2 4.11Å; V14-F23 HydrophobicContact CG2-CE2 3.67Å; V14-L48 HydrophobicContact CG2-CD2 3.86Å; V14-L61 HydrophobicContact CG1-CD2 4.35Å; V14-W66 HydrophobicContact CB-CE3 4.47Å; V14-W66 HydrophobicContact CB-CH2 4.18Å; V14-W66 HydrophobicContact CB-CZ3 3.91Å; V14-W66 HydrophobicContact CG1-CE3 4.49Å; V14-W66 HydrophobicContact CG1-CH2 3.71Å; V14-W66 HydrophobicContact CG1-CZ2 4.09Å; V14-W66 HydrophobicContact CG1-CZ3 3.92Å
15	I	94.5	Very high	93.4	Very high	118 Å²	118	65.4 Å²	65.4	61%	0.605	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.2	176.6	-54.9	175.1	0	0	0	107	T13 Q20	T13-I15 HydrophobicContact CG2-CD1 4.43Å; T13-I15 HydrophobicContact CG2-CG1 4.02Å; I15-Q20 HydrophobicContact CG1-CB 4.4Å; I15-Q20 HydrophobicContact CG1-CG 3.99Å
16	Y	91.8	Very high	93.6	Very high	145 Å²	145	63.5 Å²	63.5	57%	0.569	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	124.1	175.8	-178.4	-104.2	0	0	0	110	K18 T19	Y16-K18 PolarHBondContact O-N 3.11Å; Y16-K18 VanDerWaalsContact O-N 3.12Å; Y16-T19 PolarHBondContact N-O 3.42Å; Y16-T19 PolarHBondContact O-N 3.37Å
17	S	90.2	Very high	93.7	Very high	111 Å²	111	61.3 Å²	61.3	78%	0.776	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	-114.7	-172.9	-174.4	0	0	0	0	111.3
18	K	89.4	Confident	94.1	Very high	203 Å²	203	64.7 Å²	64.7	88%	0.883	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-5.1	178.1	-64.6	-179.6	-179.6	178.5	0	113.7	Y16	Y16-K18 PolarHBondContact O-N 3.11Å; Y16-K18 VanDerWaalsContact O-N 3.12Å
19	T	90.1	Very high	94.5	Very high	77 Å²	77	61.2 Å²	61.2	47%	0.472	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128.1	-175.5	-51.4	0	0	0	0	109.7	Y16 V21 W66	Y16-T19 PolarHBondContact N-O 3.42Å; Y16-T19 PolarHBondContact O-N 3.37Å; T19-V21 HydrophobicContact CG2-CG2 4.37Å; T19-W66 HydrophobicContact CG2-CH2 3.69Å; T19-W66 HydrophobicContact CG2-CZ2 4.09Å; T19-W66 HydrophobicContact CG2-CZ3 3.99Å
20	Q	93.7	Very high	94.8	Very high	67 Å²	67	60.7 Å²	60.7	31%	0.313	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.3	174.3	175.2	175.9	-4.6	0	0	109.2	T13 V14 I15 P184	T13-Q20 HydrophobicContact CG2-CG 3.96Å; V14-Q20 WeakPolarHBondContact O-CA 3.16Å; I15-Q20 HydrophobicContact CG1-CB 4.4Å; I15-Q20 HydrophobicContact CG1-CG 3.99Å; Q20-P184 HydrophobicContact CB-CG 4.47Å; Q20-P184 HydrophobicContact CG-CG 3.9Å; Q20-P184 WeakPolarHBondContact O-CG 3.38Å
21	V	95.1	Very high	94.9	Very high	23 Å²	23	62.6 Å²	62.6	14%	0.139	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.5	174.5	-177.2	0	0	0	0	109.1	T13 V14 T19 F23 W66 R186	T13-V21 WeakPolarHBondContact CA-O 3.36Å; V14-V21 PolarHBondContact N-O 3.21Å; V14-V21 PolarHBondContact O-N 2.96Å; V14-V21 VanDerWaalsContact O-N 3.07Å; T19-V21 HydrophobicContact CG2-CG2 4.37Å; V21-F23 HydrophobicContact CB-CE1 4.15Å; V21-F23 HydrophobicContact CB-CZ 4.31Å; V21-F23 HydrophobicContact CG1-CD1 3.69Å; V21-F23 HydrophobicContact CG1-CE1 3.5Å; V21-F23 HydrophobicContact CG1-CG 4.41Å; V21-F23 HydrophobicContact CG1-CZ 4.15Å; V21-W66 HydrophobicContact CB-CE3 3.93Å; V21-W66 HydrophobicContact CB-CZ3 3.71Å; V21-W66 HydrophobicContact CG2-CE3 3.68Å; V21-W66 HydrophobicContact CG2-CZ3 3.52Å; V21-R186 HydrophobicContact CG1-CB 3.62Å
22	A	95.8	Very high	94.9	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	94.7	168.5	0	0	0	0	0	108.7	M1 D24 P184 F185 R186	M1-A22 HydrophobicContact CE-CB 3.78Å; A22-D24 PolarHBondContact O-N 2.94Å; A22-P184 PolarHBondContact N-O 3.16Å; A22-F185 HydrophobicContact CB-CD1 3.99Å; A22-F185 HydrophobicContact CB-CE1 4.35Å; A22-F185 WeakPolarHBondContact O-CA 3.33Å; A22-R186 PolarHBondContact O-N 2.92Å
23	F	96.7	Very high	94.9	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	121.5	174.8	-62.6	-54.1	0	0	0	109.3	C11 I12 V14 V21 F25 L48 I59 W66 R186 V188	C11-F23 CarbonylContact C-O 3.56Å; C11-F23 WeakPolarHBondContact CA-O 3.39Å; C11-F23 WeakPolarHBondContact CB-O 3.19Å; I12-F23 PolarHBondContact N-O 3.2Å; I12-F23 PolarHBondContact O-N 3.47Å; V14-F23 HydrophobicContact CB-CE2 4.15Å; V14-F23 HydrophobicContact CG2-CD2 4.11Å; V14-F23 HydrophobicContact CG2-CE2 3.67Å; V21-F23 HydrophobicContact CB-CE1 4.15Å; V21-F23 HydrophobicContact CB-CZ 4.31Å; V21-F23 HydrophobicContact CG1-CD1 3.69Å; V21-F23 HydrophobicContact CG1-CE1 3.5Å; V21-F23 HydrophobicContact CG1-CG 4.41Å; V21-F23 HydrophobicContact CG1-CZ 4.15Å; F23-F25 HydrophobicContact CB-CE2 3.98Å; F23-F25 HydrophobicContact CB-CZ 4.08Å; F23-L48 HydrophobicContact CD2-CD2 4.13Å; F23-L48 HydrophobicContact CE2-CD2 4.25Å; F23-I59 HydrophobicContact CB-CD1 4.32Å; F23-I59 HydrophobicContact CD1-CD1 3.87Å; F23-I59 HydrophobicContact CD2-CD1 3.51Å; F23-I59 HydrophobicContact CE1-CD1 4.02Å; F23-I59 HydrophobicContact CE1-CG2 4.48Å; F23-I59 HydrophobicContact CE2-CD1 3.63Å; F23-I59 HydrophobicContact CE2-CG2 4.14Å; F23-I59 HydrophobicContact CG-CD1 3.62Å; F23-I59 HydrophobicContact CZ-CD1 3.87Å; F23-I59 HydrophobicContact CZ-CG2 3.82Å; F23-W66 HydrophobicContact CE2-CE3 4.33Å; F23-W66 HydrophobicContact CZ-CB 4.01Å; F23-W66 HydrophobicContact CZ-CD2 4.35Å; F23-W66 AromaticContact CZ-CE3 3.68Å; F23-W66 HydrophobicContact CZ-CE3 3.68Å; F23-R186 WeakPolarHBondContact CA-O 3.37Å; F23-R186 HydrophobicContact CD1-CB 4.39Å; F23-V188 HydrophobicContact CB-CG2 3.89Å; F23-V188 HydrophobicContact CD1-CG1 3.73Å; F23-V188 HydrophobicContact CE1-CG1 4.43Å; F23-V188 HydrophobicContact CG-CG1 4.45Å
24	D	95.3	Very high	94.9	Very high	11 Å²	11	70.8 Å²	70.8	6%	0.059	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.2	-177.6	-173.8	45.4	0	0	0	110.3	R9 C11 A22 F185 R186 K187 V188	R9-D24 WeakPolarHBondContact CD-OD1 3.49Å; R9-D24 WeakPolarHBondContact CD-OD2 3.43Å; R9-D24 IonicContact CZ-OD2 2.76Å; R9-D24 IonicContact NE-OD2 2.86Å; R9-D24 IonicContact NH1-OD2 2.99Å; R9-D24 PolarHBondContact NH1-OD2 3.19Å; C11-D24 PolarHBondContact SG-OD1 3.27Å; A22-D24 PolarHBondContact O-N 2.94Å; D24-F185 HydrophobicContact CB-CD1 4.31Å; D24-R186 PolarHBondContact N-O 2.62Å; D24-K187 WeakPolarHBondContact O-CA 3.31Å; D24-V188 PolarHBondContact O-N 3.38Å
25	F	95.4	Very high	94.7	Very high	4 Å²	4	70.5 Å²	70.5	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	145.7	-175.7	-58.3	-89.3	0	0	0	110	H10 I12 F23 S27 I29 V50 V52 V57 V188	H10-F25 HydrophobicContact CB-CB 4.39Å; H10-F25 WeakPolarHBondContact O-CD2 3.11Å; H10-F25 PolarHBondContact O-N 3.18Å; I12-F25 HydrophobicContact CB-CE2 4.3Å; I12-F25 HydrophobicContact CD1-CE2 4.29Å; I12-F25 HydrophobicContact CG1-CE2 4.14Å; F23-F25 HydrophobicContact CB-CE2 3.98Å; F23-F25 HydrophobicContact CB-CZ 4.08Å; F25-S27 PolarHBondContact O-N 3.45Å; F25-I29 HydrophobicContact CD2-CD1 4.07Å; F25-I29 HydrophobicContact CD2-CG1 4.04Å; F25-I29 HydrophobicContact CE2-CD1 4.41Å; F25-V50 HydrophobicContact CE1-CB 4.1Å; F25-V50 HydrophobicContact CE1-CG1 3.97Å; F25-V50 HydrophobicContact CE1-CG2 4.42Å; F25-V50 HydrophobicContact CE2-CG1 4.12Å; F25-V50 HydrophobicContact CZ-CB 3.95Å; F25-V50 HydrophobicContact CZ-CG1 3.72Å; F25-V50 HydrophobicContact CZ-CG2 3.86Å; F25-V52 HydrophobicContact CB-CG1 3.96Å; F25-V52 HydrophobicContact CD1-CG1 3.7Å; F25-V52 HydrophobicContact CD2-CG1 4.43Å; F25-V52 HydrophobicContact CE1-CG1 4.33Å; F25-V52 HydrophobicContact CG-CG1 3.77Å; F25-V57 HydrophobicContact CD1-CG2 4.13Å; F25-V57 HydrophobicContact CE1-CB 3.88Å; F25-V57 HydrophobicContact CE1-CG1 4.1Å; F25-V57 HydrophobicContact CE1-CG2 3.94Å; F25-V188 HydrophobicContact CD1-CG2 3.66Å; F25-V188 HydrophobicContact CE1-CG2 3.32Å; F25-V188 HydrophobicContact CE2-CG2 4.26Å; F25-V188 HydrophobicContact CG-CG2 4.27Å; F25-V188 HydrophobicContact CZ-CG2 3.64Å
26	T	93.1	Very high	94.5	Very high	40 Å²	40	70.6 Å²	70.6	25%	0.245	34%	0.344	C	S	.	.	S	Bend	trans	-77.3	-11.5	-179.2	52.3	0	0	0	0	113.6	F191	T26-F191 WeakPolarHBondContact CB-O 3.42Å; T26-F191 WeakPolarHBondContact CG2-O 3.43Å; T26-F191 PolarHBondContact OG1-O 2.83Å
27	S	94.6	Very high	94.1	Very high	8 Å²	8	67.1 Å²	67.1	6%	0.056	34%	0.335	C	S	.	.	S	Bend	trans	-135.1	166.4	179.2	66.7	0	0	0	0	111.7	H10 F25 I29 V52 E54	H10-S27 WeakPolarHBondContact CB-O 3.38Å; H10-S27 PolarHBondContact CD2-O 3.43Å; H10-S27 VanDerWaalsContact CD2-O 3.23Å; F25-S27 PolarHBondContact O-N 3.45Å; S27-I29 PolarHBondContact O-N 2.84Å; S27-V52 WeakPolarHBondContact OG-CB 3.39Å; S27-V52 VanDerWaalsContact OG-CG2 3.24Å; S27-V52 WeakPolarHBondContact OG-CG2 3.4Å; S27-E54 PolarHBondContact OG-N 2.69Å
28	R	96.8	Very high	93.2	Very high	129 Å²	129	64.1 Å²	64.1	49%	0.487	32%	0.321	S	S	.	.			trans	-65.1	134.3	-172.1	-164.8	-172.6	-49.6	112.1	22.4	110.8	H10 I30 V52 E53	H10-R28 PolarHBondContact CD2-N 2.86Å; R28-I30 PolarHBondContact O-N 3.27Å; R28-V52 CarbonylContact O-C 3.51Å; R28-V52 VanDerWaalsContact O-CA 3.31Å; R28-V52 WeakPolarHBondContact O-CA 3.44Å; R28-E53 HydrophobicContact CB-CB 4.38Å; R28-E53 IonicContact CZ-OE1 3.54Å; R28-E53 IonicContact CZ-OE2 3.34Å; R28-E53 IonicContact NH1-OE1 2.96Å; R28-E53 PolarHBondContact NH1-OE1 3.01Å; R28-E53 IonicContact NH1-OE2 3.47Å; R28-E53 PolarHBondContact NH1-OE2 3.06Å; R28-E53 IonicContact NH2-OE1 3.54Å; R28-E53 PolarHBondContact NH2-OE1 3.49Å; R28-E53 IonicContact NH2-OE2 2.74Å; R28-E53 PolarHBondContact NH2-OE2 3.37Å; R28-E53 PolarHBondContact O-N 2.78Å
29	I	97.8	Very high	92.1	Very high	46 Å²	46	59.9 Å²	59.9	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.5	171.9	-61.4	155.6	0	0	0	109.3	H10 I12 F25 S27 F32 V50 V52	H10-I29 HydrophobicContact CB-CD1 4.33Å; H10-I29 HydrophobicContact CB-CG1 4.35Å; I12-I29 HydrophobicContact CD1-CD1 4.22Å; I12-I29 HydrophobicContact CD1-CG2 4.36Å; I12-I29 HydrophobicContact CG1-CD1 3.68Å; F25-I29 HydrophobicContact CD2-CD1 4.07Å; F25-I29 HydrophobicContact CD2-CG1 4.04Å; F25-I29 HydrophobicContact CE2-CD1 4.41Å; S27-I29 PolarHBondContact O-N 2.84Å; I29-F32 HydrophobicContact CG2-CD1 4.4Å; I29-V50 HydrophobicContact CG2-CG1 4.33Å; I29-V52 HydrophobicContact CG1-CG1 4.04Å
30	I	98.2	Very high	91	Very high	96 Å²	96	64.4 Å²	64.4	49%	0.492	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-53.4	176.6	-56	-58.3	0	0	0	109.6	R28 L51 E53	R28-I30 PolarHBondContact O-N 3.27Å; I30-L51 HydrophobicContact CB-CD2 4.36Å; I30-L51 HydrophobicContact CB-CG 4.23Å; I30-L51 WeakPolarHBondContact CB-O 3.42Å; I30-L51 HydrophobicContact CG2-CD2 4.24Å; I30-L51 PolarHBondContact N-O 2.92Å; I30-E53 HydrophobicContact CD1-CB 4.21Å; I30-E53 HydrophobicContact CG1-CB 4.46Å
31	D	98.1	Very high	90.1	Very high	103 Å²	103	67.6 Å²	67.6	55%	0.551	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-158	162.3	178.3	-159.5	6.6	0	0	0	111.1	L51	D31-L51 PolarHBondContact N-O 2.8Å; D31-L51 PolarHBondContact O-N 3.38Å
32	F	97.8	Very high	89.1	Confident	103 Å²	103	71.4 Å²	71.4	45%	0.452	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	152	173.9	71.2	-83.1	0	0	0	112	I12 I29 L48 V49 V50	I12-F32 HydrophobicContact CD1-CB 3.77Å; I12-F32 HydrophobicContact CD1-CD1 3.67Å; I12-F32 HydrophobicContact CD1-CD2 4.04Å; I12-F32 HydrophobicContact CD1-CE1 4.25Å; I12-F32 HydrophobicContact CD1-CG 3.54Å; I29-F32 HydrophobicContact CG2-CD1 4.4Å; F32-L48 HydrophobicContact CB-CD1 4.45Å; F32-L48 HydrophobicContact CD2-CD1 3.81Å; F32-V49 CarbonylContact C-O 3.55Å; F32-V49 WeakPolarHBondContact CA-O 3.15Å; F32-V49 WeakPolarHBondContact CB-O 3.24Å; F32-V50 HydrophobicContact CB-CB 4.35Å; F32-V50 HydrophobicContact CB-CG1 4.21Å; F32-V50 HydrophobicContact CB-CG2 4.15Å
33	F	96.4	Very high	88.5	Confident	107 Å²	107	72.5 Å²	72.5	47%	0.469	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.4	173.1	66.7	-86.1	0	0	0	111.2	T35 V49 I117	F33-T35 HydrophobicContact CD2-CG2 4.26Å; F33-T35 HydrophobicContact CE2-CG2 3.73Å; F33-V49 HydrophobicContact CD1-CB 4.11Å; F33-V49 HydrophobicContact CD1-CG1 4.3Å; F33-V49 HydrophobicContact CD2-CB 4.4Å; F33-V49 HydrophobicContact CE1-CB 3.71Å; F33-V49 HydrophobicContact CE1-CG1 3.55Å; F33-V49 HydrophobicContact CE1-CG2 4.36Å; F33-V49 HydrophobicContact CE2-CB 4.02Å; F33-V49 HydrophobicContact CE2-CG2 3.89Å; F33-V49 HydrophobicContact CG-CB 4.44Å; F33-V49 HydrophobicContact CZ-CB 3.66Å; F33-V49 HydrophobicContact CZ-CG1 3.7Å; F33-V49 HydrophobicContact CZ-CG2 3.79Å; F33-V49 PolarHBondContact N-O 3.26Å; F33-V49 PolarHBondContact O-N 3.3Å; F33-I117 HydrophobicContact CZ-CD1 4.18Å
34	V	95.4	Very high	88	Confident	69 Å²	69	78.3 Å²	78.3	42%	0.418	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.9	-179.6	176.1	0	0	0	0	108.8	P45 A47 L48 L61	V34-P45 HydrophobicContact CG1-CB 3.76Å; V34-P45 HydrophobicContact CG1-CG 4.48Å; V34-A47 CarbonylContact C-O 3.47Å; V34-A47 WeakPolarHBondContact CA-O 3.08Å; V34-L48 HydrophobicContact CG2-CD1 3.89Å; V34-L61 HydrophobicContact CG1-CD1 4.03Å
35	T	92.6	Very high	87.9	Confident	20 Å²	20	79.8 Å²	79.8	12%	0.123	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	149.7	170	62.4	0	0	0	0	109.7	F33 S46 A47 V49	F33-T35 HydrophobicContact CD2-CG2 4.26Å; F33-T35 HydrophobicContact CE2-CG2 3.73Å; T35-S46 PolarHBondContact O-N 2.94Å; T35-S46 PolarHBondContact O-OG 2.86Å; T35-S46 PolarHBondContact OG1-OG 2.84Å; T35-A47 PolarHBondContact N-O 2.86Å; T35-A47 WeakPolarHBondContact OG1-CB 3.44Å; T35-A47 PolarHBondContact OG1-N 2.89Å; T35-A47 VanDerWaalsContact OG1-N 3.09Å; T35-A47 PolarHBondContact OG1-O 3.07Å; T35-V49 HydrophobicContact CG2-CG2 4.3Å
36	R	90.4	Very high	87.8	Confident	120 Å²	120	80.1 Å²	80.1	45%	0.453	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.3	177.1	-71.5	176.4	164	-123.2	2.5	109.9	H41 G43 E44	R36-H41 HydrophobicContact CB-CB 4.21Å; R36-H41 WeakPolarHBondContact CB-O 3.27Å; R36-H41 WeakPolarHBondContact CD-O 2.98Å; R36-H41 PolarHBondContact O-ND1 3.23Å; R36-G43 PolarHBondContact NH1-O 2.89Å; R36-E44 WeakPolarHBondContact CA-O 3.34Å
37	D	83	Confident	87.9	Confident	72 Å²	72	78.3 Å²	78.3	39%	0.385	41%	0.409	S	S	.	.			trans	-72	162.5	176.3	-83.4	-3.1	0	0	0	112.6	G43 E44 S46 Q62	D37-G43 WeakPolarHBondContact O-CA 3.42Å; D37-G43 PolarHBondContact O-N 3Å; D37-E44 PolarHBondContact N-O 3.4Å; D37-S46 WeakPolarHBondContact OD1-CB 3.16Å; D37-S46 PolarHBondContact OD1-OG 3.12Å; D37-Q62 PolarHBondContact OD2-NE2 2.98Å
38	G	71.3	Confident	88	Confident	47 Å²	47	78 Å²	78	49%	0.485	41%	0.407	S	S	.	.	S	Bend	trans	87	160.7	173.4	0	0	0	0	0	114.7	Q40 H41	G38-Q40 PolarHBondContact O-N 3.02Å; G38-H41 PolarHBondContact O-N 3.47Å
39	P	66.3	Low	88.1	Confident	114 Å²	114	72.1 Å²	72.1	74%	0.74	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-58	136.7	175	23.4	-30.9	0	0	0	110	H41	P39-H41 VanDerWaalsContact C-N 3.29Å; P39-H41 PolarHBondContact O-N 3.48Å
40	Q	68.1	Low	88.1	Confident	173 Å²	173	69.9 Å²	69.9	81%	0.808	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	66	15.8	-176.2	-50.4	-178.8	-1.2	0	0	116.3	G38 T42	G38-Q40 PolarHBondContact O-N 3.02Å; Q40-T42 VanDerWaalsContact C-N 3.27Å; Q40-T42 HydrophobicContact CB-CG2 4.24Å; Q40-T42 PolarHBondContact O-N 3.35Å
41	H	74.1	Confident	88.1	Confident	133 Å²	133	69.3 Å²	69.3	62%	0.616	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	59.5	30.9	176.3	-53.9	-63.2	0	0	0	114.5	R36 G38 P39	R36-H41 HydrophobicContact CB-CB 4.21Å; R36-H41 WeakPolarHBondContact CB-O 3.27Å; R36-H41 WeakPolarHBondContact CD-O 2.98Å; R36-H41 PolarHBondContact O-ND1 3.23Å; G38-H41 PolarHBondContact O-N 3.47Å; P39-H41 VanDerWaalsContact C-N 3.29Å; P39-H41 PolarHBondContact O-N 3.48Å
42	T	74	Confident	88.1	Confident	104 Å²	104	64.5 Å²	64.5	64%	0.638	35%	0.346	S	S	*	.			trans	-90.3	-10.5	-177.8	58	0	0	0	0	114.2	Q40	Q40-T42 VanDerWaalsContact C-N 3.27Å; Q40-T42 HydrophobicContact CB-CG2 4.24Å; Q40-T42 PolarHBondContact O-N 3.35Å
43	G	82.6	Confident	88	Confident	24 Å²	24	64 Å²	64	25%	0.247	35%	0.345	C	S	.	.	S	Bend	trans	-79.1	-164.6	-177	0	0	0	0	0	114.6	R36 D37	R36-G43 PolarHBondContact NH1-O 2.89Å; D37-G43 WeakPolarHBondContact O-CA 3.42Å; D37-G43 PolarHBondContact O-N 3Å
44	E	86.9	Confident	88	Confident	121 Å²	121	62.2 Å²	62.2	57%	0.565	34%	0.338	S	S	*	.	S	Bend	trans	-66.8	149.7	177.5	-70.3	-61.4	151.1	0	0	111.6	R36 D37 S46	R36-E44 WeakPolarHBondContact CA-O 3.34Å; D37-E44 PolarHBondContact N-O 3.4Å; E44-S46 PolarHBondContact O-N 2.87Å
45	P	92.4	Very high	88	Confident	43 Å²	43	59.6 Å²	59.6	28%	0.279	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	126.8	169.9	-27	37	0	0	0	111.8	V34 L61	V34-P45 HydrophobicContact CG1-CB 3.76Å; V34-P45 HydrophobicContact CG1-CG 4.48Å; P45-L61 HydrophobicContact CB-CD1 3.9Å
46	S	93.5	Very high	88.2	Confident	11 Å²	11	59.8 Å²	59.8	8%	0.077	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-43	-175.3	65.9	0	0	0	0	113.5	T35 D37 E44 L61 K113	T35-S46 PolarHBondContact O-N 2.94Å; T35-S46 PolarHBondContact O-OG 2.86Å; T35-S46 PolarHBondContact OG1-OG 2.84Å; D37-S46 WeakPolarHBondContact OD1-CB 3.16Å; D37-S46 PolarHBondContact OD1-OG 3.12Å; E44-S46 PolarHBondContact O-N 2.87Å; S46-L61 PolarHBondContact O-N 3.01Å; S46-K113 PolarHBondContact O-NZ 2.97Å
47	A	95.8	Very high	88.5	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	147.9	174.7	0	0	0	0	0	112	V34 T35 V58 I59 I69 P116	V34-A47 CarbonylContact C-O 3.47Å; V34-A47 WeakPolarHBondContact CA-O 3.08Å; T35-A47 PolarHBondContact N-O 2.86Å; T35-A47 WeakPolarHBondContact OG1-CB 3.44Å; T35-A47 PolarHBondContact OG1-N 2.89Å; T35-A47 VanDerWaalsContact OG1-N 3.09Å; T35-A47 PolarHBondContact OG1-O 3.07Å; A47-V58 HydrophobicContact CB-CG1 4.06Å; A47-I59 CarbonylContact C-O 3.56Å; A47-I59 WeakPolarHBondContact CA-O 3.38Å; A47-I59 WeakPolarHBondContact CB-O 3.16Å; A47-I69 HydrophobicContact CB-CD1 4.21Å; A47-P116 HydrophobicContact CB-CG 4.17Å
48	L	97.4	Very high	89.2	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.3	168.9	169.3	64.4	0	0	0	108.2	I12 V14 F23 F32 V34 V50 V58 I59 L61	I12-L48 HydrophobicContact CG2-CD2 4.03Å; V14-L48 HydrophobicContact CG2-CD2 3.86Å; F23-L48 HydrophobicContact CD2-CD2 4.13Å; F23-L48 HydrophobicContact CE2-CD2 4.25Å; F32-L48 HydrophobicContact CB-CD1 4.45Å; F32-L48 HydrophobicContact CD2-CD1 3.81Å; V34-L48 HydrophobicContact CG2-CD1 3.89Å; L48-V50 HydrophobicContact CD1-CG2 4.03Å; L48-V50 HydrophobicContact CD2-CG2 4.08Å; L48-V50 HydrophobicContact CG-CG2 3.69Å; L48-V58 CarbonylContact O-C 3.44Å; L48-V58 WeakPolarHBondContact O-CA 3.41Å; L48-I59 HydrophobicContact CB-CB 4.32Å; L48-I59 HydrophobicContact CD2-CD1 4.34Å; L48-I59 PolarHBondContact N-O 3.48Å; L48-I59 PolarHBondContact O-N 2.86Å; L48-L61 HydrophobicContact CB-CD1 4.03Å; L48-L61 HydrophobicContact CB-CD2 4.06Å; L48-L61 HydrophobicContact CB-CG 4.16Å
49	V	97.7	Very high	90.5	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.4	177.9	-178.9	0	0	0	0	108.2	F32 F33 T35 L56 V58 I117	F32-V49 CarbonylContact C-O 3.55Å; F32-V49 WeakPolarHBondContact CA-O 3.15Å; F32-V49 WeakPolarHBondContact CB-O 3.24Å; F33-V49 HydrophobicContact CD1-CB 4.11Å; F33-V49 HydrophobicContact CD1-CG1 4.3Å; F33-V49 HydrophobicContact CD2-CB 4.4Å; F33-V49 HydrophobicContact CE1-CB 3.71Å; F33-V49 HydrophobicContact CE1-CG1 3.55Å; F33-V49 HydrophobicContact CE1-CG2 4.36Å; F33-V49 HydrophobicContact CE2-CB 4.02Å; F33-V49 HydrophobicContact CE2-CG2 3.89Å; F33-V49 HydrophobicContact CG-CB 4.44Å; F33-V49 HydrophobicContact CZ-CB 3.66Å; F33-V49 HydrophobicContact CZ-CG1 3.7Å; F33-V49 HydrophobicContact CZ-CG2 3.79Å; F33-V49 PolarHBondContact N-O 3.26Å; F33-V49 PolarHBondContact O-N 3.3Å; T35-V49 HydrophobicContact CG2-CG2 4.3Å; V49-L56 HydrophobicContact CG1-CD1 3.88Å; V49-V58 HydrophobicContact CG1-CG2 4.19Å; V49-V58 HydrophobicContact CG2-CG1 4.1Å; V49-V58 HydrophobicContact CG2-CG2 4.2Å; V49-I117 HydrophobicContact CG1-CD1 4.32Å; V49-I117 HydrophobicContact CG2-CD1 4.31Å
50	V	98.3	Very high	91.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.4	-175.7	-169.5	0	0	0	0	109.5	I12 F25 I29 F32 L48 V52 V57	I12-V50 HydrophobicContact CD1-CB 4.33Å; I12-V50 HydrophobicContact CD1-CG1 3.61Å; I12-V50 HydrophobicContact CD1-CG2 3.74Å; F25-V50 HydrophobicContact CE1-CB 4.1Å; F25-V50 HydrophobicContact CE1-CG1 3.97Å; F25-V50 HydrophobicContact CE1-CG2 4.42Å; F25-V50 HydrophobicContact CE2-CG1 4.12Å; F25-V50 HydrophobicContact CZ-CB 3.95Å; F25-V50 HydrophobicContact CZ-CG1 3.72Å; F25-V50 HydrophobicContact CZ-CG2 3.86Å; I29-V50 HydrophobicContact CG2-CG1 4.33Å; F32-V50 HydrophobicContact CB-CB 4.35Å; F32-V50 HydrophobicContact CB-CG1 4.21Å; F32-V50 HydrophobicContact CB-CG2 4.15Å; L48-V50 HydrophobicContact CD1-CG2 4.03Å; L48-V50 HydrophobicContact CD2-CG2 4.08Å; L48-V50 HydrophobicContact CG-CG2 3.69Å; V50-V52 HydrophobicContact CG1-CG1 3.86Å; V50-V57 PolarHBondContact N-O 2.92Å; V50-V57 PolarHBondContact O-N 2.83Å
51	L	98.3	Very high	93.2	Very high	83 Å²	83	36.1 Å²	36.1	44%	0.435	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	116.1	169.3	179.6	64.6	0	0	0	108.6	I30 D31 L56	I30-L51 HydrophobicContact CB-CD2 4.36Å; I30-L51 HydrophobicContact CB-CG 4.23Å; I30-L51 WeakPolarHBondContact CB-O 3.42Å; I30-L51 HydrophobicContact CG2-CD2 4.24Å; I30-L51 PolarHBondContact N-O 2.92Å; D31-L51 PolarHBondContact N-O 2.8Å; D31-L51 PolarHBondContact O-N 3.38Å; L51-L56 HydrophobicContact CB-CD1 4.48Å
52	V	97.1	Very high	94.1	Very high	3 Å²	3	34 Å²	34	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	166.8	170.9	-57.4	0	0	0	0	109.9	F25 S27 R28 I29 V50 E54 E55	F25-V52 HydrophobicContact CB-CG1 3.96Å; F25-V52 HydrophobicContact CD1-CG1 3.7Å; F25-V52 HydrophobicContact CD2-CG1 4.43Å; F25-V52 HydrophobicContact CE1-CG1 4.33Å; F25-V52 HydrophobicContact CG-CG1 3.77Å; S27-V52 WeakPolarHBondContact OG-CB 3.39Å; S27-V52 VanDerWaalsContact OG-CG2 3.24Å; S27-V52 WeakPolarHBondContact OG-CG2 3.4Å; R28-V52 CarbonylContact O-C 3.51Å; R28-V52 VanDerWaalsContact O-CA 3.31Å; R28-V52 WeakPolarHBondContact O-CA 3.44Å; I29-V52 HydrophobicContact CG1-CG1 4.04Å; V50-V52 HydrophobicContact CG1-CG1 3.86Å; V52-E54 PolarHBondContact O-N 3.3Å; V52-E54 VanDerWaalsContact O-N 3.09Å; V52-E55 HydrophobicContact CG2-CB 4.31Å; V52-E55 HydrophobicContact CG2-CG 3.4Å; V52-E55 VanDerWaalsContact CG2-CG 3.4Å; V52-E55 WeakPolarHBondContact CG2-O 3.33Å; V52-E55 PolarHBondContact N-O 2.85Å; V52-E55 PolarHBondContact O-N 3.09Å
53	E	96.6	Very high	95.1	Very high	92 Å²	92	31.9 Å²	31.9	43%	0.43	17%	0.169	S	C	.	.	S	Bend	trans	-55.9	-30.3	-173.1	-169.4	166.3	-144.6	0	0	112.5	R28 I30	R28-E53 HydrophobicContact CB-CB 4.38Å; R28-E53 IonicContact CZ-OE1 3.54Å; R28-E53 IonicContact CZ-OE2 3.34Å; R28-E53 IonicContact NH1-OE1 2.96Å; R28-E53 PolarHBondContact NH1-OE1 3.01Å; R28-E53 IonicContact NH1-OE2 3.47Å; R28-E53 PolarHBondContact NH1-OE2 3.06Å; R28-E53 IonicContact NH2-OE1 3.54Å; R28-E53 PolarHBondContact NH2-OE1 3.49Å; R28-E53 IonicContact NH2-OE2 2.74Å; R28-E53 PolarHBondContact NH2-OE2 3.37Å; R28-E53 PolarHBondContact O-N 2.78Å; I30-E53 HydrophobicContact CD1-CB 4.21Å; I30-E53 HydrophobicContact CG1-CB 4.46Å
54	E	95.9	Very high	95.5	Very high	69 Å²	69	39.9 Å²	39.9	32%	0.322	20%	0.2	S	C	.	.	S	Bend	trans	-115.6	-10.7	-173.2	-58.3	-68.3	170.2	0	0	114.6	S27 V52 H78 F191	S27-E54 PolarHBondContact OG-N 2.69Å; V52-E54 PolarHBondContact O-N 3.3Å; V52-E54 VanDerWaalsContact O-N 3.09Å; E54-H78 PolarHBondContact O-CE1 2.87Å; E54-H78 IonicContact OE2-CD2 3.36Å; E54-H78 IonicContact OE2-CE1 3.64Å; E54-H78 IonicContact OE2-NE2 3.51Å; E54-H78 PolarHBondContact OE2-NE2 3.5Å; E54-F191 HydrophobicContact CB-CB 4.23Å; E54-F191 HydrophobicContact CB-CD1 3.65Å; E54-F191 HydrophobicContact CB-CD2 3.93Å; E54-F191 HydrophobicContact CB-CE1 3.94Å; E54-F191 HydrophobicContact CB-CE2 4.21Å; E54-F191 HydrophobicContact CB-CG 3.64Å; E54-F191 HydrophobicContact CB-CZ 4.21Å; E54-F191 HydrophobicContact CG-CD1 3.82Å; E54-F191 HydrophobicContact CG-CD2 4.46Å; E54-F191 HydrophobicContact CG-CE1 3.59Å; E54-F191 HydrophobicContact CG-CE2 4.27Å; E54-F191 HydrophobicContact CG-CG 4.26Å; E54-F191 HydrophobicContact CG-CZ 3.83Å
55	E	96.1	Very high	95.7	Very high	14 Å²	14	36.6 Å²	36.6	7%	0.065	20%	0.199	C	C	.	.			trans	-160.7	166.6	-177.7	60.7	-177.1	145.3	0	0	114.1	V52 V57 P76 G189 C190 F191	V52-E55 HydrophobicContact CG2-CB 4.31Å; V52-E55 HydrophobicContact CG2-CG 3.4Å; V52-E55 VanDerWaalsContact CG2-CG 3.4Å; V52-E55 WeakPolarHBondContact CG2-O 3.33Å; V52-E55 PolarHBondContact N-O 2.85Å; V52-E55 PolarHBondContact O-N 3.09Å; E55-V57 HydrophobicContact CG-CG2 3.99Å; E55-P76 HydrophobicContact CB-CB 3.85Å; E55-P76 HydrophobicContact CB-CG 3.8Å; E55-G189 VanDerWaalsContact OE1-CA 3.27Å; E55-G189 WeakPolarHBondContact OE1-CA 3.38Å; E55-G189 WeakPolarHBondContact OE2-CA 3.33Å; E55-C190 PolarHBondContact OE1-N 3.28Å; E55-C190 PolarHBondContact OE2-N 3.44Å; E55-F191 HydrophobicContact CG-CB 4.35Å; E55-F191 WeakPolarHBondContact OE1-CB 3.43Å; E55-F191 PolarHBondContact OE1-N 3.41Å; E55-F191 VanDerWaalsContact OE1-N 3.08Å; E55-F191 PolarHBondContact OE2-N 3.03Å
56	L	97.1	Very high	95.9	Very high	24 Å²	24	35.4 Å²	35.4	13%	0.126	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.7	169.4	-179.8	68.9	0	0	0	109.1	V49 L51 V58 T71 L74 W115	V49-L56 HydrophobicContact CG1-CD1 3.88Å; L51-L56 HydrophobicContact CB-CD1 4.48Å; L56-V58 HydrophobicContact CG-CG2 4.46Å; L56-T71 HydrophobicContact CD2-CG2 4.37Å; L56-T71 HydrophobicContact CG-CG2 4.47Å; L56-L74 HydrophobicContact CD2-CB 4.45Å; L56-L74 HydrophobicContact CD2-CD1 4.17Å; L56-W115 HydrophobicContact CD2-CH2 4.02Å; L56-W115 HydrophobicContact CD2-CZ2 4.46Å
57	V	97.3	Very high	96	Very high	3 Å²	3	36 Å²	36	2%	0.018	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.4	178.4	-175	0	0	0	0	109.5	F25 V50 E55 I59 V68 V188	F25-V57 HydrophobicContact CD1-CG2 4.13Å; F25-V57 HydrophobicContact CE1-CB 3.88Å; F25-V57 HydrophobicContact CE1-CG1 4.1Å; F25-V57 HydrophobicContact CE1-CG2 3.94Å; V50-V57 PolarHBondContact N-O 2.92Å; V50-V57 PolarHBondContact O-N 2.83Å; E55-V57 HydrophobicContact CG-CG2 3.99Å; V57-I59 HydrophobicContact CG1-CG1 4.11Å; V57-V68 HydrophobicContact CG1-CG1 4.33Å; V57-V68 HydrophobicContact CG1-CG2 4.37Å; V57-V188 HydrophobicContact CG1-CB 4.39Å; V57-V188 HydrophobicContact CG1-CG2 4.47Å
58	V	97.4	Very high	96	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.1	176.1	-175.4	0	0	0	0	109.2	A47 L48 V49 L56 V68 I69 W115 P116	A47-V58 HydrophobicContact CB-CG1 4.06Å; L48-V58 CarbonylContact O-C 3.44Å; L48-V58 WeakPolarHBondContact O-CA 3.41Å; V49-V58 HydrophobicContact CG1-CG2 4.19Å; V49-V58 HydrophobicContact CG2-CG1 4.1Å; V49-V58 HydrophobicContact CG2-CG2 4.2Å; L56-V58 HydrophobicContact CG-CG2 4.46Å; V58-V68 CarbonylContact O-C 3.56Å; V58-V68 VanDerWaalsContact O-CA 3.31Å; V58-V68 WeakPolarHBondContact O-CA 3.42Å; V58-V68 WeakPolarHBondContact O-CG1 3.36Å; V58-I69 HydrophobicContact CB-CB 4.23Å; V58-I69 HydrophobicContact CG1-CB 4.1Å; V58-I69 HydrophobicContact CG1-CD1 3.97Å; V58-I69 HydrophobicContact CG1-CG1 4.4Å; V58-I69 PolarHBondContact O-N 3.26Å; V58-W115 HydrophobicContact CB-CH2 4.46Å; V58-W115 HydrophobicContact CB-CZ3 3.99Å; V58-W115 HydrophobicContact CG1-CZ3 4.43Å; V58-W115 HydrophobicContact CG2-CH2 3.46Å; V58-W115 VanDerWaalsContact CG2-CH2 3.46Å; V58-W115 HydrophobicContact CG2-CZ3 3.47Å; V58-W115 VanDerWaalsContact CG2-CZ3 3.47Å; V58-P116 HydrophobicContact CG1-CG 4.03Å
59	I	97.6	Very high	95.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128	-175.2	-58.2	176.9	0	0	0	108.9	F23 A47 L48 V57 L61 W66 V188	F23-I59 HydrophobicContact CB-CD1 4.32Å; F23-I59 HydrophobicContact CD1-CD1 3.87Å; F23-I59 HydrophobicContact CD2-CD1 3.51Å; F23-I59 HydrophobicContact CE1-CD1 4.02Å; F23-I59 HydrophobicContact CE1-CG2 4.48Å; F23-I59 HydrophobicContact CE2-CD1 3.63Å; F23-I59 HydrophobicContact CE2-CG2 4.14Å; F23-I59 HydrophobicContact CG-CD1 3.62Å; F23-I59 HydrophobicContact CZ-CD1 3.87Å; F23-I59 HydrophobicContact CZ-CG2 3.82Å; A47-I59 CarbonylContact C-O 3.56Å; A47-I59 WeakPolarHBondContact CA-O 3.38Å; A47-I59 WeakPolarHBondContact CB-O 3.16Å; L48-I59 HydrophobicContact CB-CB 4.32Å; L48-I59 HydrophobicContact CD2-CD1 4.34Å; L48-I59 PolarHBondContact N-O 3.48Å; L48-I59 PolarHBondContact O-N 2.86Å; V57-I59 HydrophobicContact CG1-CG1 4.11Å; I59-L61 HydrophobicContact CG2-CD2 4.4Å; I59-L61 PolarHBondContact O-N 2.82Å; I59-W66 HydrophobicContact CG2-CB 3.86Å; I59-W66 WeakPolarHBondContact CG2-O 3.23Å; I59-V188 HydrophobicContact CD1-CG1 4.48Å
60	D	96.2	Very high	95.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	121.6	172.8	-174	-15.7	0	0	0	110.3	Q62 T63 W66 P67 I69 S111 K113	D60-Q62 PolarHBondContact OD1-N 2.99Å; D60-T63 PolarHBondContact OD1-N 2.89Å; D60-T63 VanDerWaalsContact OD1-N 3.12Å; D60-T63 WeakPolarHBondContact OD2-CB 3.15Å; D60-T63 PolarHBondContact OD2-OG1 3.32Å; D60-W66 WeakPolarHBondContact O-CA 3.46Å; D60-W66 WeakPolarHBondContact O-CB 3.29Å; D60-P67 HydrophobicContact CB-CG 4.29Å; D60-P67 WeakPolarHBondContact CB-O 3.43Å; D60-P67 PolarHBondContact N-O 3.41Å; D60-I69 HydrophobicContact CB-CD1 4.19Å; D60-I69 HydrophobicContact CB-CG1 4.06Å; D60-S111 PolarHBondContact OD2-OG 3.29Å; D60-K113 WeakPolarHBondContact OD1-CE 3.48Å; D60-K113 IonicContact OD1-NZ 3.35Å; D60-K113 PolarHBondContact OD1-NZ 3.3Å; D60-K113 WeakPolarHBondContact OD2-CD 3.36Å; D60-K113 WeakPolarHBondContact OD2-CE 3.36Å; D60-K113 VanDerWaalsContact OD2-CG 3.32Å; D60-K113 WeakPolarHBondContact OD2-CG 3.48Å; D60-K113 IonicContact OD2-NZ 3.02Å
61	L	95.6	Very high	95.3	Very high	26 Å²	26	41.4 Å²	41.4	14%	0.136	22%	0.221	C	C	.	.	S	Bend	trans	-94.9	-7.2	-178.6	-63.7	-179.9	0	0	0	114	V14 V34 P45 S46 L48 I59 W66	V14-L61 HydrophobicContact CG1-CD2 4.35Å; V34-L61 HydrophobicContact CG1-CD1 4.03Å; P45-L61 HydrophobicContact CB-CD1 3.9Å; S46-L61 PolarHBondContact O-N 3.01Å; L48-L61 HydrophobicContact CB-CD1 4.03Å; L48-L61 HydrophobicContact CB-CD2 4.06Å; L48-L61 HydrophobicContact CB-CG 4.16Å; I59-L61 HydrophobicContact CG2-CD2 4.4Å; I59-L61 PolarHBondContact O-N 2.82Å; L61-W66 PolarHBondContact O-NE1 3.09Å
62	Q	93.3	Very high	94.8	Very high	88 Å²	88	38.7 Å²	38.7	41%	0.411	21%	0.208	S	C	.	.	S	Bend	trans	-105.1	-30.9	-177.1	-53.4	175.4	-28.8	0	0	113	D37 D60 K113	D37-Q62 PolarHBondContact OD2-NE2 2.98Å; D60-Q62 PolarHBondContact OD1-N 2.99Å; Q62-K113 VanDerWaalsContact CB-NZ 3.26Å; Q62-K113 VanDerWaalsContact CG-NZ 3.3Å; Q62-K113 VanDerWaalsContact OE1-CE 3.31Å
63	T	94.1	Very high	94.5	Very high	61 Å²	61	42.1 Å²	42.1	37%	0.374	22%	0.221	S	C	.	.	S	Bend	trans	-74.8	135.2	173	-63.7	0	0	0	0	110.2	D60 W66 P67	D60-T63 PolarHBondContact OD1-N 2.89Å; D60-T63 VanDerWaalsContact OD1-N 3.12Å; D60-T63 WeakPolarHBondContact OD2-CB 3.15Å; D60-T63 PolarHBondContact OD2-OG1 3.32Å; T63-W66 PolarHBondContact O-N 3.49Å; T63-W66 VanDerWaalsContact O-N 3.07Å; T63-P67 HydrophobicContact CG2-CG 3.89Å
64	E	91.6	Very high	94.4	Very high	191 Å²	191	43.9 Å²	43.9	89%	0.893	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	141.7	178.3	-172	174.1	-173.1	0	0	111.3	W66	E64-W66 PolarHBondContact O-N 2.95Å
65	G	91.4	Very high	94.2	Very high	53 Å²	53	41.8 Å²	41.8	55%	0.546	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	-3.1	-174.6	0	0	0	0	0	114.4	R186	G65-R186 PolarHBondContact O-NH1 3.39Å
66	W	95.4	Very high	94	Very high	17 Å²	17	41.5 Å²	41.5	6%	0.064	22%	0.224	C	C	.	.			trans	48.6	59.8	178	-57.6	-31.9	0	0	0	114.2	V14 T19 V21 F23 I59 D60 L61 T63 E64 R186	V14-W66 HydrophobicContact CB-CE3 4.47Å; V14-W66 HydrophobicContact CB-CH2 4.18Å; V14-W66 HydrophobicContact CB-CZ3 3.91Å; V14-W66 HydrophobicContact CG1-CE3 4.49Å; V14-W66 HydrophobicContact CG1-CH2 3.71Å; V14-W66 HydrophobicContact CG1-CZ2 4.09Å; V14-W66 HydrophobicContact CG1-CZ3 3.92Å; T19-W66 HydrophobicContact CG2-CH2 3.69Å; T19-W66 HydrophobicContact CG2-CZ2 4.09Å; T19-W66 HydrophobicContact CG2-CZ3 3.99Å; V21-W66 HydrophobicContact CB-CE3 3.93Å; V21-W66 HydrophobicContact CB-CZ3 3.71Å; V21-W66 HydrophobicContact CG2-CE3 3.68Å; V21-W66 HydrophobicContact CG2-CZ3 3.52Å; F23-W66 HydrophobicContact CE2-CE3 4.33Å; F23-W66 HydrophobicContact CZ-CB 4.01Å; F23-W66 HydrophobicContact CZ-CD2 4.35Å; F23-W66 AromaticContact CZ-CE3 3.68Å; F23-W66 HydrophobicContact CZ-CE3 3.68Å; I59-W66 HydrophobicContact CG2-CB 3.86Å; I59-W66 WeakPolarHBondContact CG2-O 3.23Å; D60-W66 WeakPolarHBondContact O-CA 3.46Å; D60-W66 WeakPolarHBondContact O-CB 3.29Å; L61-W66 PolarHBondContact O-NE1 3.09Å; T63-W66 PolarHBondContact O-N 3.49Å; T63-W66 VanDerWaalsContact O-N 3.07Å; E64-W66 PolarHBondContact O-N 2.95Å; W66-R186 VanDerWaalsContact O-CZ 3.28Å; W66-R186 PolarHBondContact O-NH1 2.87Å; W66-R186 PolarHBondContact O-NH2 3.45Å
67	P	95.9	Very high	93.9	Very high	24 Å²	24	40.8 Å²	40.8	16%	0.156	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-66	157.5	-179	26.5	-33	0	0	0	112.5	D60 T63	D60-P67 HydrophobicContact CB-CG 4.29Å; D60-P67 WeakPolarHBondContact CB-O 3.43Å; D60-P67 PolarHBondContact N-O 3.41Å; T63-P67 HydrophobicContact CG2-CG 3.89Å
68	V	95.9	Very high	93.7	Very high	32 Å²	32	41.6 Å²	41.6	19%	0.194	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	138	175.1	176.7	0	0	0	0	109.2	V57 V58 Y110 S111	V57-V68 HydrophobicContact CG1-CG1 4.33Å; V57-V68 HydrophobicContact CG1-CG2 4.37Å; V58-V68 CarbonylContact O-C 3.56Å; V58-V68 VanDerWaalsContact O-CA 3.31Å; V58-V68 WeakPolarHBondContact O-CA 3.42Å; V58-V68 WeakPolarHBondContact O-CG1 3.36Å; V68-Y110 HydrophobicContact CB-CD1 4.09Å; V68-Y110 HydrophobicContact CB-CE1 4.27Å; V68-Y110 HydrophobicContact CG1-CD1 4.07Å; V68-Y110 HydrophobicContact CG1-CE1 3.97Å; V68-Y110 CarbonylContact O-C 3.48Å; V68-Y110 VanDerWaalsContact O-CA 3.3Å; V68-Y110 WeakPolarHBondContact O-CA 3.31Å; V68-Y110 WeakPolarHBondContact O-CD1 3.45Å; V68-S111 PolarHBondContact O-N 3.15Å
69	I	95.2	Very high	93.4	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.8	169.7	-60.3	173.2	0	0	0	107.6	A47 V58 D60 T71 K113 W115	A47-I69 HydrophobicContact CB-CD1 4.21Å; V58-I69 HydrophobicContact CB-CB 4.23Å; V58-I69 HydrophobicContact CG1-CB 4.1Å; V58-I69 HydrophobicContact CG1-CD1 3.97Å; V58-I69 HydrophobicContact CG1-CG1 4.4Å; V58-I69 PolarHBondContact O-N 3.26Å; D60-I69 HydrophobicContact CB-CD1 4.19Å; D60-I69 HydrophobicContact CB-CG1 4.06Å; I69-T71 PolarHBondContact O-N 2.86Å; I69-K113 HydrophobicContact CD1-CB 4.32Å; I69-W115 HydrophobicContact CG2-CE3 4.03Å
70	Q	91.6	Very high	93.2	Very high	69 Å²	69	42.1 Å²	42.1	32%	0.322	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-64.7	130.8	179.6	-170.5	175.3	6.9	0	0	110.6	P72 Y110	Q70-P72 WeakPolarHBondContact O-CD 3.35Å; Q70-Y110 HydrophobicContact CB-CD1 3.99Å; Q70-Y110 HydrophobicContact CB-CE1 4.41Å; Q70-Y110 HydrophobicContact CB-CG 4.13Å
71	T	91.1	Very high	93.1	Very high	16 Å²	16	44.3 Å²	44.3	10%	0.098	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-77.2	125.3	179.6	49.2	0	0	0	0	110.5	L56 I69 Y73 V75 W115	L56-T71 HydrophobicContact CD2-CG2 4.37Å; L56-T71 HydrophobicContact CG-CG2 4.47Å; I69-T71 PolarHBondContact O-N 2.86Å; T71-Y73 VanDerWaalsContact C-N 3.3Å; T71-Y73 WeakPolarHBondContact CB-O 3.35Å; T71-V75 WeakPolarHBondContact O-CG2 3.2Å; T71-W115 HydrophobicContact CG2-CH2 3.83Å; T71-W115 HydrophobicContact CG2-CZ3 3.75Å
72	P	89.4	Confident	93.2	Very high	26 Å²	26	44.7 Å²	44.7	17%	0.169	25%	0.247	C	C	.	.	S	Bend	trans	-73.4	-24.2	177	24.8	-30.4	0	0	0	112.9	Q70 W115 Y153	Q70-P72 WeakPolarHBondContact O-CD 3.35Å; P72-W115 HydrophobicContact CG-CB 4.24Å; P72-W115 HydrophobicContact CG-CD2 3.68Å; P72-W115 HydrophobicContact CG-CE3 4.19Å; P72-W115 HydrophobicContact CG-CG 3.69Å; P72-Y153 HydrophobicContact CB-CD1 4.08Å; P72-Y153 HydrophobicContact CB-CE1 3.62Å; P72-Y153 WeakPolarHBondContact O-CD1 3.19Å; P72-Y153 WeakPolarHBondContact O-CE1 3.49Å
73	Y	90.1	Very high	93.3	Very high	75 Å²	75	43 Å²	43	29%	0.294	24%	0.243	S	C	.	.	S	Bend	trans	-148	173.6	-179.2	45.8	-111.2	0	0	0	108.6	T71 V75 W115 I117	T71-Y73 VanDerWaalsContact C-N 3.3Å; T71-Y73 WeakPolarHBondContact CB-O 3.35Å; Y73-V75 PolarHBondContact O-N 3.45Å; Y73-W115 AromaticContact CE1-NE1 3.99Å; Y73-W115 AromaticContact CE2-CZ2 3.96Å; Y73-W115 HydrophobicContact CE2-CZ2 3.96Å; Y73-W115 AromaticContact CZ-CE2 3.97Å; Y73-W115 AromaticContact CZ-NE1 3.42Å; Y73-W115 PolarHBondContact OH-NE1 3.45Å; Y73-I117 PolarHBondContact OH-O 3.28Å; Y73-I117 VanDerWaalsContact OH-O 3.12Å
74	L	93.4	Very high	93.5	Very high	128 Å²	128	41.1 Å²	41.1	67%	0.67	23%	0.232	S	C	*	.	S	Bend	trans	55.7	35.8	-174.1	-59.5	169.3	0	0	0	112.2	L56	L56-L74 HydrophobicContact CD2-CB 4.45Å; L56-L74 HydrophobicContact CD2-CD1 4.17Å
75	V	92.1	Very high	93.8	Very high	26 Å²	26	33.5 Å²	33.5	16%	0.158	20%	0.2	C	C	.	.			trans	-75.4	133.4	177	-170.7	0	0	0	0	108.7	T71 Y73 L77 W145 P154	T71-V75 WeakPolarHBondContact O-CG2 3.2Å; Y73-V75 PolarHBondContact O-N 3.45Å; V75-L77 PolarHBondContact O-N 3.45Å; V75-W145 HydrophobicContact CB-CH2 4.26Å; V75-W145 HydrophobicContact CB-CZ3 3.89Å; V75-W145 HydrophobicContact CG1-CH2 3.71Å; V75-W145 HydrophobicContact CG1-CZ3 3.68Å; V75-W145 HydrophobicContact CG2-CZ3 4.42Å; V75-P154 HydrophobicContact CG1-CG 4.44Å; V75-P154 HydrophobicContact CG2-CG 4.06Å
76	P	92.3	Very high	94.1	Very high	7 Å²	7	33.1 Å²	33.1	5%	0.045	18%	0.184	C	C	.	.			trans	-70.3	92.3	179.4	29.4	-36.5	0	0	0	110.6	E55 H78 S79 C190	E55-P76 HydrophobicContact CB-CB 3.85Å; E55-P76 HydrophobicContact CB-CG 3.8Å; P76-H78 PolarHBondContact O-N 2.92Å; P76-S79 WeakPolarHBondContact O-CB 3.41Å; P76-S79 PolarHBondContact O-N 3.5Å; P76-S79 PolarHBondContact O-OG 3.28Å; P76-C190 WeakPolarHBondContact CG-SG 3.37Å
77	L	94.6	Very high	94.3	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.052	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.8	179.5	-54.9	-175.2	0	0	0	111.6	V75 S79 I82 H137 W145 L152 S609 F611	V75-L77 PolarHBondContact O-N 3.45Å; L77-S79 VanDerWaalsContact C-N 3.35Å; L77-I82 HydrophobicContact CB-CD1 3.95Å; L77-H137 PolarHBondContact O-CE1 2.66Å; L77-W145 HydrophobicContact CD2-CD2 4.14Å; L77-W145 HydrophobicContact CD2-CE3 4.01Å; L77-W145 HydrophobicContact CD2-CH2 3.35Å; L77-W145 HydrophobicContact CD2-CZ2 3.46Å; L77-W145 VanDerWaalsContact CD2-CZ2 3.46Å; L77-W145 HydrophobicContact CD2-CZ3 3.62Å; L77-L152 HydrophobicContact CD1-CD2 4.04Å; L77-L152 HydrophobicContact CD2-CD2 3.99Å; L77-S609 WeakPolarHBondContact CB-O 3.34Å; L77-S609 WeakPolarHBondContact CD1-O 3.13Å; L77-S609 WeakPolarHBondContact CG-O 3.26Å; L77-F611 HydrophobicContact CD1-CD2 3.55Å; L77-F611 HydrophobicContact CD1-CE2 4.01Å
78	H	93.4	Very high	94.4	Very high	20 Å²	20	32.5 Å²	32.5	9%	0.093	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	20	178.4	67.4	-52.1	0	0	0	113.8	E54 P76 S80 F191 P608 S609	E54-H78 PolarHBondContact O-CE1 2.87Å; E54-H78 IonicContact OE2-CD2 3.36Å; E54-H78 IonicContact OE2-CE1 3.64Å; E54-H78 IonicContact OE2-NE2 3.51Å; E54-H78 PolarHBondContact OE2-NE2 3.5Å; P76-H78 PolarHBondContact O-N 2.92Å; H78-S80 CarbonylContact C-O 3.6Å; H78-S80 WeakPolarHBondContact CA-O 3.2Å; H78-S80 CarbonylContact O-C 3.54Å; H78-S80 PolarHBondContact O-N 3.49Å; H78-F191 AromaticContact CD2-CD2 3.87Å; H78-F191 AromaticContact CD2-CE2 3.48Å; H78-F191 VanDerWaalsContact CD2-CE2 3.48Å; H78-F191 WeakPolarHBondContact CD2-CE2 3.17Å; H78-F191 AromaticContact NE2-CD2 3.82Å; H78-F191 AromaticContact NE2-CE2 3.7Å; H78-P608 WeakPolarHBondContact CB-O 3.34Å; H78-S609 WeakPolarHBondContact CE1-CB 3.41Å; H78-S609 WeakPolarHBondContact ND1-CB 3.32Å
79	S	91.9	Very high	94.4	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.021	17%	0.172	C	C	.	.	S	Bend	trans	-48.8	-32	171.9	40.7	0	0	0	0	112.7	P76 L77 R143 C190 D192	P76-S79 WeakPolarHBondContact O-CB 3.41Å; P76-S79 PolarHBondContact O-N 3.5Å; P76-S79 PolarHBondContact O-OG 3.28Å; L77-S79 VanDerWaalsContact C-N 3.35Å; S79-R143 VanDerWaalsContact OG-CZ 3.25Å; S79-R143 PolarHBondContact OG-NE 3.24Å; S79-R143 PolarHBondContact OG-NH2 3.45Å; S79-C190 VanDerWaalsContact CB-O 3.23Å; S79-C190 WeakPolarHBondContact CB-O 3.32Å; S79-D192 PolarHBondContact O-N 2.78Å
80	S	93.5	Very high	94.3	Very high	8 Å²	8	33 Å²	33	6%	0.056	19%	0.187	C	C	.	.	S	Bend	trans	-128.5	151.6	150.9	176	0	0	0	0	108.4	H78 I82 H137 D139	H78-S80 CarbonylContact C-O 3.6Å; H78-S80 WeakPolarHBondContact CA-O 3.2Å; H78-S80 CarbonylContact O-C 3.54Å; H78-S80 PolarHBondContact O-N 3.49Å; S80-I82 PolarHBondContact O-N 3.37Å; S80-H137 PolarHBondContact O-ND1 2.97Å; S80-D139 VanDerWaalsContact CB-CG 3.41Å; S80-D139 VanDerWaalsContact CB-OD2 3.24Å; S80-D139 WeakPolarHBondContact CB-OD2 3.24Å; S80-D139 WeakPolarHBondContact OG-CB 3.24Å; S80-D139 VanDerWaalsContact OG-CG 3.29Å; S80-D139 PolarHBondContact OG-N 2.86Å
81	A	93.9	Very high	94.6	Very high	45 Å²	45	29.7 Å²	29.7	37%	0.372	17%	0.172	S	C	.	.			trans	-58.3	128.3	-175	0	0	0	0	0	112	T83 H137 E138	A81-T83 PolarHBondContact O-N 2.78Å; A81-H137 CarbonylContact O-C 3.56Å; A81-H137 VanDerWaalsContact O-CA 3.23Å; A81-H137 WeakPolarHBondContact O-CA 3.42Å; A81-E138 HydrophobicContact CB-CB 4.2Å; A81-E138 PolarHBondContact O-N 3.49Å
82	I	96.3	Very high	94.8	Very high	35 Å²	35	30.9 Å²	30.9	18%	0.179	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.1	179.2	-60	168.6	0	0	0	109.7	L77 S80 L605 F611	L77-I82 HydrophobicContact CB-CD1 3.95Å; S80-I82 PolarHBondContact O-N 3.37Å; I82-L605 HydrophobicContact CB-CD1 4.37Å; I82-L605 HydrophobicContact CD1-CD1 4.29Å; I82-L605 HydrophobicContact CD1-CD2 3.96Å; I82-L605 HydrophobicContact CG2-CD1 4.37Å; I82-F611 HydrophobicContact CD1-CE2 4.24Å
83	T	96.6	Very high	95.1	Very high	53 Å²	53	33.8 Å²	33.8	33%	0.325	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-31.6	-178.4	48.1	0	0	0	0	112.6	A81 G136 H137 E138 I202	A81-T83 PolarHBondContact O-N 2.78Å; T83-G136 PolarHBondContact N-O 3.22Å; T83-G136 VanDerWaalsContact OG1-C 3.25Å; T83-G136 PolarHBondContact OG1-O 2.69Å; T83-H137 PolarHBondContact OG1-N 2.67Å; T83-E138 HydrophobicContact CG2-CB 4.16Å; T83-I202 WeakPolarHBondContact CB-O 3.46Å; T83-I202 PolarHBondContact OG1-O 3.27Å
84	C	97.7	Very high	95.4	Very high	21 Å²	21	37.8 Å²	37.8	14%	0.142	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	165.6	173.6	68.4	0	0	0	0	112.6	G136 I202 Q203	C84-G136 PolarHBondContact N-O 3.12Å; C84-G136 PolarHBondContact O-N 2.87Å; C84-I202 PolarHBondContact SG-O 3.45Å; C84-Q203 WeakPolarHBondContact CB-O 3.43Å; C84-Q203 VanDerWaalsContact SG-C 3.57Å
85	S	98.2	Very high	95.6	Very high	30 Å²	30	32.1 Å²	32.1	21%	0.21	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.2	175	58.3	0	0	0	0	111.2	L134 S593	S85-L134 CarbonylContact C-O 3.51Å; S85-L134 VanDerWaalsContact CA-O 3.24Å; S85-L134 WeakPolarHBondContact CA-O 3.4Å; S85-S593 PolarHBondContact OG-O 2.92Å
86	H	98.4	Very high	95.9	Very high	46 Å²	46	32.1 Å²	32.1	21%	0.213	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	126.2	176.7	-175.9	77.6	0	0	0	109.6	V88 L134 I205	H86-V88 VanDerWaalsContact CD2-CG2 3.5Å; H86-V88 WeakPolarHBondContact CD2-CG2 3.26Å; H86-L134 HydrophobicContact CB-CB 4.39Å; H86-L134 PolarHBondContact N-O 2.99Å; H86-L134 WeakPolarHBondContact O-CB 3.32Å; H86-L134 PolarHBondContact O-N 2.78Å; H86-I205 HydrophobicContact CB-CB 3.96Å; H86-I205 HydrophobicContact CB-CG2 4.22Å; H86-I205 PolarHBondContact ND1-O 2.48Å
87	H	98.4	Very high	96.2	Very high	19 Å²	19	37 Å²	37	9%	0.088	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.1	-179.6	-175.6	-79.1	0	0	0	110.5	S89 L132 V595 F603	H87-S89 PolarHBondContact CE1-OG 3.47Å; H87-S89 PolarHBondContact ND1-OG 2.74Å; H87-L132 WeakPolarHBondContact CA-O 3.32Å; H87-V595 HydrophobicContact CB-CG2 4.02Å; H87-F603 AromaticContact CD2-CE2 3.49Å; H87-F603 VanDerWaalsContact CD2-CE2 3.49Å; H87-F603 WeakPolarHBondContact CD2-CE2 3.27Å; H87-F603 AromaticContact NE2-CE2 3.8Å
88	V	98.1	Very high	96.3	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.055	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	116.9	176.8	-170.1	0	0	0	0	109.1	H86 I91 L132 L207 K209	H86-V88 VanDerWaalsContact CD2-CG2 3.5Å; H86-V88 WeakPolarHBondContact CD2-CG2 3.26Å; V88-I91 HydrophobicContact CB-CD1 3.82Å; V88-I91 HydrophobicContact CG1-CD1 3.44Å; V88-I91 VanDerWaalsContact CG1-CD1 3.44Å; V88-L132 PolarHBondContact N-O 3.33Å; V88-L132 PolarHBondContact O-N 3.5Å; V88-L207 HydrophobicContact CG2-CB 4.25Å; V88-L207 HydrophobicContact CG2-CD2 4.41Å; V88-K209 HydrophobicContact CG1-CB 3.98Å; V88-K209 HydrophobicContact CG1-CD 3.85Å; V88-K209 HydrophobicContact CG1-CG 4.27Å
89	S	95.6	Very high	96.6	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.028	21%	0.207	C	C	.	.			trans	-90.3	153.2	-178.5	-64.9	0	0	0	0	112.7	H87 D131 K209	H87-S89 PolarHBondContact CE1-OG 3.47Å; H87-S89 PolarHBondContact ND1-OG 2.74Å; S89-D131 WeakPolarHBondContact CA-OD1 3.07Å; S89-K209 PolarHBondContact O-NZ 3.29Å
90	A	94.5	Very high	96.8	Very high	42 Å²	42	41.3 Å²	41.3	35%	0.347	22%	0.221	S	C	.	.	S	Bend	trans	53	65.5	171.9	0	0	0	0	0	112.9	R130 D131 K209	A90-R130 CarbonylContact C-O 3.36Å; A90-R130 VanDerWaalsContact CA-O 3.28Å; A90-R130 WeakPolarHBondContact CA-O 3.43Å; A90-R130 PolarHBondContact N-O 3.14Å; A90-D131 PolarHBondContact N-OD1 3.07Å; A90-K209 PolarHBondContact O-NZ 3.38Å; A90-K209 VanDerWaalsContact O-NZ 3.1Å
91	I	97.1	Very high	97	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.239	C	C	.	.			trans	-71.7	130.3	178.8	-53.8	-56.8	0	0	0	110.8	V88 L95 W96 R130 L132 K209	V88-I91 HydrophobicContact CB-CD1 3.82Å; V88-I91 HydrophobicContact CG1-CD1 3.44Å; V88-I91 VanDerWaalsContact CG1-CD1 3.44Å; I91-L95 HydrophobicContact CG2-CB 4.16Å; I91-L95 HydrophobicContact CG2-CD2 4.15Å; I91-L95 HydrophobicContact CG2-CG 4.18Å; I91-W96 HydrophobicContact CB-CE3 4.16Å; I91-W96 HydrophobicContact CG1-CE3 4.36Å; I91-W96 HydrophobicContact CG2-CB 4.11Å; I91-W96 HydrophobicContact CG2-CE3 4.2Å; I91-R130 HydrophobicContact CB-CB 4.21Å; I91-R130 PolarHBondContact N-O 3.43Å; I91-R130 PolarHBondContact O-NE 2.86Å; I91-R130 VanDerWaalsContact O-NE 3.08Å; I91-R130 PolarHBondContact O-NH2 2.88Å; I91-L132 HydrophobicContact CD1-CB 4.3Å; I91-L132 HydrophobicContact CD1-CD1 3.87Å; I91-L132 HydrophobicContact CD1-CG 4.18Å; I91-L132 HydrophobicContact CG1-CB 4.29Å; I91-L132 HydrophobicContact CG1-CD1 3.84Å; I91-L132 HydrophobicContact CG1-CG 3.83Å; I91-L132 HydrophobicContact CG2-CD1 4.44Å; I91-K209 HydrophobicContact CD1-CB 4.03Å; I91-K209 HydrophobicContact CD1-CD 4.32Å
92	P	95.8	Very high	97.1	Very high	41 Å²	41	41.6 Å²	41.6	27%	0.266	22%	0.224	S	C	.	.			trans	-57	138	172.4	-25.9	36.1	0	0	0	111.7	K94 L95 W96 K209 Y210	P92-K94 VanDerWaalsContact C-N 3.28Å; P92-K94 PolarHBondContact O-N 3.47Å; P92-L95 PolarHBondContact O-N 2.88Å; P92-W96 PolarHBondContact O-N 3.08Å; P92-K209 WeakPolarHBondContact CD-O 3.25Å; P92-K209 WeakPolarHBondContact CG-O 3.38Å; P92-Y210 HydrophobicContact CG-CD1 4.42Å
93	L	95.3	Very high	97.1	Very high	87 Å²	87	40 Å²	40	46%	0.455	22%	0.216	S	C	.	.	H	α-helix	trans	-55.4	-43.2	-174.9	-178.2	63.2	0	0	0	112.3	L95 W96 E97	L93-L95 VanDerWaalsContact C-N 3.34Å; L93-L95 PolarHBondContact O-N 3.2Å; L93-W96 WeakPolarHBondContact O-CB 3.48Å; L93-W96 PolarHBondContact O-N 3.46Å; L93-W96 VanDerWaalsContact O-N 3.17Å; L93-E97 HydrophobicContact CD1-CG 4.15Å; L93-E97 HydrophobicContact CG-CG 4.38Å; L93-E97 WeakPolarHBondContact O-CG 3.48Å; L93-E97 PolarHBondContact O-N 3.41Å
94	K	96.3	Very high	97	Very high	158 Å²	158	42.3 Å²	42.3	69%	0.687	23%	0.23	S	C	*	.	H	α-helix	trans	-58.4	-42.7	177.5	-173.5	179.8	-178.9	-177.8	0	112.7	P92 R98	P92-K94 VanDerWaalsContact C-N 3.28Å; P92-K94 PolarHBondContact O-N 3.47Å; K94-R98 WeakPolarHBondContact O-CD 3.35Å; K94-R98 WeakPolarHBondContact O-CG 3.31Å; K94-R98 PolarHBondContact O-N 2.82Å
95	L	97.6	Very high	96.8	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-69.2	-41.6	178	177.9	60.4	0	0	0	110.8	I91 P92 L93 R98 I99 K209 L228	I91-L95 HydrophobicContact CG2-CB 4.16Å; I91-L95 HydrophobicContact CG2-CD2 4.15Å; I91-L95 HydrophobicContact CG2-CG 4.18Å; P92-L95 PolarHBondContact O-N 2.88Å; L93-L95 VanDerWaalsContact C-N 3.34Å; L93-L95 PolarHBondContact O-N 3.2Å; L95-R98 PolarHBondContact O-N 3.46Å; L95-I99 HydrophobicContact CD1-CD1 4.08Å; L95-I99 HydrophobicContact CD1-CG1 4.27Å; L95-I99 HydrophobicContact CG-CD1 3.95Å; L95-I99 WeakPolarHBondContact O-CG1 3.44Å; L95-I99 PolarHBondContact O-N 2.64Å; L95-K209 HydrophobicContact CD2-CB 4.08Å; L95-K209 WeakPolarHBondContact CD2-O 3.45Å; L95-L228 HydrophobicContact CD1-CD2 3.38Å
96	W	98	Very high	96.4	Very high	25 Å²	25	46.6 Å²	46.6	10%	0.095	25%	0.25	C	S	.	.	H	α-helix	trans	-57.2	-51.1	178.3	-177.5	-99.6	0	0	0	112.5	I91 P92 L93 R98 I99 I100 R130 L132 D146 L155	I91-W96 HydrophobicContact CB-CE3 4.16Å; I91-W96 HydrophobicContact CG1-CE3 4.36Å; I91-W96 HydrophobicContact CG2-CB 4.11Å; I91-W96 HydrophobicContact CG2-CE3 4.2Å; P92-W96 PolarHBondContact O-N 3.08Å; L93-W96 WeakPolarHBondContact O-CB 3.48Å; L93-W96 PolarHBondContact O-N 3.46Å; L93-W96 VanDerWaalsContact O-N 3.17Å; W96-R98 VanDerWaalsContact C-N 3.34Å; W96-R98 PolarHBondContact O-N 3.11Å; W96-I99 PolarHBondContact O-N 2.97Å; W96-I100 HydrophobicContact CG-CD1 4.38Å; W96-I100 HydrophobicContact CZ2-CD1 4.46Å; W96-I100 WeakPolarHBondContact O-CG1 3.31Å; W96-I100 PolarHBondContact O-N 3.26Å; W96-R130 HydrophobicContact CD2-CB 4.1Å; W96-R130 HydrophobicContact CD2-CG 4.04Å; W96-R130 HydrophobicContact CE3-CB 3.9Å; W96-R130 HydrophobicContact CE3-CG 4.35Å; W96-R130 HydrophobicContact CG-CG 4.36Å; W96-R130 HydrophobicContact CH2-CB 4.45Å; W96-R130 HydrophobicContact CZ2-CG 4.43Å; W96-R130 HydrophobicContact CZ3-CB 4.07Å; W96-L132 HydrophobicContact CE3-CD2 4.31Å; W96-L132 HydrophobicContact CE3-CG 4.33Å; W96-L132 HydrophobicContact CH2-CD2 4.47Å; W96-L132 HydrophobicContact CZ3-CD2 3.68Å; W96-L132 HydrophobicContact CZ3-CG 3.87Å; W96-D146 HydrophobicContact CH2-CB 3.8Å; W96-D146 VanDerWaalsContact CH2-CG 3.43Å; W96-D146 WeakPolarHBondContact CH2-OD1 3.31Å; W96-D146 HydrophobicContact CZ2-CB 4.25Å; W96-L155 HydrophobicContact CE3-CD1 4.47Å; W96-L155 HydrophobicContact CH2-CD1 3.63Å; W96-L155 HydrophobicContact CZ2-CD1 4.03Å; W96-L155 HydrophobicContact CZ3-CD1 3.88Å
97	E	97.9	Very high	96	Very high	109 Å²	109	46 Å²	46	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-40	179.9	-71.4	172.3	167.4	0	0	112.1	L93 I100 A101	L93-E97 HydrophobicContact CD1-CG 4.15Å; L93-E97 HydrophobicContact CG-CG 4.38Å; L93-E97 WeakPolarHBondContact O-CG 3.48Å; L93-E97 PolarHBondContact O-N 3.41Å; E97-I100 PolarHBondContact O-N 3.12Å; E97-A101 WeakPolarHBondContact O-CB 3.38Å; E97-A101 PolarHBondContact O-N 3.43Å
98	R	98.1	Very high	95.4	Very high	62 Å²	62	50.6 Å²	50.6	23%	0.234	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-38.7	177.5	-68.1	172.1	72.2	-150.1	-3.9	112.5	K94 L95 W96 A101 A102 L228 D230	K94-R98 WeakPolarHBondContact O-CD 3.35Å; K94-R98 WeakPolarHBondContact O-CG 3.31Å; K94-R98 PolarHBondContact O-N 2.82Å; L95-R98 PolarHBondContact O-N 3.46Å; W96-R98 VanDerWaalsContact C-N 3.34Å; W96-R98 PolarHBondContact O-N 3.11Å; R98-A101 PolarHBondContact O-N 3.12Å; R98-A102 PolarHBondContact O-N 2.71Å; R98-L228 HydrophobicContact CB-CD2 3.68Å; R98-L228 PolarHBondContact NH2-O 3.25Å; R98-D230 IonicContact CZ-OD1 2.7Å; R98-D230 VanDerWaalsContact CZ-OD1 3.26Å; R98-D230 IonicContact CZ-OD2 3.19Å; R98-D230 IonicContact NE-OD1 2.87Å; R98-D230 PolarHBondContact NE-OD1 2.77Å; R98-D230 IonicContact NE-OD2 3.46Å; R98-D230 PolarHBondContact NE-OD2 2.88Å; R98-D230 IonicContact NH2-OD1 2.81Å; R98-D230 PolarHBondContact NH2-OD1 2.87Å; R98-D230 IonicContact NH2-OD2 3.68Å
99	I	98.3	Very high	94.9	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-64	-44.8	174.7	-68	169.4	0	0	0	110.4	L95 W96 A102 G103 L132 F144 L155 L228 F272	L95-I99 HydrophobicContact CD1-CD1 4.08Å; L95-I99 HydrophobicContact CD1-CG1 4.27Å; L95-I99 HydrophobicContact CG-CD1 3.95Å; L95-I99 WeakPolarHBondContact O-CG1 3.44Å; L95-I99 PolarHBondContact O-N 2.64Å; W96-I99 PolarHBondContact O-N 2.97Å; I99-A102 PolarHBondContact O-N 3.11Å; I99-G103 PolarHBondContact O-N 2.82Å; I99-L132 HydrophobicContact CD1-CD1 3.81Å; I99-F144 HydrophobicContact CD1-CD1 4.23Å; I99-F144 HydrophobicContact CD1-CE1 4.32Å; I99-F144 HydrophobicContact CG2-CB 4.49Å; I99-F144 HydrophobicContact CG2-CD1 4.17Å; I99-L155 HydrophobicContact CG2-CB 4.26Å; I99-L228 HydrophobicContact CG1-CD2 4.16Å; I99-F272 HydrophobicContact CD1-CE2 4.44Å; I99-F272 HydrophobicContact CG1-CE2 4.15Å
100	I	97.4	Very high	94.7	Very high	61 Å²	61	58.8 Å²	58.8	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-45.9	176.5	-68.5	175	0	0	0	110.6	W96 E97 A102 G103 V104 L155	W96-I100 HydrophobicContact CG-CD1 4.38Å; W96-I100 HydrophobicContact CZ2-CD1 4.46Å; W96-I100 WeakPolarHBondContact O-CG1 3.31Å; W96-I100 PolarHBondContact O-N 3.26Å; E97-I100 PolarHBondContact O-N 3.12Å; I100-A102 PolarHBondContact O-N 3.07Å; I100-G103 WeakPolarHBondContact O-CA 3.38Å; I100-G103 PolarHBondContact O-N 3.05Å; I100-G103 VanDerWaalsContact O-N 3.1Å; I100-V104 HydrophobicContact CG2-CG2 4.3Å; I100-V104 WeakPolarHBondContact O-CG2 3.35Å; I100-V104 PolarHBondContact O-N 2.86Å; I100-L155 HydrophobicContact CG1-CD2 4.19Å
101	A	97.3	Very high	94.7	Very high	54 Å²	54	57.6 Å²	57.6	45%	0.446	30%	0.302	S	S	.	.	H	α-helix	trans	-58.2	-46.7	179.5	0	0	0	0	0	111.7	E97 R98 G103 V104 V105	E97-A101 WeakPolarHBondContact O-CB 3.38Å; E97-A101 PolarHBondContact O-N 3.43Å; R98-A101 PolarHBondContact O-N 3.12Å; A101-G103 VanDerWaalsContact C-N 3.31Å; A101-G103 PolarHBondContact O-N 2.73Å; A101-V104 PolarHBondContact O-N 3.39Å; A101-V105 WeakPolarHBondContact O-CG2 3.15Å; A101-V105 PolarHBondContact O-N 3.08Å
102	A	97.2	Very high	94.5	Very high	6 Å²	6	67.5 Å²	67.5	5%	0.05	35%	0.345	C	S	.	.	H	α-helix	trans	-60.5	-40.1	174.7	0	0	0	0	0	112.3	R98 I99 I100 V105 Q106 Y156	R98-A102 PolarHBondContact O-N 2.71Å; I99-A102 PolarHBondContact O-N 3.11Å; I100-A102 PolarHBondContact O-N 3.07Å; A102-V105 PolarHBondContact O-N 3.18Å; A102-Q106 PolarHBondContact O-N 3.48Å; A102-Q106 VanDerWaalsContact O-N 3.12Å; A102-Y156 HydrophobicContact CB-CD2 4.03Å; A102-Y156 HydrophobicContact CB-CE2 4.15Å
103	G	95.6	Very high	94.4	Very high	2 Å²	2	67.9 Å²	67.9	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-43	175.4	0	0	0	0	0	114.4	I99 I100 A101 V105 Q106 N107 L155	I99-G103 PolarHBondContact O-N 2.82Å; I100-G103 WeakPolarHBondContact O-CA 3.38Å; I100-G103 PolarHBondContact O-N 3.05Å; I100-G103 VanDerWaalsContact O-N 3.1Å; A101-G103 VanDerWaalsContact C-N 3.31Å; A101-G103 PolarHBondContact O-N 2.73Å; G103-V105 VanDerWaalsContact C-N 3.32Å; G103-V105 PolarHBondContact O-N 2.93Å; G103-Q106 PolarHBondContact O-N 2.67Å; G103-N107 WeakPolarHBondContact O-CB 3.16Å; G103-N107 PolarHBondContact O-N 3.35Å; G103-N107 VanDerWaalsContact O-N 3.13Å; G103-N107 PolarHBondContact O-ND2 3.34Å; G103-L155 WeakPolarHBondContact CA-O 3.34Å
104	V	94	Very high	94.2	Very high	100 Å²	100	69 Å²	69	61%	0.606	36%	0.355	S	S	*	.	H	α-helix	trans	-62.2	-41.3	177.1	171.1	0	0	0	0	110.9	I100 A101 Q106 N107	I100-V104 HydrophobicContact CG2-CG2 4.3Å; I100-V104 WeakPolarHBondContact O-CG2 3.35Å; I100-V104 PolarHBondContact O-N 2.86Å; A101-V104 PolarHBondContact O-N 3.39Å; V104-Q106 VanDerWaalsContact C-N 3.31Å; V104-Q106 PolarHBondContact O-N 2.94Å; V104-N107 PolarHBondContact O-N 2.83Å
105	V	93.2	Very high	94	Very high	81 Å²	81	63.1 Å²	63.1	49%	0.491	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-36.4	176.3	176.1	0	0	0	0	111.6	A101 A102 G103 N107 T108 P270	A101-V105 WeakPolarHBondContact O-CG2 3.15Å; A101-V105 PolarHBondContact O-N 3.08Å; A102-V105 PolarHBondContact O-N 3.18Å; G103-V105 VanDerWaalsContact C-N 3.32Å; G103-V105 PolarHBondContact O-N 2.93Å; V105-N107 VanDerWaalsContact C-N 3.33Å; V105-N107 PolarHBondContact O-N 3.33Å; V105-T108 WeakPolarHBondContact O-CG2 3.41Å; V105-P270 HydrophobicContact CG1-CG 4.19Å
106	Q	91.1	Very high	93.8	Very high	61 Å²	61	64.6 Å²	64.6	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-25.1	178.3	-175.5	175.9	37.4	0	0	113.8	A102 G103 V104 Q109 K157	A102-Q106 PolarHBondContact O-N 3.48Å; A102-Q106 VanDerWaalsContact O-N 3.12Å; G103-Q106 PolarHBondContact O-N 2.67Å; V104-Q106 VanDerWaalsContact C-N 3.31Å; V104-Q106 PolarHBondContact O-N 2.94Å; Q106-Q109 PolarHBondContact O-NE2 2.97Å; Q106-Q109 PolarHBondContact O-OE1 3.09Å; Q106-K157 PolarHBondContact NE2-O 2.94Å; Q106-K157 PolarHBondContact OE1-O 3.18Å
107	N	89.1	Confident	93.5	Very high	34 Å²	34	66.4 Å²	66.4	18%	0.182	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	26.4	-169.1	-74.2	-27.2	0	0	0	113.7	G103 V104 V105 Q109 Y110	G103-N107 WeakPolarHBondContact O-CB 3.16Å; G103-N107 PolarHBondContact O-N 3.35Å; G103-N107 VanDerWaalsContact O-N 3.13Å; G103-N107 PolarHBondContact O-ND2 3.34Å; V104-N107 PolarHBondContact O-N 2.83Å; V105-N107 VanDerWaalsContact C-N 3.33Å; V105-N107 PolarHBondContact O-N 3.33Å; N107-Q109 PolarHBondContact O-N 2.77Å; N107-Y110 HydrophobicContact CB-CD2 3.75Å; N107-Y110 HydrophobicContact CB-CE2 4.23Å; N107-Y110 PolarHBondContact O-N 3.02Å; N107-Y110 VanDerWaalsContact O-N 3.14Å; N107-Y110 WeakPolarHBondContact OD1-CE2 3.28Å
108	T	86.8	Confident	93.1	Very high	114 Å²	114	66.6 Å²	66.6	70%	0.699	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.3	-178	52	0	0	0	0	114.3	V105 Y110	V105-T108 WeakPolarHBondContact O-CG2 3.41Å; T108-Y110 VanDerWaalsContact C-N 3.29Å; T108-Y110 PolarHBondContact O-N 2.93Å
109	Q	86.8	Confident	92.8	Very high	117 Å²	117	67.1 Å²	67.1	55%	0.547	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.5	174.2	65.7	-85.7	2	0	0	114.7	Q106 N107	Q106-Q109 PolarHBondContact O-NE2 2.97Å; Q106-Q109 PolarHBondContact O-OE1 3.09Å; N107-Q109 PolarHBondContact O-N 2.77Å
110	Y	91.8	Very high	92.5	Very high	68 Å²	68	69.2 Å²	69.2	27%	0.267	41%	0.405	S	S	.	.	S	Bend	trans	-81.9	153.9	179.5	-68.4	-81.6	0	0	0	111.6	V68 Q70 N107 T108	V68-Y110 HydrophobicContact CB-CD1 4.09Å; V68-Y110 HydrophobicContact CB-CE1 4.27Å; V68-Y110 HydrophobicContact CG1-CD1 4.07Å; V68-Y110 HydrophobicContact CG1-CE1 3.97Å; V68-Y110 CarbonylContact O-C 3.48Å; V68-Y110 VanDerWaalsContact O-CA 3.3Å; V68-Y110 WeakPolarHBondContact O-CA 3.31Å; V68-Y110 WeakPolarHBondContact O-CD1 3.45Å; Q70-Y110 HydrophobicContact CB-CD1 3.99Å; Q70-Y110 HydrophobicContact CB-CE1 4.41Å; Q70-Y110 HydrophobicContact CB-CG 4.13Å; N107-Y110 HydrophobicContact CB-CD2 3.75Å; N107-Y110 HydrophobicContact CB-CE2 4.23Å; N107-Y110 PolarHBondContact O-N 3.02Å; N107-Y110 VanDerWaalsContact O-N 3.14Å; N107-Y110 WeakPolarHBondContact OD1-CE2 3.28Å; T108-Y110 VanDerWaalsContact C-N 3.29Å; T108-Y110 PolarHBondContact O-N 2.93Å
111	S	94.7	Very high	92.3	Very high	17 Å²	17	71.9 Å²	71.9	12%	0.119	42%	0.416	C	S	.	.			trans	-62.4	142.9	172.4	-178.6	0	0	0	0	110.5	D60 V68 K113	D60-S111 PolarHBondContact OD2-OG 3.29Å; V68-S111 PolarHBondContact O-N 3.15Å; S111-K113 VanDerWaalsContact C-N 3.26Å; S111-K113 WeakPolarHBondContact OG-CB 3.07Å; S111-K113 PolarHBondContact OG-N 2.93Å; S111-K113 VanDerWaalsContact OG-N 3.07Å
112	K	92.9	Very high	92	Very high	209 Å²	209	74.8 Å²	74.8	91%	0.909	42%	0.424	S	S	*	.			trans	-82.8	-1.4	171.9	-62.4	-176.6	-179.7	180	0	113
113	K	92.4	Very high	91.8	Very high	50 Å²	50	79 Å²	79	22%	0.217	45%	0.445	C	S	.	.	S	Bend	trans	-65	146.8	177.4	-82.5	-164.4	-177.2	169.9	0	111.8	S46 D60 Q62 I69 S111	S46-K113 PolarHBondContact O-NZ 2.97Å; D60-K113 WeakPolarHBondContact OD1-CE 3.48Å; D60-K113 IonicContact OD1-NZ 3.35Å; D60-K113 PolarHBondContact OD1-NZ 3.3Å; D60-K113 WeakPolarHBondContact OD2-CD 3.36Å; D60-K113 WeakPolarHBondContact OD2-CE 3.36Å; D60-K113 VanDerWaalsContact OD2-CG 3.32Å; D60-K113 WeakPolarHBondContact OD2-CG 3.48Å; D60-K113 IonicContact OD2-NZ 3.02Å; Q62-K113 VanDerWaalsContact CB-NZ 3.26Å; Q62-K113 VanDerWaalsContact CG-NZ 3.3Å; Q62-K113 VanDerWaalsContact OE1-CE 3.31Å; I69-K113 HydrophobicContact CD1-CB 4.32Å; S111-K113 VanDerWaalsContact C-N 3.26Å; S111-K113 WeakPolarHBondContact OG-CB 3.07Å; S111-K113 PolarHBondContact OG-N 2.93Å; S111-K113 VanDerWaalsContact OG-N 3.07Å
114	P	91.8	Very high	91.5	Very high	111 Å²	111	79.9 Å²	79.9	72%	0.721	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-63.3	154.1	170.9	29.5	-34.9	0	0	0	110.5
115	W	93.3	Very high	91.1	Very high	33 Å²	33	80.4 Å²	80.4	13%	0.125	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-56.6	129.4	174	179.3	-111.8	0	0	0	110.8	L56 V58 I69 T71 P72 Y73 I117 T118	L56-W115 HydrophobicContact CD2-CH2 4.02Å; L56-W115 HydrophobicContact CD2-CZ2 4.46Å; V58-W115 HydrophobicContact CB-CH2 4.46Å; V58-W115 HydrophobicContact CB-CZ3 3.99Å; V58-W115 HydrophobicContact CG1-CZ3 4.43Å; V58-W115 HydrophobicContact CG2-CH2 3.46Å; V58-W115 VanDerWaalsContact CG2-CH2 3.46Å; V58-W115 HydrophobicContact CG2-CZ3 3.47Å; V58-W115 VanDerWaalsContact CG2-CZ3 3.47Å; I69-W115 HydrophobicContact CG2-CE3 4.03Å; T71-W115 HydrophobicContact CG2-CH2 3.83Å; T71-W115 HydrophobicContact CG2-CZ3 3.75Å; P72-W115 HydrophobicContact CG-CB 4.24Å; P72-W115 HydrophobicContact CG-CD2 3.68Å; P72-W115 HydrophobicContact CG-CE3 4.19Å; P72-W115 HydrophobicContact CG-CG 3.69Å; Y73-W115 AromaticContact CE1-NE1 3.99Å; Y73-W115 AromaticContact CE2-CZ2 3.96Å; Y73-W115 HydrophobicContact CE2-CZ2 3.96Å; Y73-W115 AromaticContact CZ-CE2 3.97Å; Y73-W115 AromaticContact CZ-NE1 3.42Å; Y73-W115 PolarHBondContact OH-NE1 3.45Å; W115-I117 HydrophobicContact CZ2-CB 4.21Å; W115-I117 HydrophobicContact CZ2-CD1 3.87Å; W115-I117 HydrophobicContact CZ2-CG1 4.29Å; W115-I117 PolarHBondContact NE1-O 3.47Å; W115-T118 WeakPolarHBondContact O-CG2 3.39Å
116	P	91.4	Very high	90.8	Very high	41 Å²	41	83.5 Å²	83.5	27%	0.266	47%	0.472	S	S	.	.	S	Bend	trans	-81.8	-15.8	-172.3	29.2	-34.4	0	0	0	114.5	A47 V58 T118	A47-P116 HydrophobicContact CB-CG 4.17Å; V58-P116 HydrophobicContact CG1-CG 4.03Å; P116-T118 PolarHBondContact O-N 3.48Å
117	I	91.8	Very high	90.7	Very high	64 Å²	64	83.5 Å²	83.5	33%	0.328	48%	0.477	S	S	.	.			trans	-102.4	82.2	-176	-52.3	168.6	0	0	0	109.2	F33 V49 Y73 W115	F33-I117 HydrophobicContact CZ-CD1 4.18Å; V49-I117 HydrophobicContact CG1-CD1 4.32Å; V49-I117 HydrophobicContact CG2-CD1 4.31Å; Y73-I117 PolarHBondContact OH-O 3.28Å; Y73-I117 VanDerWaalsContact OH-O 3.12Å; W115-I117 HydrophobicContact CZ2-CB 4.21Å; W115-I117 HydrophobicContact CZ2-CD1 3.87Å; W115-I117 HydrophobicContact CZ2-CG1 4.29Å; W115-I117 PolarHBondContact NE1-O 3.47Å
118	T	91.1	Very high	90.2	Very high	112 Å²	112	87.2 Å²	87.2	69%	0.687	50%	0.503	S	S	*	.			trans	-113.7	20.3	-172	52.6	0	0	0	0	113.8	W115 P116	W115-T118 WeakPolarHBondContact O-CG2 3.39Å; P116-T118 PolarHBondContact O-N 3.48Å
119	G	90.4	Very high	90.4	Very high	74 Å²	74	83 Å²	83	76%	0.763	48%	0.475	S	S	*	.			trans	-63	146.5	-179.3	0	0	0	0	0	113.4
120	G	92.3	Very high	90.9	Very high	45 Å²	45	81.9 Å²	81.9	46%	0.464	47%	0.466	S	S	.	.	S	Bend	trans	83	-180	179.7	0	0	0	0	0	114.2	L627	G120-L627 CarbonylContact C-O 3.56Å; G120-L627 VanDerWaalsContact CA-O 3.27Å; G120-L627 WeakPolarHBondContact CA-O 3.48Å
121	Q	92.6	Very high	91.2	Very high	116 Å²	116	78.9 Å²	78.9	54%	0.542	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	130.4	178.5	-174.5	179.3	11.5	0	0	109.7	L123 C626 L627	Q121-L123 HydrophobicContact CG-CD2 4.11Å; Q121-C626 CarbonylContact O-C 3.55Å; Q121-C626 WeakPolarHBondContact O-CA 3.34Å; Q121-C626 VanDerWaalsContact O-CB 3.29Å; Q121-C626 WeakPolarHBondContact O-CB 3.47Å; Q121-L627 PolarHBondContact N-O 3.43Å; Q121-L627 PolarHBondContact O-N 3.21Å
122	N	91.6	Very high	91.4	Very high	115 Å²	115	78 Å²	78	62%	0.615	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	123.7	170.8	-174.7	16.5	0	0	0	109.7	A124 R625	N122-A124 VanDerWaalsContact OD1-CB 3.3Å; N122-A124 WeakPolarHBondContact OD1-CB 3.38Å; N122-A124 PolarHBondContact OD1-N 3.47Å; N122-R625 PolarHBondContact OD1-O 3.11Å
123	L	93.8	Very high	91.6	Very high	95 Å²	95	68.1 Å²	68.1	50%	0.497	41%	0.405	S	S	.	.			trans	-108.5	-2.1	176.7	-57.8	-177.9	0	0	0	112.2	Q121 R625 L627	Q121-L123 HydrophobicContact CG-CD2 4.11Å; L123-R625 CarbonylContact C-O 3.53Å; L123-R625 WeakPolarHBondContact CA-O 3.37Å; L123-R625 HydrophobicContact CB-CB 4.36Å; L123-R625 PolarHBondContact N-O 2.88Å; L123-L627 HydrophobicContact CD1-CB 3.91Å; L123-L627 HydrophobicContact CG-CB 4.32Å
124	A	88.7	Confident	91.9	Very high	20 Å²	20	65.7 Å²	65.7	17%	0.165	40%	0.395	C	S	.	.	S	Bend	trans	-69.5	140.2	174.9	0	0	0	0	0	109.8	N122 R625	N122-A124 VanDerWaalsContact OD1-CB 3.3Å; N122-A124 WeakPolarHBondContact OD1-CB 3.38Å; N122-A124 PolarHBondContact OD1-N 3.47Å; A124-R625 HydrophobicContact CB-CB 4.3Å; A124-R625 PolarHBondContact N-O 2.95Å
125	P	86.6	Confident	92.3	Very high	111 Å²	111	60.4 Å²	60.4	72%	0.721	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-65.4	158.7	173	30.1	-35.1	0	0	0	110.5
126	D	85.4	Confident	92.5	Very high	147 Å²	147	58.9 Å²	58.9	79%	0.786	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-59.5	145.9	172.8	-70.3	-34.1	0	0	0	110.9
127	P	88.8	Confident	92.8	Very high	60 Å²	60	56.9 Å²	56.9	39%	0.39	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-55.7	132.5	178.6	-26.4	35.4	0	0	0	111.8	Q129	P127-Q129 PolarHBondContact O-N 2.75Å
128	P	79.8	Confident	92.9	Very high	112 Å²	112	56.9 Å²	56.9	73%	0.727	34%	0.341	S	S	*	.	S	Bend	trans	-70.8	-18.2	-176	29	-35.9	0	0	0	113	Y620	P128-Y620 HydrophobicContact CG-CE1 4.42Å
129	Q	91.4	Very high	93	Very high	27 Å²	27	54.2 Å²	54.2	13%	0.126	32%	0.322	C	S	.	.	S	Bend	trans	-148.5	159.2	179.9	68.2	-175.2	13.6	0	0	110.2	P127 D131 S148 Y620	P127-Q129 PolarHBondContact O-N 2.75Å; Q129-D131 WeakPolarHBondContact CG-OD1 3.3Å; Q129-D131 VanDerWaalsContact NE2-CG 3.34Å; Q129-D131 PolarHBondContact NE2-OD1 2.96Å; Q129-D131 VanDerWaalsContact NE2-OD1 3.12Å; Q129-D131 PolarHBondContact NE2-OD2 2.98Å; Q129-S148 VanDerWaalsContact O-CB 3.31Å; Q129-S148 WeakPolarHBondContact O-CB 3.27Å; Q129-Y620 PolarHBondContact OE1-OH 3.16Å
130	R	96.3	Very high	93.2	Very high	92 Å²	92	50.7 Å²	50.7	35%	0.347	29%	0.286	S	S	.	.			trans	-90.5	119.5	173.4	-68.8	166.1	-66.7	-82.4	-4.4	109.8	A90 I91 W96 S148	A90-R130 CarbonylContact C-O 3.36Å; A90-R130 VanDerWaalsContact CA-O 3.28Å; A90-R130 WeakPolarHBondContact CA-O 3.43Å; A90-R130 PolarHBondContact N-O 3.14Å; I91-R130 HydrophobicContact CB-CB 4.21Å; I91-R130 PolarHBondContact N-O 3.43Å; I91-R130 PolarHBondContact O-NE 2.86Å; I91-R130 VanDerWaalsContact O-NE 3.08Å; I91-R130 PolarHBondContact O-NH2 2.88Å; W96-R130 HydrophobicContact CD2-CB 4.1Å; W96-R130 HydrophobicContact CD2-CG 4.04Å; W96-R130 HydrophobicContact CE3-CB 3.9Å; W96-R130 HydrophobicContact CE3-CG 4.35Å; W96-R130 HydrophobicContact CG-CG 4.36Å; W96-R130 HydrophobicContact CH2-CB 4.45Å; W96-R130 HydrophobicContact CZ2-CG 4.43Å; W96-R130 HydrophobicContact CZ3-CB 4.07Å; R130-S148 WeakPolarHBondContact CA-OG 3.43Å
131	D	97.8	Very high	93.5	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.027	27%	0.266	C	S	.	.			trans	-121.6	137.9	-179.7	-71.8	-16.4	0	0	0	110.5	S89 A90 Q129 A147 S148	S89-D131 WeakPolarHBondContact CA-OD1 3.07Å; A90-D131 PolarHBondContact N-OD1 3.07Å; Q129-D131 WeakPolarHBondContact CG-OD1 3.3Å; Q129-D131 VanDerWaalsContact NE2-CG 3.34Å; Q129-D131 PolarHBondContact NE2-OD1 2.96Å; Q129-D131 VanDerWaalsContact NE2-OD1 3.12Å; Q129-D131 PolarHBondContact NE2-OD2 2.98Å; D131-A147 HydrophobicContact CB-CB 4.45Å; D131-A147 PolarHBondContact O-N 2.97Å; D131-S148 PolarHBondContact N-OG 3.04Å
132	L	98.5	Very high	93.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.4	174.5	-78	172	0	0	0	110.6	H87 V88 I91 W96 I99 L134 F144 W145 L155 L207	H87-L132 WeakPolarHBondContact CA-O 3.32Å; V88-L132 PolarHBondContact N-O 3.33Å; V88-L132 PolarHBondContact O-N 3.5Å; I91-L132 HydrophobicContact CD1-CB 4.3Å; I91-L132 HydrophobicContact CD1-CD1 3.87Å; I91-L132 HydrophobicContact CD1-CG 4.18Å; I91-L132 HydrophobicContact CG1-CB 4.29Å; I91-L132 HydrophobicContact CG1-CD1 3.84Å; I91-L132 HydrophobicContact CG1-CG 3.83Å; I91-L132 HydrophobicContact CG2-CD1 4.44Å; W96-L132 HydrophobicContact CE3-CD2 4.31Å; W96-L132 HydrophobicContact CE3-CG 4.33Å; W96-L132 HydrophobicContact CH2-CD2 4.47Å; W96-L132 HydrophobicContact CZ3-CD2 3.68Å; W96-L132 HydrophobicContact CZ3-CG 3.87Å; I99-L132 HydrophobicContact CD1-CD1 3.81Å; L132-L134 HydrophobicContact CB-CD2 4.4Å; L132-F144 HydrophobicContact CD1-CD1 4.38Å; L132-W145 WeakPolarHBondContact CA-O 3.4Å; L132-W145 WeakPolarHBondContact CD2-O 3.36Å; L132-L155 HydrophobicContact CD2-CD1 3.67Å; L132-L207 HydrophobicContact CD1-CD2 4.08Å
133	L	98.7	Very high	94.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.2	158.7	178.4	64.6	0	0	0	108	T135 W145 A147 L152 V595 F611	L133-T135 HydrophobicContact CG-CG2 4.43Å; L133-W145 HydrophobicContact CB-CB 4.26Å; L133-W145 PolarHBondContact N-O 2.71Å; L133-W145 WeakPolarHBondContact O-CB 3.39Å; L133-W145 PolarHBondContact O-N 3.37Å; L133-A147 HydrophobicContact CB-CB 3.77Å; L133-L152 HydrophobicContact CD2-CD1 4.32Å; L133-L152 HydrophobicContact CD2-CD2 4.36Å; L133-V595 HydrophobicContact CD1-CG1 4.25Å; L133-F611 HydrophobicContact CD2-CD2 4.07Å; L133-F611 HydrophobicContact CD2-CE2 4.02Å; L133-F611 HydrophobicContact CD2-CZ 4.46Å
134	L	98.8	Very high	94.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.2	173.3	-50.4	-177.7	0	0	0	108.6	S85 H86 L132 V142 R143 F144 I205 L207	S85-L134 CarbonylContact C-O 3.51Å; S85-L134 VanDerWaalsContact CA-O 3.24Å; S85-L134 WeakPolarHBondContact CA-O 3.4Å; H86-L134 HydrophobicContact CB-CB 4.39Å; H86-L134 PolarHBondContact N-O 2.99Å; H86-L134 WeakPolarHBondContact O-CB 3.32Å; H86-L134 PolarHBondContact O-N 2.78Å; L132-L134 HydrophobicContact CB-CD2 4.4Å; L134-V142 HydrophobicContact CB-CG1 4.38Å; L134-R143 WeakPolarHBondContact CA-O 3.17Å; L134-F144 HydrophobicContact CD1-CE1 4.37Å; L134-F144 HydrophobicContact CD2-CB 4.09Å; L134-F144 HydrophobicContact CD2-CD1 3.23Å; L134-F144 HydrophobicContact CD2-CD2 4.02Å; L134-F144 HydrophobicContact CD2-CE1 3.5Å; L134-F144 HydrophobicContact CD2-CE2 4.25Å; L134-F144 HydrophobicContact CD2-CG 3.51Å; L134-F144 HydrophobicContact CD2-CZ 4Å; L134-I205 HydrophobicContact CB-CD1 4.24Å; L134-I205 HydrophobicContact CB-CG2 4.27Å; L134-I205 HydrophobicContact CD1-CG2 3.62Å; L134-L207 HydrophobicContact CD1-CB 3.85Å; L134-L207 HydrophobicContact CD1-CD2 4.06Å
135	T	98.8	Very high	94.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.4	174	57.4	0	0	0	0	110	L133 H137 V142 R143 W145 F611	L133-T135 HydrophobicContact CG-CG2 4.43Å; T135-H137 PolarHBondContact O-CD2 3.45Å; T135-H137 PolarHBondContact O-NE2 2.86Å; T135-H137 PolarHBondContact OG1-CE1 3.41Å; T135-H137 PolarHBondContact OG1-NE2 3.3Å; T135-V142 CarbonylContact O-C 3.6Å; T135-V142 VanDerWaalsContact O-CA 3.28Å; T135-V142 WeakPolarHBondContact O-CA 3.18Å; T135-R143 PolarHBondContact N-O 3.01Å; T135-R143 PolarHBondContact O-N 2.68Å; T135-W145 PolarHBondContact OG1-NE1 3.49Å; T135-F611 HydrophobicContact CG2-CE2 4.07Å; T135-F611 HydrophobicContact CG2-CZ 4.37Å
136	G	98.4	Very high	95.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	144.7	170.8	0	0	0	0	0	110.2	T83 C84	T83-G136 PolarHBondContact N-O 3.22Å; T83-G136 VanDerWaalsContact OG1-C 3.25Å; T83-G136 PolarHBondContact OG1-O 2.69Å; C84-G136 PolarHBondContact N-O 3.12Å; C84-G136 PolarHBondContact O-N 2.87Å
137	H	97.3	Very high	95.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	164.3	-172.9	-58.2	-99.3	0	0	0	112.7	L77 S80 A81 T83 T135 D139 G140 T141 R143 G201 I202	L77-H137 PolarHBondContact O-CE1 2.66Å; S80-H137 PolarHBondContact O-ND1 2.97Å; A81-H137 CarbonylContact O-C 3.56Å; A81-H137 VanDerWaalsContact O-CA 3.23Å; A81-H137 WeakPolarHBondContact O-CA 3.42Å; T83-H137 PolarHBondContact OG1-N 2.67Å; T135-H137 PolarHBondContact O-CD2 3.45Å; T135-H137 PolarHBondContact O-NE2 2.86Å; T135-H137 PolarHBondContact OG1-CE1 3.41Å; T135-H137 PolarHBondContact OG1-NE2 3.3Å; H137-D139 VanDerWaalsContact C-N 3.3Å; H137-D139 VanDerWaalsContact CB-OD1 3.31Å; H137-D139 WeakPolarHBondContact CB-OD1 3.16Å; H137-D139 PolarHBondContact O-N 2.85Å; H137-G140 PolarHBondContact O-N 3.38Å; H137-T141 PolarHBondContact CD2-O 3.25Å; H137-T141 PolarHBondContact N-O 2.86Å; H137-R143 PolarHBondContact CD2-NH1 3.36Å; H137-R143 PolarHBondContact CE1-NH1 3.08Å; H137-R143 PolarHBondContact ND1-NH1 2.98Å; H137-R143 PolarHBondContact NE2-NH1 3.07Å; H137-G201 WeakPolarHBondContact O-CA 3.5Å; H137-I202 PolarHBondContact O-N 2.89Å
138	E	94.6	Very high	96.3	Very high	63 Å²	63	20.6 Å²	20.6	29%	0.294	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-31.6	-178.7	-173.1	168.4	-156.6	0	0	113.1	A81 T83 G140 S195 G201	A81-E138 HydrophobicContact CB-CB 4.2Å; A81-E138 PolarHBondContact O-N 3.49Å; T83-E138 HydrophobicContact CG2-CB 4.16Å; E138-G140 PolarHBondContact O-N 3.43Å; E138-S195 VanDerWaalsContact CD-OG 3.29Å; E138-S195 PolarHBondContact OE1-OG 2.76Å; E138-G201 WeakPolarHBondContact O-CA 3.29Å; E138-G201 PolarHBondContact O-N 3.21Å; E138-G201 VanDerWaalsContact O-N 3.12Å
139	D	92.5	Very high	96.9	Very high	56 Å²	56	16 Å²	16	30%	0.299	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	2.1	177	67.4	-3.5	0	0	0	114.5	S80 H137 T141	S80-D139 VanDerWaalsContact CB-CG 3.41Å; S80-D139 VanDerWaalsContact CB-OD2 3.24Å; S80-D139 WeakPolarHBondContact CB-OD2 3.24Å; S80-D139 WeakPolarHBondContact OG-CB 3.24Å; S80-D139 VanDerWaalsContact OG-CG 3.29Å; S80-D139 PolarHBondContact OG-N 2.86Å; H137-D139 VanDerWaalsContact C-N 3.3Å; H137-D139 VanDerWaalsContact CB-OD1 3.31Å; H137-D139 WeakPolarHBondContact CB-OD1 3.16Å; H137-D139 PolarHBondContact O-N 2.85Å; D139-T141 VanDerWaalsContact CG-OG1 3.3Å; D139-T141 VanDerWaalsContact OD1-CB 3.28Å; D139-T141 WeakPolarHBondContact OD1-CB 3.03Å; D139-T141 WeakPolarHBondContact OD1-CG2 3.37Å; D139-T141 PolarHBondContact OD1-N 3.08Å; D139-T141 PolarHBondContact OD1-OG1 3.34Å; D139-T141 WeakPolarHBondContact OD2-CG2 3.19Å; D139-T141 PolarHBondContact OD2-OG1 3.21Å
140	G	95.9	Very high	97	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	80.1	14.1	-176	0	0	0	0	0	114.4	H137 E138 T160 L200	H137-G140 PolarHBondContact O-N 3.38Å; E138-G140 PolarHBondContact O-N 3.43Å; G140-T160 WeakPolarHBondContact O-CG2 3.5Å; G140-T160 PolarHBondContact O-N 3.24Å; G140-T160 VanDerWaalsContact O-N 3.1Å; G140-T160 PolarHBondContact O-OG1 3.05Å; G140-L200 VanDerWaalsContact CA-O 3.26Å; G140-L200 WeakPolarHBondContact CA-O 3.29Å
141	T	97.7	Very high	96.9	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.043	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	150.8	172.8	61.4	0	0	0	0	112.4	H137 D139 R143 K157 L158	H137-T141 PolarHBondContact CD2-O 3.25Å; H137-T141 PolarHBondContact N-O 2.86Å; D139-T141 VanDerWaalsContact CG-OG1 3.3Å; D139-T141 VanDerWaalsContact OD1-CB 3.28Å; D139-T141 WeakPolarHBondContact OD1-CB 3.03Å; D139-T141 WeakPolarHBondContact OD1-CG2 3.37Å; D139-T141 PolarHBondContact OD1-N 3.08Å; D139-T141 PolarHBondContact OD1-OG1 3.34Å; D139-T141 WeakPolarHBondContact OD2-CG2 3.19Å; D139-T141 PolarHBondContact OD2-OG1 3.21Å; T141-R143 PolarHBondContact OG1-NH1 2.87Å; T141-K157 HydrophobicContact CG2-CD 4.35Å; T141-K157 HydrophobicContact CG2-CG 4.49Å; T141-L158 CarbonylContact C-O 3.56Å; T141-L158 WeakPolarHBondContact CA-O 3.49Å; T141-L158 WeakPolarHBondContact CB-O 3.38Å
142	V	98.7	Very high	96.8	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.2	165.9	180	0	0	0	0	108.9	L134 T135 F144 L158 I202 I205 V216	L134-V142 HydrophobicContact CB-CG1 4.38Å; T135-V142 CarbonylContact O-C 3.6Å; T135-V142 VanDerWaalsContact O-CA 3.28Å; T135-V142 WeakPolarHBondContact O-CA 3.18Å; V142-F144 HydrophobicContact CG1-CD2 4.39Å; V142-F144 HydrophobicContact CG1-CE2 3.95Å; V142-L158 HydrophobicContact CB-CB 4.2Å; V142-L158 HydrophobicContact CB-CD2 4.34Å; V142-L158 PolarHBondContact N-O 3.17Å; V142-L158 PolarHBondContact O-N 3.33Å; V142-I202 HydrophobicContact CG2-CB 4.5Å; V142-I202 HydrophobicContact CG2-CD1 4.4Å; V142-I202 HydrophobicContact CG2-CG1 3.93Å; V142-I202 HydrophobicContact CG2-CG2 4.05Å; V142-I205 HydrophobicContact CG1-CD1 3.75Å; V142-I205 HydrophobicContact CG1-CG1 4.47Å; V142-I205 HydrophobicContact CG2-CD1 4.08Å; V142-I205 HydrophobicContact CG2-CG1 4.31Å; V142-V216 HydrophobicContact CG2-CG1 3.96Å
143	R	98.4	Very high	96.6	Very high	27 Å²	27	21.4 Å²	21.4	10%	0.102	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.8	179.1	-64.9	177.7	178.6	69.4	1	110.2	S79 L134 T135 H137 T141 W145 K157	S79-R143 VanDerWaalsContact OG-CZ 3.25Å; S79-R143 PolarHBondContact OG-NE 3.24Å; S79-R143 PolarHBondContact OG-NH2 3.45Å; L134-R143 WeakPolarHBondContact CA-O 3.17Å; T135-R143 PolarHBondContact N-O 3.01Å; T135-R143 PolarHBondContact O-N 2.68Å; H137-R143 PolarHBondContact CD2-NH1 3.36Å; H137-R143 PolarHBondContact CE1-NH1 3.08Å; H137-R143 PolarHBondContact ND1-NH1 2.98Å; H137-R143 PolarHBondContact NE2-NH1 3.07Å; T141-R143 PolarHBondContact OG1-NH1 2.87Å; R143-W145 HydrophobicContact CB-CZ2 3.76Å; R143-W145 VanDerWaalsContact CD-CZ2 3.49Å; R143-W145 HydrophobicContact CG-CZ2 4.26Å; R143-K157 HydrophobicContact CG-CG 4.16Å
144	F	98.6	Very high	96.4	Very high	1 Å²	1	23 Å²	23	0%	0.004	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122	180	-72.6	-118.8	0	0	0	108.5	I99 L132 L134 V142 L155 Y156 L158 L207 L214 F272	I99-F144 HydrophobicContact CD1-CD1 4.23Å; I99-F144 HydrophobicContact CD1-CE1 4.32Å; I99-F144 HydrophobicContact CG2-CB 4.49Å; I99-F144 HydrophobicContact CG2-CD1 4.17Å; L132-F144 HydrophobicContact CD1-CD1 4.38Å; L134-F144 HydrophobicContact CD1-CE1 4.37Å; L134-F144 HydrophobicContact CD2-CB 4.09Å; L134-F144 HydrophobicContact CD2-CD1 3.23Å; L134-F144 HydrophobicContact CD2-CD2 4.02Å; L134-F144 HydrophobicContact CD2-CE1 3.5Å; L134-F144 HydrophobicContact CD2-CE2 4.25Å; L134-F144 HydrophobicContact CD2-CG 3.51Å; L134-F144 HydrophobicContact CD2-CZ 4Å; V142-F144 HydrophobicContact CG1-CD2 4.39Å; V142-F144 HydrophobicContact CG1-CE2 3.95Å; F144-L155 HydrophobicContact CB-CB 4.4Å; F144-L155 PolarHBondContact O-N 3.04Å; F144-Y156 WeakPolarHBondContact CB-O 3.4Å; F144-Y156 AromaticContact CD2-CD1 3.58Å; F144-Y156 HydrophobicContact CD2-CD1 3.58Å; F144-Y156 HydrophobicContact CD2-CE1 4.33Å; F144-Y156 AromaticContact CE2-CD1 3.76Å; F144-Y156 HydrophobicContact CE2-CD1 3.76Å; F144-Y156 HydrophobicContact CE2-CE1 4.09Å; F144-Y156 HydrophobicContact CG-CD1 4.07Å; F144-Y156 HydrophobicContact CZ-CD1 4.38Å; F144-Y156 PolarHBondContact N-O 2.79Å; F144-L158 HydrophobicContact CE2-CB 4.49Å; F144-L207 HydrophobicContact CE1-CD2 4.23Å; F144-L214 HydrophobicContact CZ-CD2 4.03Å; F144-F272 HydrophobicContact CD1-CE2 4.42Å; F144-F272 HydrophobicContact CE1-CD2 4.24Å; F144-F272 AromaticContact CE1-CE2 3.46Å; F144-F272 HydrophobicContact CE1-CE2 3.46Å; F144-F272 VanDerWaalsContact CE1-CE2 3.46Å; F144-F272 AromaticContact CE1-CZ 3.93Å; F144-F272 HydrophobicContact CE1-CZ 3.93Å; F144-F272 HydrophobicContact CE2-CD2 4.36Å; F144-F272 HydrophobicContact CE2-CE2 4.37Å; F144-F272 AromaticContact CZ-CD2 3.76Å; F144-F272 HydrophobicContact CZ-CD2 3.76Å; F144-F272 AromaticContact CZ-CE2 3.44Å; F144-F272 HydrophobicContact CZ-CE2 3.44Å; F144-F272 VanDerWaalsContact CZ-CE2 3.44Å; F144-F272 HydrophobicContact CZ-CZ 4.04Å
145	W	98.1	Very high	96.3	Very high	4 Å²	4	24 Å²	24	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.4	-176.5	-50.7	94.5	0	0	0	110.9	V75 L77 L132 L133 T135 R143 A147 L152 Y153 P154	V75-W145 HydrophobicContact CB-CH2 4.26Å; V75-W145 HydrophobicContact CB-CZ3 3.89Å; V75-W145 HydrophobicContact CG1-CH2 3.71Å; V75-W145 HydrophobicContact CG1-CZ3 3.68Å; V75-W145 HydrophobicContact CG2-CZ3 4.42Å; L77-W145 HydrophobicContact CD2-CD2 4.14Å; L77-W145 HydrophobicContact CD2-CE3 4.01Å; L77-W145 HydrophobicContact CD2-CH2 3.35Å; L77-W145 HydrophobicContact CD2-CZ2 3.46Å; L77-W145 VanDerWaalsContact CD2-CZ2 3.46Å; L77-W145 HydrophobicContact CD2-CZ3 3.62Å; L132-W145 WeakPolarHBondContact CA-O 3.4Å; L132-W145 WeakPolarHBondContact CD2-O 3.36Å; L133-W145 HydrophobicContact CB-CB 4.26Å; L133-W145 PolarHBondContact N-O 2.71Å; L133-W145 WeakPolarHBondContact O-CB 3.39Å; L133-W145 PolarHBondContact O-N 3.37Å; T135-W145 PolarHBondContact OG1-NE1 3.49Å; R143-W145 HydrophobicContact CB-CZ2 3.76Å; R143-W145 VanDerWaalsContact CD-CZ2 3.49Å; R143-W145 HydrophobicContact CG-CZ2 4.26Å; W145-A147 PolarHBondContact O-N 3.41Å; W145-A147 VanDerWaalsContact O-N 3.12Å; W145-L152 HydrophobicContact CB-CD1 3.57Å; W145-L152 HydrophobicContact CB-CG 3.89Å; W145-L152 HydrophobicContact CD2-CG 4.39Å; W145-L152 HydrophobicContact CE3-CG 4.23Å; W145-L152 HydrophobicContact CG-CD1 4.36Å; W145-L152 HydrophobicContact CG-CG 4.27Å; W145-Y153 CarbonylContact C-O 3.48Å; W145-Y153 VanDerWaalsContact CA-O 3.25Å; W145-Y153 WeakPolarHBondContact CA-O 3.42Å; W145-P154 HydrophobicContact CE3-CB 3.99Å; W145-P154 HydrophobicContact CH2-CB 4.45Å; W145-P154 HydrophobicContact CZ3-CB 3.68Å; W145-P154 HydrophobicContact CZ3-CG 4.35Å
146	D	97.8	Very high	96.3	Very high	28 Å²	28	24.9 Å²	24.9	15%	0.15	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	103.2	164.9	-175.8	-6.5	0	0	0	108.9	W96 S148 L152 Y153 L155	W96-D146 HydrophobicContact CH2-CB 3.8Å; W96-D146 VanDerWaalsContact CH2-CG 3.43Å; W96-D146 WeakPolarHBondContact CH2-OD1 3.31Å; W96-D146 HydrophobicContact CZ2-CB 4.25Å; D146-S148 WeakPolarHBondContact OD1-CB 2.94Å; D146-S148 PolarHBondContact OD1-N 3.33Å; D146-S148 PolarHBondContact OD1-OG 2.95Å; D146-L152 WeakPolarHBondContact O-CA 3.34Å; D146-L152 WeakPolarHBondContact O-CD1 3.44Å; D146-Y153 HydrophobicContact CB-CD2 4.3Å; D146-Y153 PolarHBondContact N-O 3.02Å; D146-Y153 PolarHBondContact O-N 3.28Å; D146-L155 HydrophobicContact CB-CD1 4Å; D146-L155 HydrophobicContact CB-CD2 4.07Å; D146-L155 HydrophobicContact CB-CG 4.09Å
147	A	97.2	Very high	96.2	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.008	15%	0.151	C	C	.	.			trans	-101.1	21.5	176.3	0	0	0	0	0	111.4	D131 L133 W145 L152 F603 R613	D131-A147 HydrophobicContact CB-CB 4.45Å; D131-A147 PolarHBondContact O-N 2.97Å; L133-A147 HydrophobicContact CB-CB 3.77Å; W145-A147 PolarHBondContact O-N 3.41Å; W145-A147 VanDerWaalsContact O-N 3.12Å; A147-L152 HydrophobicContact CB-CD1 3.97Å; A147-F603 HydrophobicContact CB-CZ 4.16Å; A147-R613 PolarHBondContact O-NH2 2.83Å
148	S	96.4	Very high	96.2	Very high	9 Å²	9	29.4 Å²	29.4	6%	0.063	15%	0.152	C	C	.	.	S	Bend	trans	-74.3	-44.5	-178.3	-45.5	0	0	0	0	111.5	Q129 R130 D131 D146	Q129-S148 VanDerWaalsContact O-CB 3.31Å; Q129-S148 WeakPolarHBondContact O-CB 3.27Å; R130-S148 WeakPolarHBondContact CA-OG 3.43Å; D131-S148 PolarHBondContact N-OG 3.04Å; D146-S148 WeakPolarHBondContact OD1-CB 2.94Å; D146-S148 PolarHBondContact OD1-N 3.33Å; D146-S148 PolarHBondContact OD1-OG 2.95Å
149	G	93.6	Very high	96.3	Very high	15 Å²	15	29 Å²	29	16%	0.155	16%	0.157	C	C	.	.	S	Bend	trans	-107.6	-157.3	-171.3	0	0	0	0	0	114.8	R613 V622	G149-R613 PolarHBondContact O-NH1 2.86Å; G149-V622 VanDerWaalsContact C-CG1 3.4Å; G149-V622 WeakPolarHBondContact O-CG1 3.38Å
150	V	94	Very high	96.5	Very high	75 Å²	75	26.4 Å²	26.4	46%	0.455	14%	0.143	S	C	.	.	S	Bend	trans	-75	-41.7	177.1	175	0	0	0	0	111.1	V622 E623 P624	V150-V622 HydrophobicContact CG2-CG1 3.89Å; V150-E623 WeakPolarHBondContact CG2-O 3.38Å; V150-P624 HydrophobicContact CG1-CB 3.99Å; V150-P624 HydrophobicContact CG1-CG 4.48Å
151	C	93.4	Very high	96.4	Very high	35 Å²	35	27.1 Å²	27.1	24%	0.236	15%	0.148	C	C	.	.	S	Bend	trans	-85.3	133.6	176.7	-65.5	0	0	0	0	109.9	Y153	C151-Y153 HydrophobicContact CB-CD2 3.95Å; C151-Y153 HydrophobicContact CB-CE1 3.97Å; C151-Y153 HydrophobicContact CB-CE2 3.3Å; C151-Y153 HydrophobicContact CB-CG 4.5Å; C151-Y153 WeakPolarHBondContact CB-OH 3.48Å; C151-Y153 WeakPolarHBondContact O-CD2 3.15Å; C151-Y153 PolarHBondContact O-N 2.95Å
152	L	95.7	Very high	96.1	Very high	37 Å²	37	28.5 Å²	28.5	19%	0.194	16%	0.16	C	C	.	.			trans	-92.3	90.9	175.3	-172	67.1	0	0	0	109	L77 L133 W145 D146 A147	L77-L152 HydrophobicContact CD1-CD2 4.04Å; L77-L152 HydrophobicContact CD2-CD2 3.99Å; L133-L152 HydrophobicContact CD2-CD1 4.32Å; L133-L152 HydrophobicContact CD2-CD2 4.36Å; W145-L152 HydrophobicContact CB-CD1 3.57Å; W145-L152 HydrophobicContact CB-CG 3.89Å; W145-L152 HydrophobicContact CD2-CG 4.39Å; W145-L152 HydrophobicContact CE3-CG 4.23Å; W145-L152 HydrophobicContact CG-CD1 4.36Å; W145-L152 HydrophobicContact CG-CG 4.27Å; D146-L152 WeakPolarHBondContact O-CA 3.34Å; D146-L152 WeakPolarHBondContact O-CD1 3.44Å; A147-L152 HydrophobicContact CB-CD1 3.97Å
153	Y	94.3	Very high	95.9	Very high	91 Å²	91	28.6 Å²	28.6	36%	0.357	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	136.3	-173.5	-61	-85.2	0	0	0	112.2	P72 W145 D146 C151	P72-Y153 HydrophobicContact CB-CD1 4.08Å; P72-Y153 HydrophobicContact CB-CE1 3.62Å; P72-Y153 WeakPolarHBondContact O-CD1 3.19Å; P72-Y153 WeakPolarHBondContact O-CE1 3.49Å; W145-Y153 CarbonylContact C-O 3.48Å; W145-Y153 VanDerWaalsContact CA-O 3.25Å; W145-Y153 WeakPolarHBondContact CA-O 3.42Å; D146-Y153 HydrophobicContact CB-CD2 4.3Å; D146-Y153 PolarHBondContact N-O 3.02Å; D146-Y153 PolarHBondContact O-N 3.28Å; C151-Y153 HydrophobicContact CB-CD2 3.95Å; C151-Y153 HydrophobicContact CB-CE1 3.97Å; C151-Y153 HydrophobicContact CB-CE2 3.3Å; C151-Y153 HydrophobicContact CB-CG 4.5Å; C151-Y153 WeakPolarHBondContact CB-OH 3.48Å; C151-Y153 WeakPolarHBondContact O-CD2 3.15Å; C151-Y153 PolarHBondContact O-N 2.95Å
154	P	94.9	Very high	95.7	Very high	34 Å²	34	27.5 Å²	27.5	22%	0.221	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.1	171.4	28.9	-31.7	0	0	0	110.2	V75 W145	V75-P154 HydrophobicContact CG1-CG 4.44Å; V75-P154 HydrophobicContact CG2-CG 4.06Å; W145-P154 HydrophobicContact CE3-CB 3.99Å; W145-P154 HydrophobicContact CH2-CB 4.45Å; W145-P154 HydrophobicContact CZ3-CB 3.68Å; W145-P154 HydrophobicContact CZ3-CG 4.35Å
155	L	96.5	Very high	95.1	Very high	22 Å²	22	30.4 Å²	30.4	12%	0.115	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-51.2	-179.6	-59.6	-178.6	0	0	0	112.3	W96 I99 I100 G103 L132 F144 D146	W96-L155 HydrophobicContact CE3-CD1 4.47Å; W96-L155 HydrophobicContact CH2-CD1 3.63Å; W96-L155 HydrophobicContact CZ2-CD1 4.03Å; W96-L155 HydrophobicContact CZ3-CD1 3.88Å; I99-L155 HydrophobicContact CG2-CB 4.26Å; I100-L155 HydrophobicContact CG1-CD2 4.19Å; G103-L155 WeakPolarHBondContact CA-O 3.34Å; L132-L155 HydrophobicContact CD2-CD1 3.67Å; F144-L155 HydrophobicContact CB-CB 4.4Å; F144-L155 PolarHBondContact O-N 3.04Å; D146-L155 HydrophobicContact CB-CD1 4Å; D146-L155 HydrophobicContact CB-CD2 4.07Å; D146-L155 HydrophobicContact CB-CG 4.09Å
156	Y	97.8	Very high	93.6	Very high	17 Å²	17	32.1 Å²	32.1	7%	0.067	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	149.5	-173.3	169.8	-105	0	0	0	111	A102 F144 L158 F272	A102-Y156 HydrophobicContact CB-CD2 4.03Å; A102-Y156 HydrophobicContact CB-CE2 4.15Å; F144-Y156 WeakPolarHBondContact CB-O 3.4Å; F144-Y156 AromaticContact CD2-CD1 3.58Å; F144-Y156 HydrophobicContact CD2-CD1 3.58Å; F144-Y156 HydrophobicContact CD2-CE1 4.33Å; F144-Y156 AromaticContact CE2-CD1 3.76Å; F144-Y156 HydrophobicContact CE2-CD1 3.76Å; F144-Y156 HydrophobicContact CE2-CE1 4.09Å; F144-Y156 HydrophobicContact CG-CD1 4.07Å; F144-Y156 HydrophobicContact CZ-CD1 4.38Å; F144-Y156 PolarHBondContact N-O 2.79Å; Y156-L158 HydrophobicContact CE1-CB 3.87Å; Y156-F272 HydrophobicContact CD1-CD2 4.15Å; Y156-F272 HydrophobicContact CE1-CB 4.44Å; Y156-F272 AromaticContact CE1-CD2 3.65Å; Y156-F272 HydrophobicContact CE1-CD2 3.65Å; Y156-F272 HydrophobicContact CE1-CE2 4.48Å; Y156-F272 PolarHBondContact OH-N 3.33Å; Y156-F272 VanDerWaalsContact OH-N 3.1Å
157	K	97.4	Very high	91.4	Very high	89 Å²	89	38.3 Å²	38.3	39%	0.387	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	115.3	175.5	-176.7	-177	71.2	171.4	0	110.9	Q106 T141 R143	Q106-K157 PolarHBondContact NE2-O 2.94Å; Q106-K157 PolarHBondContact OE1-O 3.18Å; T141-K157 HydrophobicContact CG2-CD 4.35Å; T141-K157 HydrophobicContact CG2-CG 4.49Å; R143-K157 HydrophobicContact CG-CG 4.16Å
158	L	97.9	Very high	88.9	Confident	6 Å²	6	41.4 Å²	41.4	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	137	167.2	174.5	63	0	0	0	110	T141 V142 F144 Y156 T160 L214 V216 L226 F272	T141-L158 CarbonylContact C-O 3.56Å; T141-L158 WeakPolarHBondContact CA-O 3.49Å; T141-L158 WeakPolarHBondContact CB-O 3.38Å; V142-L158 HydrophobicContact CB-CB 4.2Å; V142-L158 HydrophobicContact CB-CD2 4.34Å; V142-L158 PolarHBondContact N-O 3.17Å; V142-L158 PolarHBondContact O-N 3.33Å; F144-L158 HydrophobicContact CE2-CB 4.49Å; Y156-L158 HydrophobicContact CE1-CB 3.87Å; L158-T160 HydrophobicContact CD2-CG2 4.43Å; L158-T160 HydrophobicContact CG-CG2 4.49Å; L158-L214 HydrophobicContact CD2-CD2 3.68Å; L158-V216 HydrophobicContact CD2-CG1 4.48Å; L158-L226 HydrophobicContact CD1-CD2 3.7Å; L158-L226 HydrophobicContact CD2-CD1 4.48Å; L158-L226 HydrophobicContact CD2-CD2 3.66Å; L158-L226 HydrophobicContact CG-CD2 4.3Å; L158-F272 HydrophobicContact CD1-CB 4.26Å; L158-F272 WeakPolarHBondContact CD1-O 3.44Å
159	S	96.1	Very high	86.1	Confident	55 Å²	55	47.7 Å²	47.7	39%	0.385	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.4	167.2	179.6	0	0	0	0	109.8
160	T	96.6	Very high	83.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	30%	0.297	C	S	.	.	S	Bend	trans	-85.6	-15	177.1	67.4	0	0	0	0	112.9	G140 L158 A162 V163 F164 I202 V216 L224	G140-T160 WeakPolarHBondContact O-CG2 3.5Å; G140-T160 PolarHBondContact O-N 3.24Å; G140-T160 VanDerWaalsContact O-N 3.1Å; G140-T160 PolarHBondContact O-OG1 3.05Å; L158-T160 HydrophobicContact CD2-CG2 4.43Å; L158-T160 HydrophobicContact CG-CG2 4.49Å; T160-A162 PolarHBondContact O-N 3.15Å; T160-V163 WeakPolarHBondContact O-CB 3.49Å; T160-V163 PolarHBondContact O-N 3.31Å; T160-F164 WeakPolarHBondContact O-CD2 3.36Å; T160-I202 HydrophobicContact CG2-CD1 4.09Å; T160-V216 HydrophobicContact CG2-CG2 3.87Å; T160-L224 HydrophobicContact CG2-CD2 4.07Å
161	A	93.3	Very high	81.3	Confident	14 Å²	14	54.3 Å²	54.3	12%	0.116	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-59.8	-30.3	-175.7	0	0	0	0	0	112.7	V163 F164 L170 L200	A161-V163 PolarHBondContact O-N 2.85Å; A161-V163 VanDerWaalsContact O-N 3.09Å; A161-F164 PolarHBondContact O-N 3.02Å; A161-L170 HydrophobicContact CB-CD1 4.18Å; A161-L200 HydrophobicContact CB-CD1 4.24Å; A161-L200 HydrophobicContact CB-CD2 4.43Å
162	A	91.8	Very high	78.7	Confident	36 Å²	36	58.5 Å²	58.5	30%	0.298	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-60.3	-20.8	179.4	0	0	0	0	0	114.1	T160 F164 R262 V266 F268	T160-A162 PolarHBondContact O-N 3.15Å; A162-F164 VanDerWaalsContact C-N 3.31Å; A162-R262 WeakPolarHBondContact O-CD 3.3Å; A162-R262 PolarHBondContact O-NE 3.04Å; A162-V266 HydrophobicContact CB-CG1 4.49Å; A162-F268 HydrophobicContact CB-CE1 4.23Å
163	V	94.9	Very high	76	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.012	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-76.8	-21.4	177.1	-178.1	0	0	0	0	112.1	T160 A161 L224 V237 V261 R262 F268 P274 V277	T160-V163 WeakPolarHBondContact O-CB 3.49Å; T160-V163 PolarHBondContact O-N 3.31Å; A161-V163 PolarHBondContact O-N 2.85Å; A161-V163 VanDerWaalsContact O-N 3.09Å; V163-L224 HydrophobicContact CB-CD2 4.36Å; V163-L224 HydrophobicContact CG2-CD2 3.86Å; V163-V237 HydrophobicContact CG1-CB 4.12Å; V163-V237 HydrophobicContact CG1-CG1 4.13Å; V163-V237 HydrophobicContact CG1-CG2 4.2Å; V163-V237 HydrophobicContact CG2-CG2 4.45Å; V163-V261 HydrophobicContact CG1-CG1 4.09Å; V163-R262 PolarHBondContact O-N 3.18Å; V163-F268 HydrophobicContact CG2-CE1 4.07Å; V163-F268 HydrophobicContact CG2-CZ 4.1Å; V163-P274 HydrophobicContact CG2-CB 4.06Å; V163-P274 HydrophobicContact CG2-CG 3.42Å; V163-P274 VanDerWaalsContact CG2-CG 3.42Å; V163-V277 HydrophobicContact CG1-CG2 3.7Å
164	F	94.3	Very high	73.4	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.018	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-108.1	148.1	-172	-55.1	-71.9	0	0	0	111.5	T160 A161 A162 A166 L200 Q222 L224 L259 D260 V261 R262	T160-F164 WeakPolarHBondContact O-CD2 3.36Å; A161-F164 PolarHBondContact O-N 3.02Å; A162-F164 VanDerWaalsContact C-N 3.31Å; F164-A166 PolarHBondContact O-N 3.24Å; F164-L200 HydrophobicContact CD2-CD2 3.79Å; F164-L200 HydrophobicContact CE2-CD2 4.28Å; F164-Q222 HydrophobicContact CE1-CB 4.44Å; F164-Q222 HydrophobicContact CE1-CG 4.48Å; F164-Q222 HydrophobicContact CE2-CG 4.42Å; F164-Q222 HydrophobicContact CZ-CB 4.08Å; F164-Q222 HydrophobicContact CZ-CG 3.76Å; F164-L224 HydrophobicContact CE2-CD1 4.4Å; F164-L224 HydrophobicContact CZ-CD1 4.07Å; F164-L259 HydrophobicContact CB-CB 4.49Å; F164-L259 HydrophobicContact CD1-CB 3.44Å; F164-L259 VanDerWaalsContact CD1-CB 3.44Å; F164-L259 HydrophobicContact CD1-CD1 4.19Å; F164-L259 HydrophobicContact CD1-CG 4.41Å; F164-L259 HydrophobicContact CD2-CD1 4.05Å; F164-L259 HydrophobicContact CE1-CB 3.75Å; F164-L259 HydrophobicContact CE1-CD1 4.16Å; F164-L259 HydrophobicContact CE2-CD1 4.04Å; F164-L259 HydrophobicContact CG-CB 3.96Å; F164-L259 HydrophobicContact CG-CD1 4.14Å; F164-L259 HydrophobicContact CZ-CD1 4.1Å; F164-D260 CarbonylContact C-O 3.48Å; F164-D260 WeakPolarHBondContact CA-O 3.33Å; F164-V261 HydrophobicContact CD1-CG2 4.03Å; F164-V261 HydrophobicContact CE1-CG2 3.82Å; F164-R262 PolarHBondContact O-NE 2.83Å; F164-R262 PolarHBondContact O-NH2 3.38Å
165	S	86.2	Confident	70.7	Confident	62 Å²	62	66.8 Å²	66.8	43%	0.434	39%	0.386	S	S	.	.			trans	-72	118.1	167.9	-63	0	0	0	0	107.5	D260	S165-D260 PolarHBondContact N-O 3.05Å
166	A	64.8	Low	68.3	Low	41 Å²	41	74.4 Å²	74.4	34%	0.339	42%	0.421	S	S	.	.			trans	-88.2	131.7	173	0	0	0	0	0	107.9	F164 A168 L170	F164-A166 PolarHBondContact O-N 3.24Å; A166-A168 WeakPolarHBondContact CB-O 3.25Å; A166-A168 PolarHBondContact O-N 2.88Å; A166-L170 HydrophobicContact CB-CD1 4.12Å; A166-L170 HydrophobicContact CB-CG 4.3Å
167	D	52.3	Low	65.9	Low	157 Å²	157	75.4 Å²	75.4	84%	0.84	44%	0.436	S	S	*	.	S	Bend	trans	-68.7	-9	170.1	-75.3	-37.4	0	0	0	112.1
168	A	45.2	Very low	63.5	Low	67 Å²	67	74.7 Å²	74.7	55%	0.554	45%	0.447	S	S	*	.	S	Bend	trans	-129.3	123.3	173.9	0	0	0	0	0	108.6	A166 L170	A166-A168 WeakPolarHBondContact CB-O 3.25Å; A166-A168 PolarHBondContact O-N 2.88Å; A168-L170 PolarHBondContact O-N 2.87Å
169	D	37.9	Very low	61.3	Low	140 Å²	140	84.4 Å²	84.4	75%	0.749	49%	0.492	S	S	*	.			trans	-59.6	97	174.3	-73.6	-49.9	0	0	0	110.2	N171 D172	D169-N171 PolarHBondContact O-N 3.35Å; D169-D172 PolarHBondContact O-N 2.74Å
170	L	46.3	Very low	59.6	Low	82 Å²	82	85.7 Å²	85.7	43%	0.429	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-59.8	-6.2	179.7	-71.9	164.7	0	0	0	113.8	A161 A166 A168 D196	A161-L170 HydrophobicContact CB-CD1 4.18Å; A166-L170 HydrophobicContact CB-CD1 4.12Å; A166-L170 HydrophobicContact CB-CG 4.3Å; A168-L170 PolarHBondContact O-N 2.87Å; L170-D196 HydrophobicContact CD2-CB 4.37Å; L170-D196 VanDerWaalsContact CD2-OD2 3.28Å; L170-D196 WeakPolarHBondContact CD2-OD2 3.47Å
171	N	40	Very low	58.5	Low	147 Å²	147	89.9 Å²	89.9	79%	0.786	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-81.4	-8.8	178.2	-100.5	-0.3	0	0	0	114.3	D169 N173	D169-N171 PolarHBondContact O-N 3.35Å; N171-N173 VanDerWaalsContact C-N 3.28Å; N171-N173 PolarHBondContact O-N 3.31Å
172	D	38.4	Very low	57.9	Low	123 Å²	123	97.6 Å²	97.6	66%	0.658	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-74.9	-13.4	-179	-96.9	-7.2	0	0	0	114.2	D169 M174 S175	D169-D172 PolarHBondContact O-N 2.74Å; D172-M174 VanDerWaalsContact C-N 3.29Å; D172-M174 PolarHBondContact O-N 3.41Å; D172-S175 PolarHBondContact O-N 3.06Å; D172-S175 PolarHBondContact O-OG 3.18Å
173	N	40.2	Very low	57.7	Low	94 Å²	94	96.3 Å²	96.3	50%	0.503	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-78.4	-8	179.7	-90.8	-18.6	0	0	0	114.7	N171	N171-N173 VanDerWaalsContact C-N 3.28Å; N171-N173 PolarHBondContact O-N 3.31Å
174	M	39.8	Very low	57.6	Low	156 Å²	156	97.9 Å²	97.9	77%	0.768	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-118.5	32.6	169.5	-86.6	-67.6	-164.5	0	0	111.2	D172 Q176	D172-M174 VanDerWaalsContact C-N 3.29Å; D172-M174 PolarHBondContact O-N 3.41Å; M174-Q176 VanDerWaalsContact C-N 3.27Å; M174-Q176 PolarHBondContact O-N 3.02Å
175	S	38.1	Very low	57.5	Low	86 Å²	86	98.7 Å²	98.7	60%	0.601	56%	0.562	S	S	*	*			trans	-59.5	98.4	158.5	41.2	0	0	0	0	107.5	D172 G177	D172-S175 PolarHBondContact O-N 3.06Å; D172-S175 PolarHBondContact O-OG 3.18Å; S175-G177 PolarHBondContact O-N 3.27Å; S175-G177 VanDerWaalsContact O-N 3.09Å
176	Q	45.1	Very low	57.8	Low	183 Å²	183	99 Å²	99	86%	0.855	55%	0.554	S	S	*	*			trans	-48.7	119.8	159.1	-69.2	179	3.8	0	0	105.1	M174 A178	M174-Q176 VanDerWaalsContact C-N 3.27Å; M174-Q176 PolarHBondContact O-N 3.02Å; Q176-A178 PolarHBondContact O-N 3.41Å; Q176-A178 VanDerWaalsContact O-N 3.15Å
177	G	47.2	Very low	59.2	Low	38 Å²	38	101.3 Å²	101.3	39%	0.392	56%	0.556	S	S	.	*			trans	-43.1	127.2	-177.3	0	0	0	0	0	109.3	S175 E179	S175-G177 PolarHBondContact O-N 3.27Å; S175-G177 VanDerWaalsContact O-N 3.09Å; G177-E179 PolarHBondContact O-N 2.62Å
178	A	47	Very low	61.1	Low	73 Å²	73	94.1 Å²	94.1	60%	0.603	52%	0.518	S	S	*	.			trans	-50.5	134.5	-176.9	0	0	0	0	0	109	Q176 G180 E181	Q176-A178 PolarHBondContact O-N 3.41Å; Q176-A178 VanDerWaalsContact O-N 3.15Å; A178-G180 PolarHBondContact O-N 2.95Å; A178-E181 PolarHBondContact O-N 3.09Å
179	E	51.2	Low	63.3	Low	210 Å²	210	92.5 Å²	92.5	98%	0.981	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	113.5	175.9	-78.1	-168.4	151.2	0	0	109.4	G177	G177-E179 PolarHBondContact O-N 2.62Å
180	G	61.9	Low	65.8	Low	82 Å²	82	88.7 Å²	88.7	85%	0.845	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.6	-2.6	-177.5	0	0	0	0	0	116.4	A178 W182	A178-G180 PolarHBondContact O-N 2.95Å; G180-W182 PolarHBondContact O-N 3.18Å
181	E	72.3	Confident	68	Low	91 Å²	91	86.1 Å²	86.1	43%	0.425	48%	0.477	S	S	.	.			trans	-68.6	129	173.7	-165.2	174.8	-179	0	0	111.5	A178 P183	A178-E181 PolarHBondContact O-N 3.09Å; E181-P183 CarbonylContact O-C 3.55Å
182	W	80.6	Confident	70.2	Confident	175 Å²	175	81.2 Å²	81.2	66%	0.663	45%	0.451	S	S	*	.	S	Bend	trans	-125.2	125.3	177.9	-177.6	-97.2	0	0	0	111.2	G180 P184	G180-W182 PolarHBondContact O-N 3.18Å; W182-P184 HydrophobicContact CE3-CG 4.49Å; W182-P184 HydrophobicContact CZ3-CG 4.38Å
183	P	89.1	Confident	72.2	Confident	10 Å²	10	78.6 Å²	78.6	7%	0.065	44%	0.44	C	S	.	.	S	Bend	cis	-63	154.6	-2.4	-22.5	33.8	0	0	0	114.8	M1 E181 F185	M1-P183 HydrophobicContact SD-CB 4.37Å; M1-P183 HydrophobicContact SD-CG 4.06Å; E181-P183 CarbonylContact O-C 3.55Å; P183-F185 VanDerWaalsContact C-N 3.27Å; P183-F185 HydrophobicContact CB-CD2 4.33Å; P183-F185 HydrophobicContact CB-CE1 4.13Å; P183-F185 HydrophobicContact CB-CE2 3.87Å; P183-F185 HydrophobicContact CB-CZ 3.76Å; P183-F185 HydrophobicContact CG-CE1 4.46Å; P183-F185 HydrophobicContact CG-CE2 3.92Å; P183-F185 HydrophobicContact CG-CZ 3.72Å; P183-F185 VanDerWaalsContact O-CD2 3.23Å; P183-F185 WeakPolarHBondContact O-CD2 3.38Å; P183-F185 PolarHBondContact O-N 2.81Å
184	P	91.7	Very high	74.1	Confident	34 Å²	34	82.2 Å²	82.2	22%	0.221	45%	0.448	C	S	.	.			trans	-78.2	76.4	-177.7	32.3	-34.5	0	0	0	110.4	Q20 A22 W182	Q20-P184 HydrophobicContact CB-CG 4.47Å; Q20-P184 HydrophobicContact CG-CG 3.9Å; Q20-P184 WeakPolarHBondContact O-CG 3.38Å; A22-P184 PolarHBondContact N-O 3.16Å; W182-P184 HydrophobicContact CE3-CG 4.49Å; W182-P184 HydrophobicContact CZ3-CG 4.38Å
185	F	91.8	Very high	75.7	Confident	22 Å²	22	77.3 Å²	77.3	10%	0.096	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.5	-176.7	-67	-67	0	0	0	111.8	M1 Y6 A22 D24 P183	M1-F185 HydrophobicContact CE-CE1 4Å; M1-F185 HydrophobicContact SD-CE1 3.99Å; M1-F185 HydrophobicContact SD-CZ 4.15Å; Y6-F185 AromaticContact CD1-CE2 3.69Å; Y6-F185 HydrophobicContact CD1-CE2 3.69Å; Y6-F185 AromaticContact CD1-CZ 3.76Å; Y6-F185 HydrophobicContact CD1-CZ 3.76Å; Y6-F185 HydrophobicContact CD2-CE2 4.31Å; Y6-F185 HydrophobicContact CD2-CZ 4.18Å; Y6-F185 HydrophobicContact CE1-CD2 4.5Å; Y6-F185 AromaticContact CE1-CE2 3.55Å; Y6-F185 HydrophobicContact CE1-CE2 3.55Å; Y6-F185 HydrophobicContact CE1-CZ 4.12Å; Y6-F185 HydrophobicContact CE2-CE2 4.2Å; Y6-F185 HydrophobicContact CG-CE2 4.06Å; Y6-F185 AromaticContact CG-CZ 3.78Å; Y6-F185 HydrophobicContact CG-CZ 3.78Å; Y6-F185 AromaticContact CZ-CE2 3.83Å; A22-F185 HydrophobicContact CB-CD1 3.99Å; A22-F185 HydrophobicContact CB-CE1 4.35Å; A22-F185 WeakPolarHBondContact O-CA 3.33Å; D24-F185 HydrophobicContact CB-CD1 4.31Å; P183-F185 VanDerWaalsContact C-N 3.27Å; P183-F185 HydrophobicContact CB-CD2 4.33Å; P183-F185 HydrophobicContact CB-CE1 4.13Å; P183-F185 HydrophobicContact CB-CE2 3.87Å; P183-F185 HydrophobicContact CB-CZ 3.76Å; P183-F185 HydrophobicContact CG-CE1 4.46Å; P183-F185 HydrophobicContact CG-CE2 3.92Å; P183-F185 HydrophobicContact CG-CZ 3.72Å; P183-F185 VanDerWaalsContact O-CD2 3.23Å; P183-F185 WeakPolarHBondContact O-CD2 3.38Å; P183-F185 PolarHBondContact O-N 2.81Å
186	R	93.5	Very high	77.6	Confident	68 Å²	68	78.1 Å²	78.1	26%	0.257	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	112.7	165.8	-168.2	-174.7	88.8	177.5	3.9	109.2	V21 A22 F23 D24 G65 W66 V188	V21-R186 HydrophobicContact CG1-CB 3.62Å; A22-R186 PolarHBondContact O-N 2.92Å; F23-R186 WeakPolarHBondContact CA-O 3.37Å; F23-R186 HydrophobicContact CD1-CB 4.39Å; D24-R186 PolarHBondContact N-O 2.62Å; G65-R186 PolarHBondContact O-NH1 3.39Å; W66-R186 VanDerWaalsContact O-CZ 3.28Å; W66-R186 PolarHBondContact O-NH1 2.87Å; W66-R186 PolarHBondContact O-NH2 3.45Å; R186-V188 PolarHBondContact O-N 2.88Å
187	K	93.1	Very high	79.7	Confident	89 Å²	89	71.1 Å²	71.1	39%	0.387	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	130.9	173.2	-165.4	175.2	-179.2	-176.9	0	109.4	D24	D24-K187 WeakPolarHBondContact O-CA 3.31Å
188	V	93.3	Very high	81.7	Confident	7 Å²	7	71.8 Å²	71.8	4%	0.042	39%	0.393	C	S	.	.			trans	-134.4	162.6	177	-68	0	0	0	0	109.8	F23 D24 F25 V57 I59 R186	F23-V188 HydrophobicContact CB-CG2 3.89Å; F23-V188 HydrophobicContact CD1-CG1 3.73Å; F23-V188 HydrophobicContact CE1-CG1 4.43Å; F23-V188 HydrophobicContact CG-CG1 4.45Å; D24-V188 PolarHBondContact O-N 3.38Å; F25-V188 HydrophobicContact CD1-CG2 3.66Å; F25-V188 HydrophobicContact CE1-CG2 3.32Å; F25-V188 HydrophobicContact CE2-CG2 4.26Å; F25-V188 HydrophobicContact CG-CG2 4.27Å; F25-V188 HydrophobicContact CZ-CG2 3.64Å; V57-V188 HydrophobicContact CG1-CB 4.39Å; V57-V188 HydrophobicContact CG1-CG2 4.47Å; I59-V188 HydrophobicContact CD1-CG1 4.48Å; R186-V188 PolarHBondContact O-N 2.88Å
189	G	91	Very high	83.9	Confident	33 Å²	33	70.1 Å²	70.1	34%	0.34	37%	0.371	S	S	.	.	S	Bend	trans	87.9	173.9	-169.4	0	0	0	0	0	111.9	E55	E55-G189 VanDerWaalsContact OE1-CA 3.27Å; E55-G189 WeakPolarHBondContact OE1-CA 3.38Å; E55-G189 WeakPolarHBondContact OE2-CA 3.33Å
190	C	90.4	Very high	86	Confident	60 Å²	60	60.8 Å²	60.8	41%	0.405	33%	0.328	S	S	.	.			trans	-127.7	0.7	179.7	68.7	0	0	0	0	113.5	E55 P76 S79 D192	E55-C190 PolarHBondContact OE1-N 3.28Å; E55-C190 PolarHBondContact OE2-N 3.44Å; P76-C190 WeakPolarHBondContact CG-SG 3.37Å; S79-C190 VanDerWaalsContact CB-O 3.23Å; S79-C190 WeakPolarHBondContact CB-O 3.32Å; C190-D192 PolarHBondContact O-N 3.05Å
191	F	92.1	Very high	87.6	Confident	28 Å²	28	57 Å²	57	12%	0.123	29%	0.288	C	S	.	.			trans	-70.1	123.1	174.6	177.6	-104.5	0	0	0	111.5	T26 E54 E55 H78 P193	T26-F191 WeakPolarHBondContact CB-O 3.42Å; T26-F191 WeakPolarHBondContact CG2-O 3.43Å; T26-F191 PolarHBondContact OG1-O 2.83Å; E54-F191 HydrophobicContact CB-CB 4.23Å; E54-F191 HydrophobicContact CB-CD1 3.65Å; E54-F191 HydrophobicContact CB-CD2 3.93Å; E54-F191 HydrophobicContact CB-CE1 3.94Å; E54-F191 HydrophobicContact CB-CE2 4.21Å; E54-F191 HydrophobicContact CB-CG 3.64Å; E54-F191 HydrophobicContact CB-CZ 4.21Å; E54-F191 HydrophobicContact CG-CD1 3.82Å; E54-F191 HydrophobicContact CG-CD2 4.46Å; E54-F191 HydrophobicContact CG-CE1 3.59Å; E54-F191 HydrophobicContact CG-CE2 4.27Å; E54-F191 HydrophobicContact CG-CG 4.26Å; E54-F191 HydrophobicContact CG-CZ 3.83Å; E55-F191 HydrophobicContact CG-CB 4.35Å; E55-F191 WeakPolarHBondContact OE1-CB 3.43Å; E55-F191 PolarHBondContact OE1-N 3.41Å; E55-F191 VanDerWaalsContact OE1-N 3.08Å; E55-F191 PolarHBondContact OE2-N 3.03Å; H78-F191 AromaticContact CD2-CD2 3.87Å; H78-F191 AromaticContact CD2-CE2 3.48Å; H78-F191 VanDerWaalsContact CD2-CE2 3.48Å; H78-F191 WeakPolarHBondContact CD2-CE2 3.17Å; H78-F191 AromaticContact NE2-CD2 3.82Å; H78-F191 AromaticContact NE2-CE2 3.7Å; F191-P193 HydrophobicContact CE1-CB 3.84Å; F191-P193 HydrophobicContact CE1-CG 4.38Å; F191-P193 HydrophobicContact CZ-CB 4.26Å
192	D	86.6	Confident	88.9	Confident	44 Å²	44	52.8 Å²	52.8	24%	0.235	27%	0.268	C	S	.	.			trans	-112.2	111.4	174.6	-165.3	-5.8	0	0	0	110.7	S79 C190 Y194	S79-D192 PolarHBondContact O-N 2.78Å; C190-D192 PolarHBondContact O-N 3.05Å; D192-Y194 PolarHBondContact O-N 2.81Å; D192-Y194 WeakPolarHBondContact OD1-CB 3.23Å; D192-Y194 WeakPolarHBondContact OD1-CD2 3.4Å; D192-Y194 PolarHBondContact OD1-N 2.87Å
193	P	80.3	Confident	89.7	Confident	67 Å²	67	46.9 Å²	46.9	44%	0.435	25%	0.248	S	C	.	.			trans	-74.4	-7.6	176	30.6	-34	0	0	0	113.1	F191	F191-P193 HydrophobicContact CE1-CB 3.84Å; F191-P193 HydrophobicContact CE1-CG 4.38Å; F191-P193 HydrophobicContact CZ-CB 4.26Å
194	Y	80	Confident	90.2	Very high	170 Å²	170	49.3 Å²	49.3	67%	0.667	26%	0.258	S	S	*	.			trans	-101.4	150.3	-176.5	-53.6	-69.2	0	0	0	111.7	D192	D192-Y194 PolarHBondContact O-N 2.81Å; D192-Y194 WeakPolarHBondContact OD1-CB 3.23Å; D192-Y194 WeakPolarHBondContact OD1-CD2 3.4Å; D192-Y194 PolarHBondContact OD1-N 2.87Å
195	S	73.9	Confident	90.5	Very high	53 Å²	53	48.3 Å²	48.3	37%	0.371	25%	0.251	S	S	.	.			trans	-119.5	105.5	170.8	164.5	0	0	0	0	107.2	E138	E138-S195 VanDerWaalsContact CD-OG 3.29Å; E138-S195 PolarHBondContact OE1-OG 2.76Å
196	D	77.8	Confident	90.8	Very high	103 Å²	103	49.3 Å²	49.3	55%	0.551	26%	0.255	S	S	*	.	S	Bend	trans	-66.3	-55.8	-175.5	-65.1	-30	0	0	0	111.7	L170	L170-D196 HydrophobicContact CD2-CB 4.37Å; L170-D196 VanDerWaalsContact CD2-OD2 3.28Å; L170-D196 WeakPolarHBondContact CD2-OD2 3.47Å
197	D	89.3	Confident	91.1	Very high	36 Å²	36	46.4 Å²	46.4	19%	0.193	25%	0.245	C	C	.	.			trans	-139.3	105.5	178.8	-168.9	-14.3	0	0	0	112	R199 L200	D197-R199 PolarHBondContact O-N 2.88Å; D197-R199 WeakPolarHBondContact OD1-CB 3.19Å; D197-R199 WeakPolarHBondContact OD1-CG 3.36Å; D197-R199 PolarHBondContact OD1-N 2.89Å; D197-R199 IonicContact OD1-NE 3.3Å; D197-R199 PolarHBondContact OD1-NE 3.35Å; D197-R199 VanDerWaalsContact OD1-NE 3.09Å; D197-R199 IonicContact OD2-CZ 2.75Å; D197-R199 IonicContact OD2-NE 2.96Å; D197-R199 PolarHBondContact OD2-NE 2.89Å; D197-R199 IonicContact OD2-NH2 3.17Å; D197-R199 PolarHBondContact OD2-NH2 2.89Å; D197-L200 HydrophobicContact CB-CD1 4.16Å; D197-L200 HydrophobicContact CB-CG 4.37Å; D197-L200 WeakPolarHBondContact O-CB 3.46Å; D197-L200 PolarHBondContact O-N 3.23Å
198	P	88.8	Confident	91.3	Very high	52 Å²	52	42.6 Å²	42.6	34%	0.338	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-65.4	-11.6	-178.9	29	-36.4	0	0	0	113.2	L200 G201 T219	P198-L200 PolarHBondContact O-N 3.08Å; P198-G201 PolarHBondContact O-N 3.27Å; P198-T219 WeakPolarHBondContact O-CB 3.12Å; P198-T219 PolarHBondContact O-OG1 3.15Å
199	R	93.6	Very high	91.4	Very high	38 Å²	38	42.9 Å²	42.9	14%	0.143	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63.3	-30.9	172.5	-65.8	-178.1	-69.1	175.9	-0.2	111.8	D197 G201 T219 A220 Q222 H256 T257 Q258 L259	D197-R199 PolarHBondContact O-N 2.88Å; D197-R199 WeakPolarHBondContact OD1-CB 3.19Å; D197-R199 WeakPolarHBondContact OD1-CG 3.36Å; D197-R199 PolarHBondContact OD1-N 2.89Å; D197-R199 IonicContact OD1-NE 3.3Å; D197-R199 PolarHBondContact OD1-NE 3.35Å; D197-R199 VanDerWaalsContact OD1-NE 3.09Å; D197-R199 IonicContact OD2-CZ 2.75Å; D197-R199 IonicContact OD2-NE 2.96Å; D197-R199 PolarHBondContact OD2-NE 2.89Å; D197-R199 IonicContact OD2-NH2 3.17Å; D197-R199 PolarHBondContact OD2-NH2 2.89Å; R199-G201 VanDerWaalsContact C-N 3.26Å; R199-G201 PolarHBondContact O-N 3.12Å; R199-T219 PolarHBondContact O-N 3.21Å; R199-A220 HydrophobicContact CB-CB 3.78Å; R199-A220 HydrophobicContact CG-CB 4.03Å; R199-A220 PolarHBondContact O-N 2.91Å; R199-Q222 PolarHBondContact O-NE2 2.79Å; R199-H256 HydrophobicContact CG-CB 3.82Å; R199-T257 VanDerWaalsContact CD-O 3.25Å; R199-T257 WeakPolarHBondContact CD-O 3.47Å; R199-T257 PolarHBondContact NH1-OG1 3.27Å; R199-Q258 PolarHBondContact NH1-O 2.93Å; R199-L259 HydrophobicContact CB-CD1 4.29Å; R199-L259 HydrophobicContact CB-CD2 3.89Å; R199-L259 HydrophobicContact CB-CG 4.06Å
200	L	95.3	Very high	91.6	Very high	15 Å²	15	42.7 Å²	42.7	8%	0.079	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-69.8	-23	180	-69.8	169.9	0	0	0	112.9	G140 A161 F164 D197 P198 I202 L259	G140-L200 VanDerWaalsContact CA-O 3.26Å; G140-L200 WeakPolarHBondContact CA-O 3.29Å; A161-L200 HydrophobicContact CB-CD1 4.24Å; A161-L200 HydrophobicContact CB-CD2 4.43Å; F164-L200 HydrophobicContact CD2-CD2 3.79Å; F164-L200 HydrophobicContact CE2-CD2 4.28Å; D197-L200 HydrophobicContact CB-CD1 4.16Å; D197-L200 HydrophobicContact CB-CG 4.37Å; D197-L200 WeakPolarHBondContact O-CB 3.46Å; D197-L200 PolarHBondContact O-N 3.23Å; P198-L200 PolarHBondContact O-N 3.08Å; L200-I202 PolarHBondContact O-N 3.1Å; L200-L259 HydrophobicContact CD2-CD1 3.74Å; L200-L259 HydrophobicContact CD2-CD2 4.42Å; L200-L259 HydrophobicContact CG-CD1 4.41Å
201	G	96.3	Very high	91.9	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.01	21%	0.211	C	C	.	.			trans	-52.2	128.3	-171.1	0	0	0	0	0	114	H137 E138 P198 R199 G218 T219	H137-G201 WeakPolarHBondContact O-CA 3.5Å; E138-G201 WeakPolarHBondContact O-CA 3.29Å; E138-G201 PolarHBondContact O-N 3.21Å; E138-G201 VanDerWaalsContact O-N 3.12Å; P198-G201 PolarHBondContact O-N 3.27Å; R199-G201 VanDerWaalsContact C-N 3.26Å; R199-G201 PolarHBondContact O-N 3.12Å; G201-G218 CarbonylContact O-C 3.58Å; G201-G218 VanDerWaalsContact O-CA 3.26Å; G201-G218 WeakPolarHBondContact O-CA 3.34Å; G201-T219 PolarHBondContact O-N 3.46Å; G201-T219 PolarHBondContact O-OG1 3.46Å
202	I	98.4	Very high	92.1	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	123.1	-175.7	-54.4	-60.1	0	0	0	110.7	T83 C84 H137 V142 T160 L200 I205 V216	T83-I202 WeakPolarHBondContact CB-O 3.46Å; T83-I202 PolarHBondContact OG1-O 3.27Å; C84-I202 PolarHBondContact SG-O 3.45Å; H137-I202 PolarHBondContact O-N 2.89Å; V142-I202 HydrophobicContact CG2-CB 4.5Å; V142-I202 HydrophobicContact CG2-CD1 4.4Å; V142-I202 HydrophobicContact CG2-CG1 3.93Å; V142-I202 HydrophobicContact CG2-CG2 4.05Å; T160-I202 HydrophobicContact CG2-CD1 4.09Å; L200-I202 PolarHBondContact O-N 3.1Å; I202-I205 HydrophobicContact CG2-CD1 4.16Å; I202-I205 HydrophobicContact CG2-CG1 3.73Å; I202-V216 HydrophobicContact CG2-CB 4.49Å
203	Q	98.1	Very high	92.6	Very high	51 Å²	51	39.9 Å²	39.9	24%	0.238	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-31.7	-175.1	-63.7	-64.9	-31	0	0	113.4	C84 A217 T219 V285 V286	C84-Q203 WeakPolarHBondContact CB-O 3.43Å; C84-Q203 VanDerWaalsContact SG-C 3.57Å; Q203-A217 PolarHBondContact N-O 3.09Å; Q203-T219 PolarHBondContact NE2-OG1 3.09Å; Q203-V285 HydrophobicContact CG-CG1 3.89Å; Q203-V286 WeakPolarHBondContact CB-O 3.31Å
204	K	98.6	Very high	93.5	Very high	62 Å²	62	36.7 Å²	36.7	27%	0.27	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	146	179.2	-58.9	-67.3	169.1	172.1	0	110.9	V216 A217 T287 L289	K204-V216 WeakPolarHBondContact O-CA 3.49Å; K204-A217 HydrophobicContact CB-CB 4.25Å; K204-A217 PolarHBondContact N-O 2.8Å; K204-A217 PolarHBondContact O-N 3.07Å; K204-T287 WeakPolarHBondContact CE-O 3.31Å; K204-T287 PolarHBondContact NZ-O 3.12Å; K204-T287 VanDerWaalsContact NZ-O 3.12Å; K204-L289 HydrophobicContact CB-CB 3.58Å; K204-L289 HydrophobicContact CB-CD2 3.67Å; K204-L289 HydrophobicContact CB-CG 4.29Å; K204-L289 HydrophobicContact CG-CB 3.96Å
205	I	98.8	Very high	94.4	Very high	13 Å²	13	28.6 Å²	28.6	7%	0.067	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.4	176.3	-59	164.3	0	0	0	107.2	H86 L134 V142 I202 L214 V216	H86-I205 HydrophobicContact CB-CB 3.96Å; H86-I205 HydrophobicContact CB-CG2 4.22Å; H86-I205 PolarHBondContact ND1-O 2.48Å; L134-I205 HydrophobicContact CB-CD1 4.24Å; L134-I205 HydrophobicContact CB-CG2 4.27Å; L134-I205 HydrophobicContact CD1-CG2 3.62Å; V142-I205 HydrophobicContact CG1-CD1 3.75Å; V142-I205 HydrophobicContact CG1-CG1 4.47Å; V142-I205 HydrophobicContact CG2-CD1 4.08Å; V142-I205 HydrophobicContact CG2-CG1 4.31Å; I202-I205 HydrophobicContact CG2-CD1 4.16Å; I202-I205 HydrophobicContact CG2-CG1 3.73Å; I205-L214 HydrophobicContact CG2-CD1 3.86Å; I205-V216 HydrophobicContact CG1-CG1 4.39Å; I205-V216 HydrophobicContact CG2-CG1 4.49Å
206	H	98.7	Very high	95.6	Very high	43 Å²	43	26 Å²	26	20%	0.199	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	117.6	168.4	-168	139.4	0	0	0	108.9	T215 L291	H206-T215 HydrophobicContact CB-CG2 3.72Å; H206-T215 PolarHBondContact N-O 2.8Å; H206-T215 PolarHBondContact O-N 3.41Å; H206-L291 HydrophobicContact CB-CB 4.25Å; H206-L291 PolarHBondContact ND1-N 3.41Å
207	L	98.5	Very high	96.6	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.031	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.6	177	171.9	65.1	0	0	0	109.9	V88 L132 L134 F144 K209 L214 F272	V88-L207 HydrophobicContact CG2-CB 4.25Å; V88-L207 HydrophobicContact CG2-CD2 4.41Å; L132-L207 HydrophobicContact CD1-CD2 4.08Å; L134-L207 HydrophobicContact CD1-CB 3.85Å; L134-L207 HydrophobicContact CD1-CD2 4.06Å; F144-L207 HydrophobicContact CE1-CD2 4.23Å; L207-K209 PolarHBondContact O-N 2.89Å; L207-L214 HydrophobicContact CB-CD1 3.96Å; L207-L214 HydrophobicContact CD1-CB 4.21Å; L207-L214 HydrophobicContact CD1-CD1 4.3Å; L207-F272 HydrophobicContact CD1-CE1 3.89Å; L207-F272 HydrophobicContact CD1-CZ 3.84Å
208	C	97.8	Very high	96.9	Very high	9 Å²	9	19.5 Å²	19.5	6%	0.061	10%	0.098	C	C	.	.			trans	-84.2	107.8	166	-177.7	0	0	0	0	109.7	Y210 G212 Y213 L291 S293	C208-Y210 PolarHBondContact O-N 3.46Å; C208-Y210 VanDerWaalsContact O-N 3.16Å; C208-G212 WeakPolarHBondContact O-CA 3.42Å; C208-G212 PolarHBondContact O-N 2.9Å; C208-Y213 PolarHBondContact N-O 3.21Å; C208-L291 HydrophobicContact CB-CD2 4.06Å; C208-S293 VanDerWaalsContact SG-CB 3.53Å; C208-S293 PolarHBondContact SG-OG 3.31Å
209	K	96	Very high	97.3	Very high	14 Å²	14	18.2 Å²	18.2	6%	0.061	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.3	-179.9	65.7	179.5	-179.1	168.1	0	115.2	V88 S89 A90 I91 P92 L95 L207	V88-K209 HydrophobicContact CG1-CB 3.98Å; V88-K209 HydrophobicContact CG1-CD 3.85Å; V88-K209 HydrophobicContact CG1-CG 4.27Å; S89-K209 PolarHBondContact O-NZ 3.29Å; A90-K209 PolarHBondContact O-NZ 3.38Å; A90-K209 VanDerWaalsContact O-NZ 3.1Å; I91-K209 HydrophobicContact CD1-CB 4.03Å; I91-K209 HydrophobicContact CD1-CD 4.32Å; P92-K209 WeakPolarHBondContact CD-O 3.25Å; P92-K209 WeakPolarHBondContact CG-O 3.38Å; L95-K209 HydrophobicContact CD2-CB 4.08Å; L95-K209 WeakPolarHBondContact CD2-O 3.45Å; L207-K209 PolarHBondContact O-N 2.89Å
210	Y	95.3	Very high	97.4	Very high	28 Å²	28	16.5 Å²	16.5	11%	0.11	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-51.5	-179.2	-56.4	-62	0	0	0	112	P92 C208 P485 L486 E487 H490 L492	P92-Y210 HydrophobicContact CG-CD1 4.42Å; C208-Y210 PolarHBondContact O-N 3.46Å; C208-Y210 VanDerWaalsContact O-N 3.16Å; Y210-P485 WeakPolarHBondContact CD2-O 3.4Å; Y210-L486 HydrophobicContact CD2-CB 4.02Å; Y210-L486 HydrophobicContact CG-CB 4.18Å; Y210-E487 HydrophobicContact CE2-CB 3.84Å; Y210-E487 HydrophobicContact CE2-CG 4.41Å; Y210-E487 VanDerWaalsContact OH-CG 3.31Å; Y210-E487 WeakPolarHBondContact OH-CG 3.18Å; Y210-H490 HydrophobicContact CD1-CB 4.45Å; Y210-H490 AromaticContact CD1-CG 3.99Å; Y210-L492 HydrophobicContact CD1-CD1 4.38Å; Y210-L492 HydrophobicContact CE1-CD1 3.45Å; Y210-L492 VanDerWaalsContact CE1-CD1 3.45Å
211	S	95.4	Very high	97.5	Very high	34 Å²	34	15.8 Å²	15.8	24%	0.238	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-17.6	-179	71.4	0	0	0	0	113.6	Y213 S293	S211-Y213 PolarHBondContact O-N 3.22Å; S211-Y213 WeakPolarHBondContact OG-CB 3.4Å; S211-Y213 WeakPolarHBondContact OG-CD2 3.49Å; S211-Y213 PolarHBondContact OG-N 3.14Å; S211-S293 WeakPolarHBondContact OG-CB 3.42Å
212	G	95.8	Very high	97.6	Very high	3 Å²	3	15.8 Å²	15.8	3%	0.031	8%	0.078	C	C	.	.			trans	72.2	15.1	-170.9	0	0	0	0	0	113.9	C208 L228 F272	C208-G212 WeakPolarHBondContact O-CA 3.42Å; C208-G212 PolarHBondContact O-N 2.9Å; G212-L228 PolarHBondContact O-N 2.83Å; G212-F272 WeakPolarHBondContact O-CE1 3.23Å
213	Y	98.2	Very high	97.6	Very high	36 Å²	36	15.6 Å²	15.6	14%	0.141	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.2	171	-76.8	-58.3	0	0	0	109.9	C208 S211 E227 F275 K296 Y311	C208-Y213 PolarHBondContact N-O 3.21Å; S211-Y213 PolarHBondContact O-N 3.22Å; S211-Y213 WeakPolarHBondContact OG-CB 3.4Å; S211-Y213 WeakPolarHBondContact OG-CD2 3.49Å; S211-Y213 PolarHBondContact OG-N 3.14Å; Y213-E227 HydrophobicContact CD1-CB 4.05Å; Y213-E227 HydrophobicContact CD1-CG 4.27Å; Y213-E227 HydrophobicContact CE1-CB 3.82Å; Y213-E227 HydrophobicContact CE1-CG 3.86Å; Y213-E227 WeakPolarHBondContact CE1-OE2 3.23Å; Y213-E227 PolarHBondContact OH-OE2 2.75Å; Y213-F275 HydrophobicContact CD1-CE1 4.09Å; Y213-F275 HydrophobicContact CD1-CZ 4.45Å; Y213-F275 AromaticContact CE1-CE1 3.9Å; Y213-F275 HydrophobicContact CE1-CE1 3.9Å; Y213-F275 HydrophobicContact CE1-CZ 4.18Å; Y213-K296 HydrophobicContact CE2-CD 4.43Å; Y213-Y311 HydrophobicContact CD2-CE2 4.31Å; Y213-Y311 HydrophobicContact CE1-CE2 4.44Å; Y213-Y311 HydrophobicContact CE2-CE2 4.26Å; Y213-Y311 HydrophobicContact CG-CE2 4.49Å
214	L	98.7	Very high	97.6	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136	175.7	174	70.4	0	0	0	108.6	F144 L158 I205 L207 V216 L226 F272	F144-L214 HydrophobicContact CZ-CD2 4.03Å; L158-L214 HydrophobicContact CD2-CD2 3.68Å; I205-L214 HydrophobicContact CG2-CD1 3.86Å; L207-L214 HydrophobicContact CB-CD1 3.96Å; L207-L214 HydrophobicContact CD1-CB 4.21Å; L207-L214 HydrophobicContact CD1-CD1 4.3Å; L214-V216 HydrophobicContact CD1-CG1 4.21Å; L214-V216 HydrophobicContact CD2-CG1 4.14Å; L214-V216 HydrophobicContact CG-CG1 4.01Å; L214-L226 HydrophobicContact CB-CB 4.3Å; L214-L226 HydrophobicContact CD2-CD1 4.33Å; L214-L226 HydrophobicContact CG-CD1 4.34Å; L214-L226 PolarHBondContact N-O 3.42Å; L214-L226 PolarHBondContact O-N 2.74Å; L214-F272 HydrophobicContact CB-CD1 3.53Å; L214-F272 HydrophobicContact CB-CE1 3.63Å; L214-F272 HydrophobicContact CB-CG 4.43Å; L214-F272 HydrophobicContact CD2-CB 4.12Å; L214-F272 HydrophobicContact CD2-CD1 3.79Å; L214-F272 HydrophobicContact CD2-CD2 4.38Å; L214-F272 HydrophobicContact CD2-CE1 4.26Å; L214-F272 HydrophobicContact CD2-CG 3.84Å; L214-F272 HydrophobicContact CG-CD1 4.32Å
215	T	98.7	Very high	97.6	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.9	166.1	-177.2	0	0	0	0	110.5	H206 L224 M225 L289 L291 V298	H206-T215 HydrophobicContact CB-CG2 3.72Å; H206-T215 PolarHBondContact N-O 2.8Å; H206-T215 PolarHBondContact O-N 3.41Å; T215-L224 VanDerWaalsContact CA-O 3.3Å; T215-L224 WeakPolarHBondContact CA-O 3.43Å; T215-L224 PolarHBondContact OG1-O 3.02Å; T215-M225 VanDerWaalsContact CB-SD 3.57Å; T215-M225 PolarHBondContact OG1-SD 2.79Å; T215-L289 HydrophobicContact CG2-CD1 4.31Å; T215-L289 HydrophobicContact CG2-CD2 3.76Å; T215-L289 HydrophobicContact CG2-CG 4.05Å; T215-L291 HydrophobicContact CG2-CB 3.88Å; T215-L291 HydrophobicContact CG2-CD1 4.41Å; T215-L291 HydrophobicContact CG2-CD2 4.22Å; T215-L291 HydrophobicContact CG2-CG 4.4Å; T215-V298 HydrophobicContact CG2-CG2 4.24Å
216	V	98.8	Very high	97.6	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.7	178.4	-57.4	0	0	0	0	108.4	V142 L158 T160 I202 K204 I205 L214 I223 L224 L226	V142-V216 HydrophobicContact CG2-CG1 3.96Å; L158-V216 HydrophobicContact CD2-CG1 4.48Å; T160-V216 HydrophobicContact CG2-CG2 3.87Å; I202-V216 HydrophobicContact CG2-CB 4.49Å; K204-V216 WeakPolarHBondContact O-CA 3.49Å; I205-V216 HydrophobicContact CG1-CG1 4.39Å; I205-V216 HydrophobicContact CG2-CG1 4.49Å; L214-V216 HydrophobicContact CD1-CG1 4.21Å; L214-V216 HydrophobicContact CD2-CG1 4.14Å; L214-V216 HydrophobicContact CG-CG1 4.01Å; V216-I223 CarbonylContact O-C 3.52Å; V216-I223 WeakPolarHBondContact O-CA 3.02Å; V216-L224 HydrophobicContact CG2-CB 3.84Å; V216-L224 HydrophobicContact CG2-CD1 4.3Å; V216-L224 PolarHBondContact N-O 2.54Å; V216-L224 VanDerWaalsContact N-O 3.12Å; V216-L224 PolarHBondContact O-N 3.49Å; V216-L226 HydrophobicContact CG1-CD1 4.43Å; V216-L226 HydrophobicContact CG2-CD1 3.81Å
217	A	98.6	Very high	97.5	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.008	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.7	179.5	0	0	0	0	0	110.7	Q203 K204 Q222 I223 V286 L289	Q203-A217 PolarHBondContact N-O 3.09Å; K204-A217 HydrophobicContact CB-CB 4.25Å; K204-A217 PolarHBondContact N-O 2.8Å; K204-A217 PolarHBondContact O-N 3.07Å; A217-Q222 CarbonylContact C-O 3.43Å; A217-Q222 WeakPolarHBondContact CA-O 3.45Å; A217-I223 HydrophobicContact CB-CB 4.46Å; A217-I223 HydrophobicContact CB-CG1 3.77Å; A217-V286 HydrophobicContact CB-CB 3.71Å; A217-V286 HydrophobicContact CB-CG1 3.58Å; A217-V286 HydrophobicContact CB-CG2 4Å; A217-L289 HydrophobicContact CB-CD1 4.32Å; A217-L289 HydrophobicContact CB-CD2 4Å
218	G	97.1	Very high	97.5	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.01	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	-171.6	-171.3	0	0	0	0	0	115.3	G201 Q222 V286	G201-G218 CarbonylContact O-C 3.58Å; G201-G218 VanDerWaalsContact O-CA 3.26Å; G201-G218 WeakPolarHBondContact O-CA 3.34Å; G218-Q222 PolarHBondContact N-O 3.33Å; G218-V286 PolarHBondContact O-N 2.83Å
219	T	96.4	Very high	97.4	Very high	25 Å²	25	14.5 Å²	14.5	15%	0.153	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-28.3	-172.7	-57.9	0	0	0	0	112.9	P198 R199 G201 Q203 V285	P198-T219 WeakPolarHBondContact O-CB 3.12Å; P198-T219 PolarHBondContact O-OG1 3.15Å; R199-T219 PolarHBondContact O-N 3.21Å; G201-T219 PolarHBondContact O-N 3.46Å; G201-T219 PolarHBondContact O-OG1 3.46Å; Q203-T219 PolarHBondContact NE2-OG1 3.09Å; T219-V285 HydrophobicContact CG2-CG2 3.93Å; T219-V285 VanDerWaalsContact O-CA 3.23Å; T219-V285 WeakPolarHBondContact O-CA 3.45Å; T219-V285 WeakPolarHBondContact O-CG2 3.18Å; T219-V285 PolarHBondContact O-N 2.84Å
220	A	95.9	Very high	97.4	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	30.1	179.7	0	0	0	0	0	113.2	R199 Q222 Q279 P283	R199-A220 HydrophobicContact CB-CB 3.78Å; R199-A220 HydrophobicContact CG-CB 4.03Å; R199-A220 PolarHBondContact O-N 2.91Å; A220-Q222 VanDerWaalsContact C-N 3.25Å; A220-Q222 VanDerWaalsContact CB-OE1 3.31Å; A220-Q222 PolarHBondContact O-N 3.4Å; A220-Q222 PolarHBondContact O-OE1 2.87Å; A220-Q279 PolarHBondContact O-NE2 3.46Å; A220-P283 CarbonylContact C-O 3.29Å; A220-P283 WeakPolarHBondContact O-CA 3.49Å; A220-P283 WeakPolarHBondContact O-CB 3.49Å
221	G	96.8	Very high	97.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	76.5	5.8	174.3	0	0	0	0	0	115.5	C280 A284	G221-C280 WeakPolarHBondContact O-CB 3.48Å; G221-C280 PolarHBondContact O-N 3.24Å; G221-C280 PolarHBondContact O-SG 2.94Å; G221-A284 WeakPolarHBondContact CA-O 3.29Å; G221-A284 PolarHBondContact N-O 2.98Å; G221-A284 VanDerWaalsContact N-O 3.14Å
222	Q	98	Very high	97.5	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	132.4	175.2	72.5	-76.4	14.5	0	0	111.2	F164 R199 A217 G218 A220 L224 L259 V277 V278	F164-Q222 HydrophobicContact CE1-CB 4.44Å; F164-Q222 HydrophobicContact CE1-CG 4.48Å; F164-Q222 HydrophobicContact CE2-CG 4.42Å; F164-Q222 HydrophobicContact CZ-CB 4.08Å; F164-Q222 HydrophobicContact CZ-CG 3.76Å; R199-Q222 PolarHBondContact O-NE2 2.79Å; A217-Q222 CarbonylContact C-O 3.43Å; A217-Q222 WeakPolarHBondContact CA-O 3.45Å; G218-Q222 PolarHBondContact N-O 3.33Å; A220-Q222 VanDerWaalsContact C-N 3.25Å; A220-Q222 VanDerWaalsContact CB-OE1 3.31Å; A220-Q222 PolarHBondContact O-N 3.4Å; A220-Q222 PolarHBondContact O-OE1 2.87Å; Q222-L224 HydrophobicContact CG-CD1 4.09Å; Q222-L259 HydrophobicContact CG-CD1 4.18Å; Q222-V277 HydrophobicContact CB-CG1 4.28Å; Q222-V278 CarbonylContact C-O 3.57Å
223	I	98.7	Very high	97.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.1	172.4	-59.4	115.8	0	0	0	107.9	V216 A217 V277 V278 C280 V286 L289 F300	V216-I223 CarbonylContact O-C 3.52Å; V216-I223 WeakPolarHBondContact O-CA 3.02Å; A217-I223 HydrophobicContact CB-CB 4.46Å; A217-I223 HydrophobicContact CB-CG1 3.77Å; I223-V277 CarbonylContact O-C 3.55Å; I223-V277 WeakPolarHBondContact O-CA 3.25Å; I223-V278 HydrophobicContact CB-CB 4.24Å; I223-V278 HydrophobicContact CD1-CB 4.35Å; I223-V278 HydrophobicContact CD1-CG1 4.41Å; I223-V278 PolarHBondContact N-O 3.44Å; I223-V278 PolarHBondContact O-N 3Å; I223-C280 VanDerWaalsContact CD1-SG 3.6Å; I223-V286 HydrophobicContact CD1-CG2 4.13Å; I223-V286 HydrophobicContact CG1-CG2 4.05Å; I223-L289 HydrophobicContact CG2-CD1 4.08Å; I223-F300 HydrophobicContact CD1-CB 3.72Å; I223-F300 HydrophobicContact CD1-CD1 3.95Å; I223-F300 HydrophobicContact CD1-CD2 3.6Å; I223-F300 HydrophobicContact CD1-CE2 4.2Å; I223-F300 HydrophobicContact CD1-CG 3.46Å; I223-F300 VanDerWaalsContact CD1-CG 3.46Å; I223-F300 HydrophobicContact CG1-CB 4.14Å; I223-F300 HydrophobicContact CG1-CG 4.33Å
224	L	98.6	Very high	97.4	Very high	3 Å²	3	31 Å²	31	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.3	178.2	-66.6	78.3	0	0	0	109.6	T160 V163 F164 T215 V216 Q222 L226 P274 V277	T160-L224 HydrophobicContact CG2-CD2 4.07Å; V163-L224 HydrophobicContact CB-CD2 4.36Å; V163-L224 HydrophobicContact CG2-CD2 3.86Å; F164-L224 HydrophobicContact CE2-CD1 4.4Å; F164-L224 HydrophobicContact CZ-CD1 4.07Å; T215-L224 VanDerWaalsContact CA-O 3.3Å; T215-L224 WeakPolarHBondContact CA-O 3.43Å; T215-L224 PolarHBondContact OG1-O 3.02Å; V216-L224 HydrophobicContact CG2-CB 3.84Å; V216-L224 HydrophobicContact CG2-CD1 4.3Å; V216-L224 PolarHBondContact N-O 2.54Å; V216-L224 VanDerWaalsContact N-O 3.12Å; V216-L224 PolarHBondContact O-N 3.49Å; Q222-L224 HydrophobicContact CG-CD1 4.09Å; L224-L226 HydrophobicContact CB-CD1 3.82Å; L224-P274 HydrophobicContact CD2-CB 4.23Å; L224-V277 HydrophobicContact CG-CG2 4.2Å
225	M	98.3	Very high	97.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.9	167.8	-61.8	-59.6	-53.4	0	0	108.9	T215 P274 F275 T276 L291 V298 Y311	T215-M225 VanDerWaalsContact CB-SD 3.57Å; T215-M225 PolarHBondContact OG1-SD 2.79Å; M225-P274 WeakPolarHBondContact O-CA 3.24Å; M225-F275 HydrophobicContact CB-CE1 3.85Å; M225-F275 HydrophobicContact CB-CE2 3.96Å; M225-F275 HydrophobicContact CB-CZ 3.54Å; M225-F275 WeakPolarHBondContact O-CD1 3.46Å; M225-F275 PolarHBondContact O-N 2.81Å; M225-T276 HydrophobicContact CB-CG2 3.61Å; M225-T276 HydrophobicContact CG-CG2 3.73Å; M225-T276 PolarHBondContact N-O 2.94Å; M225-L291 HydrophobicContact CE-CD1 3.76Å; M225-V298 HydrophobicContact SD-CB 3.85Å; M225-V298 HydrophobicContact SD-CG1 3.79Å; M225-V298 HydrophobicContact SD-CG2 4.01Å; M225-Y311 HydrophobicContact CE-CD1 3.56Å; M225-Y311 HydrophobicContact CE-CD2 4.25Å; M225-Y311 HydrophobicContact CE-CE1 3.71Å; M225-Y311 HydrophobicContact CE-CE2 4.38Å; M225-Y311 HydrophobicContact CE-CG 3.83Å; M225-Y311 HydrophobicContact CG-CG 4.5Å; M225-Y311 HydrophobicContact SD-CD1 4.37Å
226	L	98.5	Very high	97	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149	-175.9	-51.6	94.1	0	0	0	111	L158 L214 V216 L224 F272 Q273 P274	L158-L226 HydrophobicContact CD1-CD2 3.7Å; L158-L226 HydrophobicContact CD2-CD1 4.48Å; L158-L226 HydrophobicContact CD2-CD2 3.66Å; L158-L226 HydrophobicContact CG-CD2 4.3Å; L214-L226 HydrophobicContact CB-CB 4.3Å; L214-L226 HydrophobicContact CD2-CD1 4.33Å; L214-L226 HydrophobicContact CG-CD1 4.34Å; L214-L226 PolarHBondContact N-O 3.42Å; L214-L226 PolarHBondContact O-N 2.74Å; V216-L226 HydrophobicContact CG1-CD1 4.43Å; V216-L226 HydrophobicContact CG2-CD1 3.81Å; L224-L226 HydrophobicContact CB-CD1 3.82Å; L226-F272 HydrophobicContact CB-CB 4.15Å; L226-F272 HydrophobicContact CD2-CB 4.16Å; L226-Q273 VanDerWaalsContact CA-O 3.27Å; L226-Q273 WeakPolarHBondContact CA-O 3.47Å; L226-P274 HydrophobicContact CD2-CB 4.04Å; L226-P274 HydrophobicContact CD2-CG 4.47Å; L226-P274 HydrophobicContact CG-CB 3.99Å
227	E	97.4	Very high	96.9	Very high	86 Å²	86	37.6 Å²	37.6	40%	0.402	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.1	173.8	-174.2	166	-175.8	0	0	109.8	Y213 N229 F272 Q273 F275	Y213-E227 HydrophobicContact CD1-CB 4.05Å; Y213-E227 HydrophobicContact CD1-CG 4.27Å; Y213-E227 HydrophobicContact CE1-CB 3.82Å; Y213-E227 HydrophobicContact CE1-CG 3.86Å; Y213-E227 WeakPolarHBondContact CE1-OE2 3.23Å; Y213-E227 PolarHBondContact OH-OE2 2.75Å; E227-N229 PolarHBondContact O-N 2.99Å; E227-F272 CarbonylContact O-C 3.53Å; E227-F272 WeakPolarHBondContact O-CA 3.21Å; E227-Q273 PolarHBondContact N-O 3.21Å; E227-Q273 PolarHBondContact O-N 3.07Å; E227-F275 HydrophobicContact CB-CD1 4.35Å; E227-F275 HydrophobicContact CB-CE1 4.33Å
228	L	97.5	Very high	96.6	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.037	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	120	174.8	-178.1	61.2	0	0	0	110.3	L95 R98 I99 G212 F272	L95-L228 HydrophobicContact CD1-CD2 3.38Å; R98-L228 HydrophobicContact CB-CD2 3.68Å; R98-L228 PolarHBondContact NH2-O 3.25Å; I99-L228 HydrophobicContact CG1-CD2 4.16Å; G212-L228 PolarHBondContact O-N 2.83Å; L228-F272 HydrophobicContact CB-CD1 4.14Å; L228-F272 HydrophobicContact CB-CE1 3.91Å; L228-F272 HydrophobicContact CB-CZ 4.18Å; L228-F272 HydrophobicContact CD1-CD2 4.06Å; L228-F272 HydrophobicContact CD1-CE2 4.04Å; L228-F272 HydrophobicContact CD1-CG 4.44Å; L228-F272 HydrophobicContact CD1-CZ 4.39Å; L228-F272 HydrophobicContact CD2-CZ 4.48Å
229	N	97.3	Very high	96.5	Very high	63 Å²	63	43.8 Å²	43.8	34%	0.337	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.5	175.7	-163.1	-6.9	0	0	0	110.8	E227 E231 G271 Q273	E227-N229 PolarHBondContact O-N 2.99Å; N229-E231 PolarHBondContact OD1-N 3.43Å; N229-G271 PolarHBondContact N-O 3.4Å; N229-G271 PolarHBondContact O-N 2.57Å; N229-Q273 HydrophobicContact CB-CG 4.27Å; N229-Q273 PolarHBondContact ND2-OE1 3.27Å
230	D	96.2	Very high	96.6	Very high	97 Å²	97	46.1 Å²	46.1	52%	0.519	25%	0.248	S	C	.	.	S	Bend	trans	-88.4	-19.3	-175.4	-58	-22.9	0	0	0	111.9	R98 P270	R98-D230 IonicContact CZ-OD1 2.7Å; R98-D230 VanDerWaalsContact CZ-OD1 3.26Å; R98-D230 IonicContact CZ-OD2 3.19Å; R98-D230 IonicContact NE-OD1 2.87Å; R98-D230 PolarHBondContact NE-OD1 2.77Å; R98-D230 IonicContact NE-OD2 3.46Å; R98-D230 PolarHBondContact NE-OD2 2.88Å; R98-D230 IonicContact NH2-OD1 2.81Å; R98-D230 PolarHBondContact NH2-OD1 2.87Å; R98-D230 IonicContact NH2-OD2 3.68Å; D230-P270 WeakPolarHBondContact O-CB 3.23Å
231	E	96.4	Very high	96.6	Very high	148 Å²	148	51 Å²	51	69%	0.692	27%	0.272	S	S	*	.	S	Bend	trans	-115.5	158.2	179.3	-63.5	-173.6	173.5	0	0	111.4	N229 Q273	N229-E231 PolarHBondContact OD1-N 3.43Å; E231-Q273 PolarHBondContact O-NE2 2.77Å
232	A	96.1	Very high	96.6	Very high	54 Å²	54	51 Å²	51	45%	0.446	27%	0.273	S	S	.	.			trans	-67.2	141.6	171.3	0	0	0	0	0	109.9	L267 F268	A232-L267 HydrophobicContact CB-CD1 4.25Å; A232-F268 CarbonylContact C-O 3.49Å; A232-F268 WeakPolarHBondContact CA-O 3.11Å; A232-F268 WeakPolarHBondContact CB-O 3.39Å
233	A	96.3	Very high	96.5	Very high	22 Å²	22	53.9 Å²	53.9	18%	0.182	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.9	179	0	0	0	0	0	110.9	F268 Q273	A233-F268 PolarHBondContact N-O 3.32Å; A233-F268 PolarHBondContact O-N 2.86Å; A233-Q273 VanDerWaalsContact CB-OE1 3.31Å
234	E	96	Very high	96.3	Very high	142 Å²	142	53.9 Å²	53.9	66%	0.664	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.5	169	-174.6	172.2	-147	0	0	108.9	P265 V266 L267	E234-P265 HydrophobicContact CG-CB 3.67Å; E234-V266 WeakPolarHBondContact CA-O 3.43Å; E234-L267 HydrophobicContact CB-CD1 4.17Å
235	Q	94.3	Very high	95.9	Very high	53 Å²	53	54.3 Å²	54.3	25%	0.248	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	147.8	-178.8	61.8	-172.4	-3	0	0	112.1	V266 F268 P274	Q235-V266 PolarHBondContact N-O 2.74Å; Q235-V266 VanDerWaalsContact N-O 3.08Å; Q235-V266 PolarHBondContact O-N 3.12Å; Q235-F268 HydrophobicContact CG-CD2 3.72Å; Q235-F268 HydrophobicContact CG-CE2 3.74Å; Q235-P274 PolarHBondContact NE2-O 2.86Å
236	T	94.4	Very high	95.2	Very high	76 Å²	76	59.8 Å²	59.8	47%	0.466	32%	0.315	S	S	.	.			trans	-85.8	129.7	169.1	-56.7	0	0	0	0	109.3	E263	T236-E263 WeakPolarHBondContact CG2-O 3.36Å
237	V	95.5	Very high	94	Very high	9 Å²	9	63.4 Å²	63.4	6%	0.055	35%	0.353	C	S	.	.			trans	-90.9	115.1	-178.9	-168.1	0	0	0	0	109.8	V163 A239 F268 P274 V277	V163-V237 HydrophobicContact CG1-CB 4.12Å; V163-V237 HydrophobicContact CG1-CG1 4.13Å; V163-V237 HydrophobicContact CG1-CG2 4.2Å; V163-V237 HydrophobicContact CG2-CG2 4.45Å; V237-A239 PolarHBondContact O-N 3.26Å; V237-F268 HydrophobicContact CG2-CE2 3.84Å; V237-F268 HydrophobicContact CG2-CZ 3.72Å; V237-P274 HydrophobicContact CG1-CB 4.38Å; V237-P274 HydrophobicContact CG2-CB 4.48Å; V237-P274 HydrophobicContact CG2-CG 4.16Å; V237-V277 HydrophobicContact CG1-CG2 3.67Å
238	E	93.5	Very high	93.1	Very high	82 Å²	82	62.6 Å²	62.6	38%	0.383	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.2	-178.9	-172.8	-177.4	160.3	0	0	111.6	T276 V277 K314	E238-T276 CarbonylContact O-C 3.58Å; E238-T276 VanDerWaalsContact O-CA 3.29Å; E238-T276 WeakPolarHBondContact O-CA 3.31Å; E238-T276 PolarHBondContact O-OG1 2.96Å; E238-V277 PolarHBondContact O-N 2.86Å; E238-K314 WeakPolarHBondContact OE2-CD 3.28Å; E238-K314 WeakPolarHBondContact OE2-CE 3.44Å; E238-K314 IonicContact OE2-NZ 3.9Å; E238-K314 PolarHBondContact OE2-NZ 3.26Å
239	A	95.3	Very high	92.1	Very high	50 Å²	50	70.9 Å²	70.9	41%	0.413	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.1	176.9	0	0	0	0	0	112.1	V237 V261 V277	V237-A239 PolarHBondContact O-N 3.26Å; A239-V261 HydrophobicContact CB-CB 4.12Å; A239-V261 HydrophobicContact CB-CG1 4.19Å; A239-V261 HydrophobicContact CB-CG2 3.94Å; A239-V277 CarbonylContact C-O 3.56Å; A239-V277 VanDerWaalsContact CA-O 3.31Å; A239-V277 WeakPolarHBondContact CA-O 3.28Å; A239-V277 HydrophobicContact CB-CB 4.44Å
240	K	96.8	Very high	91.1	Very high	74 Å²	74	71.8 Å²	71.8	32%	0.322	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.1	173.5	-169.9	74.1	171.9	-165.3	0	111	V277 V278 Q279 Y309	K240-V277 PolarHBondContact N-O 3.44Å; K240-V278 CarbonylContact O-C 3.55Å; K240-V278 WeakPolarHBondContact O-CA 3.4Å; K240-Q279 PolarHBondContact O-N 3.06Å; K240-Y309 HydrophobicContact CB-CE2 4.06Å; K240-Y309 HydrophobicContact CG-CE2 3.94Å
241	I	96.9	Very high	90.3	Very high	103 Å²	103	69.4 Å²	69.4	53%	0.528	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.7	172.7	-59.4	174.9	0	0	0	109.8	Q279 Q281	I241-Q279 CarbonylContact C-O 3.58Å; I241-Q279 WeakPolarHBondContact CA-O 3.2Å; I241-Q281 HydrophobicContact CG2-CB 3.93Å
242	V	96.9	Very high	89.6	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.006	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	105	174.2	177.1	0	0	0	0	109.5	L244 V278 Q279 Q281 F300 N316 V319	V242-L244 HydrophobicContact CG1-CD2 4.21Å; V242-L244 PolarHBondContact O-N 3.31Å; V242-V278 HydrophobicContact CB-CG1 4.22Å; V242-V278 HydrophobicContact CG2-CG1 3.57Å; V242-Q279 PolarHBondContact N-O 3.2Å; V242-Q281 PolarHBondContact O-N 2.87Å; V242-F300 HydrophobicContact CB-CE2 4.45Å; V242-F300 HydrophobicContact CB-CZ 4.16Å; V242-F300 HydrophobicContact CG1-CE2 4.17Å; V242-F300 HydrophobicContact CG1-CZ 3.95Å; V242-F300 HydrophobicContact CG2-CZ 4.17Å; V242-N316 HydrophobicContact CG2-CB 4.47Å; V242-V319 HydrophobicContact CG1-CG2 3.68Å
243	D	95.5	Very high	89.1	Confident	60 Å²	60	72.9 Å²	72.9	32%	0.321	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	103.3	177.3	-179.5	15.4	0	0	0	111.8	L245 Q246 Q281 V319	D243-L245 PolarHBondContact O-N 3.1Å; D243-L245 WeakPolarHBondContact OD1-CB 3.44Å; D243-L245 PolarHBondContact OD1-N 3.16Å; D243-Q246 HydrophobicContact CB-CG 4.15Å; D243-Q246 VanDerWaalsContact O-CG 3.26Å; D243-Q246 WeakPolarHBondContact O-CG 3.18Å; D243-Q281 CarbonylContact C-O 3.54Å; D243-Q281 HydrophobicContact CB-CB 4.4Å; D243-V319 WeakPolarHBondContact O-CG1 3.32Å
244	L	95	Very high	88.4	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.3	178.2	-63.6	179.5	0	0	0	113.3	V242 C280 Q281 F300 T302 V319 C321	V242-L244 HydrophobicContact CG1-CD2 4.21Å; V242-L244 PolarHBondContact O-N 3.31Å; L244-C280 HydrophobicContact CD1-CB 4.26Å; L244-Q281 PolarHBondContact N-O 2.57Å; L244-F300 HydrophobicContact CD2-CE2 4.32Å; L244-T302 HydrophobicContact CD1-CG2 3.67Å; L244-T302 WeakPolarHBondContact CD1-OG1 3.42Å; L244-V319 HydrophobicContact CD2-CG1 3.9Å; L244-C321 VanDerWaalsContact O-CB 3.27Å; L244-C321 WeakPolarHBondContact O-CB 3.35Å
245	L	90.6	Very high	87.8	Confident	12 Å²	12	71.6 Å²	71.6	6%	0.063	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	15.1	-179.5	-63.1	179.8	0	0	0	113	D243 G247 Q248 F251 P282 H304 L323	D243-L245 PolarHBondContact O-N 3.1Å; D243-L245 WeakPolarHBondContact OD1-CB 3.44Å; D243-L245 PolarHBondContact OD1-N 3.16Å; L245-G247 PolarHBondContact O-N 3.01Å; L245-Q248 HydrophobicContact CB-CB 4.35Å; L245-Q248 WeakPolarHBondContact O-CB 3.24Å; L245-Q248 PolarHBondContact O-N 3.04Å; L245-F251 HydrophobicContact CD1-CB 3.84Å; L245-F251 HydrophobicContact CD1-CD1 3.17Å; L245-F251 HydrophobicContact CD1-CD2 4.19Å; L245-F251 HydrophobicContact CD1-CE1 3.68Å; L245-F251 HydrophobicContact CD1-CG 3.46Å; L245-F251 VanDerWaalsContact CD1-CG 3.46Å; L245-F251 HydrophobicContact CD1-CZ 4.36Å; L245-P282 VanDerWaalsContact CD1-CD 3.47Å; L245-P282 HydrophobicContact CD1-CG 3.44Å; L245-P282 VanDerWaalsContact CD1-CG 3.44Å; L245-P282 HydrophobicContact CG-CG 4.14Å; L245-H304 HydrophobicContact CD2-CB 4.08Å; L245-L323 HydrophobicContact CD2-CD1 3.51Å
246	Q	82.8	Confident	87.3	Confident	115 Å²	115	73 Å²	73	54%	0.537	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.1	118.8	176.1	-81.2	172.9	16.3	0	0	111.8	D243	D243-Q246 HydrophobicContact CB-CG 4.15Å; D243-Q246 VanDerWaalsContact O-CG 3.26Å; D243-Q246 WeakPolarHBondContact O-CG 3.18Å
247	G	72.8	Confident	87.3	Confident	78 Å²	78	74 Å²	74	80%	0.804	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	6.6	-179.1	0	0	0	0	0	116	L245	L245-G247 PolarHBondContact O-N 3.01Å
248	Q	78.8	Confident	87.2	Confident	69 Å²	69	76.3 Å²	76.3	32%	0.322	41%	0.41	S	S	.	.			trans	-106.6	108.7	172.2	-61.6	-68.5	-53.8	0	0	110.2	L245	L245-Q248 HydrophobicContact CB-CB 4.35Å; L245-Q248 WeakPolarHBondContact O-CB 3.24Å; L245-Q248 PolarHBondContact O-N 3.04Å
249	E	76.6	Confident	87.2	Confident	181 Å²	181	72.8 Å²	72.8	85%	0.846	39%	0.394	S	S	*	.			trans	-86.1	152.8	176	-64.3	-174.2	173.9	0	0	111.9	F251	E249-F251 VanDerWaalsContact C-N 3.33Å; E249-F251 PolarHBondContact O-N 3.02Å
250	G	76	Confident	87.2	Confident	81 Å²	81	74.6 Å²	74.6	84%	0.835	40%	0.397	S	S	*	.	S	Bend	trans	82.5	-4	172	0	0	0	0	0	116.4	R252	G250-R252 PolarHBondContact O-N 2.91Å
251	F	80.8	Confident	87.1	Confident	47 Å²	47	72.5 Å²	72.5	21%	0.206	39%	0.39	C	S	.	.			trans	-69.6	130.2	174	-176.1	-87.9	0	0	0	111.2	L245 E249 W253 P282 H304	L245-F251 HydrophobicContact CD1-CB 3.84Å; L245-F251 HydrophobicContact CD1-CD1 3.17Å; L245-F251 HydrophobicContact CD1-CD2 4.19Å; L245-F251 HydrophobicContact CD1-CE1 3.68Å; L245-F251 HydrophobicContact CD1-CG 3.46Å; L245-F251 VanDerWaalsContact CD1-CG 3.46Å; L245-F251 HydrophobicContact CD1-CZ 4.36Å; E249-F251 VanDerWaalsContact C-N 3.33Å; E249-F251 PolarHBondContact O-N 3.02Å; F251-W253 HydrophobicContact CE1-CB 4.33Å; F251-W253 HydrophobicContact CE1-CE3 4.37Å; F251-P282 HydrophobicContact CD1-CG 4.05Å; F251-P282 HydrophobicContact CE1-CB 4.32Å; F251-P282 HydrophobicContact CE1-CG 3.45Å; F251-P282 VanDerWaalsContact CE1-CG 3.45Å; F251-P282 HydrophobicContact CZ-CG 4.22Å; F251-H304 AromaticContact CZ-CD2 3.85Å; F251-H304 AromaticContact CZ-NE2 3.59Å
252	R	81	Confident	87	Confident	205 Å²	205	72.3 Å²	72.3	77%	0.774	38%	0.383	S	S	*	.			trans	-119.7	117.5	176.5	-174	175.7	176	179.9	0.4	110.6	G250	G250-R252 PolarHBondContact O-N 2.91Å
253	W	86.2	Confident	86.7	Confident	71 Å²	71	80.3 Å²	80.3	27%	0.269	42%	0.42	S	S	.	.			trans	-66.8	131.1	173.9	179.8	-116.5	0	0	0	111.3	F251 G255 H256 P282 P283 A284 H304	F251-W253 HydrophobicContact CE1-CB 4.33Å; F251-W253 HydrophobicContact CE1-CE3 4.37Å; W253-G255 VanDerWaalsContact CE2-CA 3.44Å; W253-G255 VanDerWaalsContact CZ2-CA 3.49Å; W253-G255 VanDerWaalsContact NE1-C 3.31Å; W253-G255 PolarHBondContact NE1-O 2.84Å; W253-H256 PolarHBondContact NE1-O 3.24Å; W253-P282 HydrophobicContact CB-CB 4.28Å; W253-P282 HydrophobicContact CD2-CB 3.71Å; W253-P282 HydrophobicContact CE3-CB 3.46Å; W253-P282 VanDerWaalsContact CE3-CB 3.46Å; W253-P282 HydrophobicContact CE3-CG 4.27Å; W253-P282 HydrophobicContact CG-CB 4.1Å; W253-P282 HydrophobicContact CZ3-CB 4.04Å; W253-P283 HydrophobicContact CZ2-CG 4.18Å; W253-P283 VanDerWaalsContact CZ2-O 3.31Å; W253-P283 WeakPolarHBondContact CZ2-O 3.4Å; W253-A284 HydrophobicContact CH2-CB 3.68Å; W253-A284 HydrophobicContact CZ3-CB 3.94Å; W253-H304 AromaticContact CZ3-CE1 3.74Å
254	K	81.8	Confident	86.5	Confident	111 Å²	111	84.1 Å²	84.1	48%	0.483	44%	0.436	S	S	.	.			trans	-122.4	13.8	179.9	-64.4	-178.5	-178.8	177.2	0	112.8	E332	K254-E332 IonicContact NZ-OE1 2.92Å; K254-E332 PolarHBondContact NZ-OE1 3.42Å
255	G	82.5	Confident	86.4	Confident	25 Å²	25	87 Å²	87	26%	0.258	46%	0.455	S	S	.	.	S	Bend	trans	-100.5	-164.5	179.3	0	0	0	0	0	113.1	W253	W253-G255 VanDerWaalsContact CE2-CA 3.44Å; W253-G255 VanDerWaalsContact CZ2-CA 3.49Å; W253-G255 VanDerWaalsContact NE1-C 3.31Å; W253-G255 PolarHBondContact NE1-O 2.84Å
256	H	84.8	Confident	86.6	Confident	84 Å²	84	87.3 Å²	87.3	39%	0.389	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-60.2	142	174.2	-68.3	-70.8	0	0	0	111.2	R199 W253 P283	R199-H256 HydrophobicContact CG-CB 3.82Å; W253-H256 PolarHBondContact NE1-O 3.24Å; H256-P283 WeakPolarHBondContact O-CG 3.28Å
257	T	92.6	Very high	87.2	Confident	95 Å²	95	87.4 Å²	87.4	58%	0.583	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-66.7	160.8	171.9	50.1	0	0	0	0	110.6	R199	R199-T257 VanDerWaalsContact CD-O 3.25Å; R199-T257 WeakPolarHBondContact CD-O 3.47Å; R199-T257 PolarHBondContact NH1-OG1 3.27Å
258	Q	94.1	Very high	88.3	Confident	59 Å²	59	84.3 Å²	84.3	28%	0.276	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-59.2	160.4	170.6	68	-178.2	34	0	0	110.8	R199 Q279 P283	R199-Q258 PolarHBondContact NH1-O 2.93Å; Q258-Q279 HydrophobicContact CB-CG 4.11Å; Q258-P283 HydrophobicContact CB-CB 3.91Å; Q258-P283 HydrophobicContact CB-CG 4.38Å
259	L	94.3	Very high	89.1	Confident	7 Å²	7	85 Å²	85	4%	0.037	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-82	142.2	169.6	-70.7	165.8	0	0	0	109.5	F164 R199 L200 Q222 V261	F164-L259 HydrophobicContact CB-CB 4.49Å; F164-L259 HydrophobicContact CD1-CB 3.44Å; F164-L259 VanDerWaalsContact CD1-CB 3.44Å; F164-L259 HydrophobicContact CD1-CD1 4.19Å; F164-L259 HydrophobicContact CD1-CG 4.41Å; F164-L259 HydrophobicContact CD2-CD1 4.05Å; F164-L259 HydrophobicContact CE1-CB 3.75Å; F164-L259 HydrophobicContact CE1-CD1 4.16Å; F164-L259 HydrophobicContact CE2-CD1 4.04Å; F164-L259 HydrophobicContact CG-CB 3.96Å; F164-L259 HydrophobicContact CG-CD1 4.14Å; F164-L259 HydrophobicContact CZ-CD1 4.1Å; R199-L259 HydrophobicContact CB-CD1 4.29Å; R199-L259 HydrophobicContact CB-CD2 3.89Å; R199-L259 HydrophobicContact CB-CG 4.06Å; L200-L259 HydrophobicContact CD2-CD1 3.74Å; L200-L259 HydrophobicContact CD2-CD2 4.42Å; L200-L259 HydrophobicContact CG-CD1 4.41Å; Q222-L259 HydrophobicContact CG-CD1 4.18Å; L259-V261 PolarHBondContact O-N 3.32Å
260	D	94.4	Very high	90.1	Very high	88 Å²	88	77.5 Å²	77.5	47%	0.471	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-84.1	117	179	-61.9	-47.5	0	0	0	109.4	F164 S165	F164-D260 CarbonylContact C-O 3.48Å; F164-D260 WeakPolarHBondContact CA-O 3.33Å; S165-D260 PolarHBondContact N-O 3.05Å
261	V	94.8	Very high	91.2	Very high	31 Å²	31	73.6 Å²	73.6	19%	0.188	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-78.7	136.1	179.2	-179.5	0	0	0	0	108.9	V163 F164 A239 L259 E263 V277	V163-V261 HydrophobicContact CG1-CG1 4.09Å; F164-V261 HydrophobicContact CD1-CG2 4.03Å; F164-V261 HydrophobicContact CE1-CG2 3.82Å; A239-V261 HydrophobicContact CB-CB 4.12Å; A239-V261 HydrophobicContact CB-CG1 4.19Å; A239-V261 HydrophobicContact CB-CG2 3.94Å; L259-V261 PolarHBondContact O-N 3.32Å; V261-E263 PolarHBondContact O-N 3.32Å; V261-V277 HydrophobicContact CG1-CG2 4.5Å; V261-V277 HydrophobicContact CG2-CB 4.44Å; V261-V277 HydrophobicContact CG2-CG1 4.34Å; V261-V277 HydrophobicContact CG2-CG2 4.38Å
262	R	93.9	Very high	92	Very high	98 Å²	98	71.6 Å²	71.6	37%	0.37	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-65.4	130.4	177.2	-66.3	-178.1	-176.8	-159	-2.8	110.5	A162 V163 F164 V266	A162-R262 WeakPolarHBondContact O-CD 3.3Å; A162-R262 PolarHBondContact O-NE 3.04Å; V163-R262 PolarHBondContact O-N 3.18Å; F164-R262 PolarHBondContact O-NE 2.83Å; F164-R262 PolarHBondContact O-NH2 3.38Å; R262-V266 HydrophobicContact CB-CG2 4.29Å
263	E	91.3	Very high	92.8	Very high	169 Å²	169	62.2 Å²	62.2	79%	0.79	32%	0.319	S	S	*	.			trans	-83.1	-27.1	175.4	-60.7	-173.3	166.2	0	0	112	T236 V261	T236-E263 WeakPolarHBondContact CG2-O 3.36Å; V261-E263 PolarHBondContact O-N 3.32Å
264	E	91.8	Very high	93.3	Very high	141 Å²	141	59 Å²	59	66%	0.659	31%	0.307	S	S	*	.	S	Bend	trans	-77.6	150.1	178.9	-60.7	-57.2	152.4	0	0	112.1	V266	E264-V266 PolarHBondContact O-N 3.07Å
265	P	93.2	Very high	94	Very high	61 Å²	61	55.6 Å²	55.6	40%	0.396	29%	0.292	S	S	.	.			trans	-55.9	137.2	172.6	-20.7	31.2	0	0	0	111.6	E234	E234-P265 HydrophobicContact CG-CB 3.67Å
266	V	94.4	Very high	94.7	Very high	17 Å²	17	54.4 Å²	54.4	10%	0.103	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	130.3	176.3	-179.5	0	0	0	0	108.5	A162 E234 Q235 R262 E264 F268	A162-V266 HydrophobicContact CB-CG1 4.49Å; E234-V266 WeakPolarHBondContact CA-O 3.43Å; Q235-V266 PolarHBondContact N-O 2.74Å; Q235-V266 VanDerWaalsContact N-O 3.08Å; Q235-V266 PolarHBondContact O-N 3.12Å; R262-V266 HydrophobicContact CB-CG2 4.29Å; E264-V266 PolarHBondContact O-N 3.07Å; V266-F268 HydrophobicContact CB-CD2 4.46Å; V266-F268 HydrophobicContact CB-CE1 4.31Å; V266-F268 HydrophobicContact CB-CE2 3.78Å; V266-F268 HydrophobicContact CB-CZ 3.68Å; V266-F268 HydrophobicContact CG1-CD1 4.27Å; V266-F268 HydrophobicContact CG1-CE1 3.82Å; V266-F268 HydrophobicContact CG1-CE2 4.12Å; V266-F268 HydrophobicContact CG1-CZ 3.73Å; V266-F268 HydrophobicContact CG2-CZ 4.49Å; V266-F268 VanDerWaalsContact O-CD2 3.3Å; V266-F268 WeakPolarHBondContact O-CD2 3.1Å; V266-F268 WeakPolarHBondContact O-CE2 3.49Å; V266-F268 PolarHBondContact O-N 3.42Å
267	L	95.6	Very high	95.4	Very high	118 Å²	118	50.4 Å²	50.4	62%	0.618	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	107.9	171.1	-178.5	66	0	0	0	109.7	A232 E234	A232-L267 HydrophobicContact CB-CD1 4.25Å; E234-L267 HydrophobicContact CB-CD1 4.17Å
268	F	96.1	Very high	95.6	Very high	12 Å²	12	45.9 Å²	45.9	5%	0.053	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.4	173.5	-61.3	-77.1	0	0	0	110.5	A162 V163 A232 A233 Q235 V237 V266 Q273 P274	A162-F268 HydrophobicContact CB-CE1 4.23Å; V163-F268 HydrophobicContact CG2-CE1 4.07Å; V163-F268 HydrophobicContact CG2-CZ 4.1Å; A232-F268 CarbonylContact C-O 3.49Å; A232-F268 WeakPolarHBondContact CA-O 3.11Å; A232-F268 WeakPolarHBondContact CB-O 3.39Å; A233-F268 PolarHBondContact N-O 3.32Å; A233-F268 PolarHBondContact O-N 2.86Å; Q235-F268 HydrophobicContact CG-CD2 3.72Å; Q235-F268 HydrophobicContact CG-CE2 3.74Å; V237-F268 HydrophobicContact CG2-CE2 3.84Å; V237-F268 HydrophobicContact CG2-CZ 3.72Å; V266-F268 HydrophobicContact CB-CD2 4.46Å; V266-F268 HydrophobicContact CB-CE1 4.31Å; V266-F268 HydrophobicContact CB-CE2 3.78Å; V266-F268 HydrophobicContact CB-CZ 3.68Å; V266-F268 HydrophobicContact CG1-CD1 4.27Å; V266-F268 HydrophobicContact CG1-CE1 3.82Å; V266-F268 HydrophobicContact CG1-CE2 4.12Å; V266-F268 HydrophobicContact CG1-CZ 3.73Å; V266-F268 HydrophobicContact CG2-CZ 4.49Å; V266-F268 VanDerWaalsContact O-CD2 3.3Å; V266-F268 WeakPolarHBondContact O-CD2 3.1Å; V266-F268 WeakPolarHBondContact O-CE2 3.49Å; V266-F268 PolarHBondContact O-N 3.42Å; F268-Q273 HydrophobicContact CB-CB 4.33Å; F268-Q273 HydrophobicContact CB-CG 3.81Å; F268-P274 HydrophobicContact CD1-CG 4.15Å; F268-P274 HydrophobicContact CE1-CG 3.56Å; F268-P274 HydrophobicContact CE2-CG 4.09Å; F268-P274 HydrophobicContact CZ-CG 3.52Å
269	P	95.8	Very high	95.8	Very high	84 Å²	84	43.3 Å²	43.3	55%	0.545	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-67.8	170.1	174.2	30.6	-35.7	0	0	0	111.5	Q273	P269-Q273 PolarHBondContact O-NE2 3.23Å
270	P	97.3	Very high	96	Very high	23 Å²	23	43 Å²	43	15%	0.149	22%	0.22	C	C	.	.	S	Bend	trans	-52	141.5	168.8	-27.4	37.5	0	0	0	112.1	V105 D230	V105-P270 HydrophobicContact CG1-CG 4.19Å; D230-P270 WeakPolarHBondContact O-CB 3.23Å
271	G	97.7	Very high	96	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.5	-151.7	-175	0	0	0	0	0	112.5	N229 Q273	N229-G271 PolarHBondContact N-O 3.4Å; N229-G271 PolarHBondContact O-N 2.57Å; G271-Q273 PolarHBondContact O-N 3.12Å
272	F	98.4	Very high	96	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.022	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	111.6	-179.8	-73.6	-88.2	0	0	0	110.6	I99 F144 Y156 L158 L207 G212 L214 L226 E227 L228	I99-F272 HydrophobicContact CD1-CE2 4.44Å; I99-F272 HydrophobicContact CG1-CE2 4.15Å; F144-F272 HydrophobicContact CD1-CE2 4.42Å; F144-F272 HydrophobicContact CE1-CD2 4.24Å; F144-F272 AromaticContact CE1-CE2 3.46Å; F144-F272 HydrophobicContact CE1-CE2 3.46Å; F144-F272 VanDerWaalsContact CE1-CE2 3.46Å; F144-F272 AromaticContact CE1-CZ 3.93Å; F144-F272 HydrophobicContact CE1-CZ 3.93Å; F144-F272 HydrophobicContact CE2-CD2 4.36Å; F144-F272 HydrophobicContact CE2-CE2 4.37Å; F144-F272 AromaticContact CZ-CD2 3.76Å; F144-F272 HydrophobicContact CZ-CD2 3.76Å; F144-F272 AromaticContact CZ-CE2 3.44Å; F144-F272 HydrophobicContact CZ-CE2 3.44Å; F144-F272 VanDerWaalsContact CZ-CE2 3.44Å; F144-F272 HydrophobicContact CZ-CZ 4.04Å; Y156-F272 HydrophobicContact CD1-CD2 4.15Å; Y156-F272 HydrophobicContact CE1-CB 4.44Å; Y156-F272 AromaticContact CE1-CD2 3.65Å; Y156-F272 HydrophobicContact CE1-CD2 3.65Å; Y156-F272 HydrophobicContact CE1-CE2 4.48Å; Y156-F272 PolarHBondContact OH-N 3.33Å; Y156-F272 VanDerWaalsContact OH-N 3.1Å; L158-F272 HydrophobicContact CD1-CB 4.26Å; L158-F272 WeakPolarHBondContact CD1-O 3.44Å; L207-F272 HydrophobicContact CD1-CE1 3.89Å; L207-F272 HydrophobicContact CD1-CZ 3.84Å; G212-F272 WeakPolarHBondContact O-CE1 3.23Å; L214-F272 HydrophobicContact CB-CD1 3.53Å; L214-F272 HydrophobicContact CB-CE1 3.63Å; L214-F272 HydrophobicContact CB-CG 4.43Å; L214-F272 HydrophobicContact CD2-CB 4.12Å; L214-F272 HydrophobicContact CD2-CD1 3.79Å; L214-F272 HydrophobicContact CD2-CD2 4.38Å; L214-F272 HydrophobicContact CD2-CE1 4.26Å; L214-F272 HydrophobicContact CD2-CG 3.84Å; L214-F272 HydrophobicContact CG-CD1 4.32Å; L226-F272 HydrophobicContact CB-CB 4.15Å; L226-F272 HydrophobicContact CD2-CB 4.16Å; E227-F272 CarbonylContact O-C 3.53Å; E227-F272 WeakPolarHBondContact O-CA 3.21Å; L228-F272 HydrophobicContact CB-CD1 4.14Å; L228-F272 HydrophobicContact CB-CE1 3.91Å; L228-F272 HydrophobicContact CB-CZ 4.18Å; L228-F272 HydrophobicContact CD1-CD2 4.06Å; L228-F272 HydrophobicContact CD1-CE2 4.04Å; L228-F272 HydrophobicContact CD1-CG 4.44Å; L228-F272 HydrophobicContact CD1-CZ 4.39Å; L228-F272 HydrophobicContact CD2-CZ 4.48Å
273	Q	98	Very high	96.1	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.037	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.5	-174.8	-62.6	174.4	-12.1	0	0	110.3	L226 E227 N229 E231 A233 F268 P269 G271	L226-Q273 VanDerWaalsContact CA-O 3.27Å; L226-Q273 WeakPolarHBondContact CA-O 3.47Å; E227-Q273 PolarHBondContact N-O 3.21Å; E227-Q273 PolarHBondContact O-N 3.07Å; N229-Q273 HydrophobicContact CB-CG 4.27Å; N229-Q273 PolarHBondContact ND2-OE1 3.27Å; E231-Q273 PolarHBondContact O-NE2 2.77Å; A233-Q273 VanDerWaalsContact CB-OE1 3.31Å; F268-Q273 HydrophobicContact CB-CB 4.33Å; F268-Q273 HydrophobicContact CB-CG 3.81Å; P269-Q273 PolarHBondContact O-NE2 3.23Å; G271-Q273 PolarHBondContact O-N 3.12Å
274	P	97.3	Very high	96.1	Very high	4 Å²	4	28.5 Å²	28.5	3%	0.026	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	131.8	-178.2	30.2	-31.7	0	0	0	111.4	V163 L224 M225 L226 Q235 V237 F268	V163-P274 HydrophobicContact CG2-CB 4.06Å; V163-P274 HydrophobicContact CG2-CG 3.42Å; V163-P274 VanDerWaalsContact CG2-CG 3.42Å; L224-P274 HydrophobicContact CD2-CB 4.23Å; M225-P274 WeakPolarHBondContact O-CA 3.24Å; L226-P274 HydrophobicContact CD2-CB 4.04Å; L226-P274 HydrophobicContact CD2-CG 4.47Å; L226-P274 HydrophobicContact CG-CB 3.99Å; Q235-P274 PolarHBondContact NE2-O 2.86Å; V237-P274 HydrophobicContact CG1-CB 4.38Å; V237-P274 HydrophobicContact CG2-CB 4.48Å; V237-P274 HydrophobicContact CG2-CG 4.16Å; F268-P274 HydrophobicContact CD1-CG 4.15Å; F268-P274 HydrophobicContact CE1-CG 3.56Å; F268-P274 HydrophobicContact CE2-CG 4.09Å; F268-P274 HydrophobicContact CZ-CG 3.52Å
275	F	96.5	Very high	96.3	Very high	39 Å²	39	23.4 Å²	23.4	17%	0.171	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-15.3	178.8	63.8	-95.4	0	0	0	113.6	Y213 M225 E227 Y311	Y213-F275 HydrophobicContact CD1-CE1 4.09Å; Y213-F275 HydrophobicContact CD1-CZ 4.45Å; Y213-F275 AromaticContact CE1-CE1 3.9Å; Y213-F275 HydrophobicContact CE1-CE1 3.9Å; Y213-F275 HydrophobicContact CE1-CZ 4.18Å; M225-F275 HydrophobicContact CB-CE1 3.85Å; M225-F275 HydrophobicContact CB-CE2 3.96Å; M225-F275 HydrophobicContact CB-CZ 3.54Å; M225-F275 WeakPolarHBondContact O-CD1 3.46Å; M225-F275 PolarHBondContact O-N 2.81Å; E227-F275 HydrophobicContact CB-CD1 4.35Å; E227-F275 HydrophobicContact CB-CE1 4.33Å; F275-Y311 HydrophobicContact CE2-CD2 4.19Å; F275-Y311 AromaticContact CZ-CD2 3.84Å; F275-Y311 HydrophobicContact CZ-CD2 3.84Å; F275-Y311 HydrophobicContact CZ-CE2 4.46Å; F275-Y311 HydrophobicContact CZ-CG 4.48Å
276	T	97.1	Very high	96.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	148.4	171.3	-175.4	0	0	0	0	112.3	M225 E238 Y309	M225-T276 HydrophobicContact CB-CG2 3.61Å; M225-T276 HydrophobicContact CG-CG2 3.73Å; M225-T276 PolarHBondContact N-O 2.94Å; E238-T276 CarbonylContact O-C 3.58Å; E238-T276 VanDerWaalsContact O-CA 3.29Å; E238-T276 WeakPolarHBondContact O-CA 3.31Å; E238-T276 PolarHBondContact O-OG1 2.96Å; T276-Y309 HydrophobicContact CG2-CE1 4.14Å; T276-Y309 PolarHBondContact OG1-OH 2.81Å
277	V	98.1	Very high	96.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.7	170	-174.2	0	0	0	0	109.4	V163 Q222 I223 L224 V237 E238 A239 K240 V261	V163-V277 HydrophobicContact CG1-CG2 3.7Å; Q222-V277 HydrophobicContact CB-CG1 4.28Å; I223-V277 CarbonylContact O-C 3.55Å; I223-V277 WeakPolarHBondContact O-CA 3.25Å; L224-V277 HydrophobicContact CG-CG2 4.2Å; V237-V277 HydrophobicContact CG1-CG2 3.67Å; E238-V277 PolarHBondContact O-N 2.86Å; A239-V277 CarbonylContact C-O 3.56Å; A239-V277 VanDerWaalsContact CA-O 3.31Å; A239-V277 WeakPolarHBondContact CA-O 3.28Å; A239-V277 HydrophobicContact CB-CB 4.44Å; K240-V277 PolarHBondContact N-O 3.44Å; V261-V277 HydrophobicContact CG1-CG2 4.5Å; V261-V277 HydrophobicContact CG2-CB 4.44Å; V261-V277 HydrophobicContact CG2-CG1 4.34Å; V261-V277 HydrophobicContact CG2-CG2 4.38Å
278	V	98.4	Very high	96.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.7	165.3	-175.5	0	0	0	0	108.2	Q222 I223 K240 V242 F300 Y309	Q222-V278 CarbonylContact C-O 3.57Å; I223-V278 HydrophobicContact CB-CB 4.24Å; I223-V278 HydrophobicContact CD1-CB 4.35Å; I223-V278 HydrophobicContact CD1-CG1 4.41Å; I223-V278 PolarHBondContact N-O 3.44Å; I223-V278 PolarHBondContact O-N 3Å; K240-V278 CarbonylContact O-C 3.55Å; K240-V278 WeakPolarHBondContact O-CA 3.4Å; V242-V278 HydrophobicContact CB-CG1 4.22Å; V242-V278 HydrophobicContact CG2-CG1 3.57Å; V278-F300 HydrophobicContact CG1-CE1 3.8Å; V278-F300 HydrophobicContact CG1-CE2 4.35Å; V278-F300 HydrophobicContact CG1-CZ 3.63Å; V278-Y309 HydrophobicContact CG2-CD1 3.38Å; V278-Y309 HydrophobicContact CG2-CD2 4Å; V278-Y309 HydrophobicContact CG2-CE1 3.57Å; V278-Y309 HydrophobicContact CG2-CE2 4.19Å; V278-Y309 HydrophobicContact CG2-CG 3.59Å
279	Q	98	Very high	97	Very high	5 Å²	5	16.2 Å²	16.2	2%	0.023	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	112.9	179.2	-180	55.4	58.4	0	0	109.8	A220 K240 I241 V242 Q258	A220-Q279 PolarHBondContact O-NE2 3.46Å; K240-Q279 PolarHBondContact O-N 3.06Å; I241-Q279 CarbonylContact C-O 3.58Å; I241-Q279 WeakPolarHBondContact CA-O 3.2Å; V242-Q279 PolarHBondContact N-O 3.2Å; Q258-Q279 HydrophobicContact CB-CG 4.11Å
280	C	97.6	Very high	97.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	139.8	173.5	-62.9	0	0	0	0	110.5	G221 I223 L244 P282 P283 F300 T302	G221-C280 WeakPolarHBondContact O-CB 3.48Å; G221-C280 PolarHBondContact O-N 3.24Å; G221-C280 PolarHBondContact O-SG 2.94Å; I223-C280 VanDerWaalsContact CD1-SG 3.6Å; L244-C280 HydrophobicContact CD1-CB 4.26Å; C280-P282 CarbonylContact C-O 3.51Å; C280-P282 CarbonylContact O-C 3.44Å; C280-P282 VanDerWaalsContact O-C 3.29Å; C280-P283 WeakPolarHBondContact O-CA 3.43Å; C280-F300 VanDerWaalsContact SG-CD2 3.59Å; C280-T302 HydrophobicContact CB-CG2 4.29Å
281	Q	95.1	Very high	97.2	Very high	72 Å²	72	11.9 Å²	11.9	34%	0.336	6%	0.063	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.6	168.1	-178.7	66.9	14.8	0	0	108.4	I241 V242 D243 L244	I241-Q281 HydrophobicContact CG2-CB 3.93Å; V242-Q281 PolarHBondContact O-N 2.87Å; D243-Q281 CarbonylContact C-O 3.54Å; D243-Q281 HydrophobicContact CB-CB 4.4Å; L244-Q281 PolarHBondContact N-O 2.57Å
282	P	94.2	Very high	97.2	Very high	3 Å²	3	12.6 Å²	12.6	2%	0.019	7%	0.066	C	C	.	.	S	Bend	cis	-60.6	154.9	-6.8	-19.5	30.2	0	0	0	113.4	L245 F251 W253 C280 A284	L245-P282 VanDerWaalsContact CD1-CD 3.47Å; L245-P282 HydrophobicContact CD1-CG 3.44Å; L245-P282 VanDerWaalsContact CD1-CG 3.44Å; L245-P282 HydrophobicContact CG-CG 4.14Å; F251-P282 HydrophobicContact CD1-CG 4.05Å; F251-P282 HydrophobicContact CE1-CB 4.32Å; F251-P282 HydrophobicContact CE1-CG 3.45Å; F251-P282 VanDerWaalsContact CE1-CG 3.45Å; F251-P282 HydrophobicContact CZ-CG 4.22Å; W253-P282 HydrophobicContact CB-CB 4.28Å; W253-P282 HydrophobicContact CD2-CB 3.71Å; W253-P282 HydrophobicContact CE3-CB 3.46Å; W253-P282 VanDerWaalsContact CE3-CB 3.46Å; W253-P282 HydrophobicContact CE3-CG 4.27Å; W253-P282 HydrophobicContact CG-CB 4.1Å; W253-P282 HydrophobicContact CZ3-CB 4.04Å; C280-P282 CarbonylContact C-O 3.51Å; C280-P282 CarbonylContact O-C 3.44Å; C280-P282 VanDerWaalsContact O-C 3.29Å; P282-A284 PolarHBondContact O-N 2.83Å
283	P	95.5	Very high	97	Very high	5 Å²	5	12.4 Å²	12.4	3%	0.032	7%	0.066	C	C	.	.			trans	-75.7	59.9	-179.7	32.9	-37.5	0	0	0	111.8	A220 W253 H256 Q258 C280	A220-P283 CarbonylContact C-O 3.29Å; A220-P283 WeakPolarHBondContact O-CA 3.49Å; A220-P283 WeakPolarHBondContact O-CB 3.49Å; W253-P283 HydrophobicContact CZ2-CG 4.18Å; W253-P283 VanDerWaalsContact CZ2-O 3.31Å; W253-P283 WeakPolarHBondContact CZ2-O 3.4Å; H256-P283 WeakPolarHBondContact O-CG 3.28Å; Q258-P283 HydrophobicContact CB-CB 3.91Å; Q258-P283 HydrophobicContact CB-CG 4.38Å; C280-P283 WeakPolarHBondContact O-CA 3.43Å
284	A	92.9	Very high	96.9	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.008	9%	0.085	C	C	.	.			trans	-89.9	157.7	-179.4	0	0	0	0	0	111.8	G221 W253 P282 V286 H304	G221-A284 WeakPolarHBondContact CA-O 3.29Å; G221-A284 PolarHBondContact N-O 2.98Å; G221-A284 VanDerWaalsContact N-O 3.14Å; W253-A284 HydrophobicContact CH2-CB 3.68Å; W253-A284 HydrophobicContact CZ3-CB 3.94Å; P282-A284 PolarHBondContact O-N 2.83Å; A284-V286 PolarHBondContact O-N 2.99Å; A284-H304 WeakPolarHBondContact CB-CE1 3.28Å
285	V	96.1	Very high	96.8	Very high	35 Å²	35	17.5 Å²	17.5	21%	0.212	9%	0.088	C	C	.	.			trans	-50.9	129.4	177	-178.5	0	0	0	0	111.1	Q203 T219 T287	Q203-V285 HydrophobicContact CG-CG1 3.89Å; T219-V285 HydrophobicContact CG2-CG2 3.93Å; T219-V285 VanDerWaalsContact O-CA 3.23Å; T219-V285 WeakPolarHBondContact O-CA 3.45Å; T219-V285 WeakPolarHBondContact O-CG2 3.18Å; T219-V285 PolarHBondContact O-N 2.84Å; V285-T287 PolarHBondContact O-N 2.86Å
286	V	98.3	Very high	96.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.			trans	-77.1	115.6	173.5	-176.4	0	0	0	0	109.5	Q203 A217 G218 I223 A284 A288 F300 G301	Q203-V286 WeakPolarHBondContact CB-O 3.31Å; A217-V286 HydrophobicContact CB-CB 3.71Å; A217-V286 HydrophobicContact CB-CG1 3.58Å; A217-V286 HydrophobicContact CB-CG2 4Å; G218-V286 PolarHBondContact O-N 2.83Å; I223-V286 HydrophobicContact CD1-CG2 4.13Å; I223-V286 HydrophobicContact CG1-CG2 4.05Å; A284-V286 PolarHBondContact O-N 2.99Å; V286-A288 WeakPolarHBondContact CG1-O 3.32Å; V286-F300 HydrophobicContact CG1-CB 4.32Å; V286-G301 CarbonylContact C-O 3.6Å; V286-G301 WeakPolarHBondContact CA-O 3.42Å
287	T	97.8	Very high	96.8	Very high	30 Å²	30	18.1 Å²	18.1	18%	0.184	9%	0.091	C	C	.	.			trans	-99.5	-19.8	-172.3	48.8	0	0	0	0	113.6	K204 V285 G301 T302 L405 V406	K204-T287 WeakPolarHBondContact CE-O 3.31Å; K204-T287 PolarHBondContact NZ-O 3.12Å; K204-T287 VanDerWaalsContact NZ-O 3.12Å; V285-T287 PolarHBondContact O-N 2.86Å; T287-G301 PolarHBondContact N-O 2.9Å; T287-G301 PolarHBondContact OG1-O 2.87Å; T287-G301 VanDerWaalsContact OG1-O 3.12Å; T287-T302 WeakPolarHBondContact OG1-CA 3.4Å; T287-T302 PolarHBondContact OG1-O 3.39Å; T287-L405 HydrophobicContact CG2-CD1 4.23Å; T287-L405 HydrophobicContact CG2-CG 4.34Å; T287-V406 VanDerWaalsContact CB-O 3.22Å; T287-V406 WeakPolarHBondContact CB-O 3.36Å; T287-V406 PolarHBondContact OG1-O 3.32Å
288	A	98.3	Very high	96.8	Very high	3 Å²	3	18.1 Å²	18.1	3%	0.025	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144.7	176.4	0	0	0	0	0	110.7	V286 F300 G301 V406 L409	V286-A288 WeakPolarHBondContact CG1-O 3.32Å; A288-F300 WeakPolarHBondContact O-CA 3.44Å; A288-G301 PolarHBondContact N-O 3.36Å; A288-G301 PolarHBondContact O-N 3.06Å; A288-V406 HydrophobicContact CB-CG1 4.14Å; A288-L409 HydrophobicContact CB-CD1 3.82Å; A288-L409 HydrophobicContact CB-CG 3.87Å
289	L	98.7	Very high	96.9	Very high	23 Å²	23	18.1 Å²	18.1	12%	0.12	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.9	-180	-173.5	67.6	0	0	0	109.3	K204 T215 A217 I223 V298 A299 F300	K204-L289 HydrophobicContact CB-CB 3.58Å; K204-L289 HydrophobicContact CB-CD2 3.67Å; K204-L289 HydrophobicContact CB-CG 4.29Å; K204-L289 HydrophobicContact CG-CB 3.96Å; T215-L289 HydrophobicContact CG2-CD1 4.31Å; T215-L289 HydrophobicContact CG2-CD2 3.76Å; T215-L289 HydrophobicContact CG2-CG 4.05Å; A217-L289 HydrophobicContact CB-CD1 4.32Å; A217-L289 HydrophobicContact CB-CD2 4Å; I223-L289 HydrophobicContact CG2-CD1 4.08Å; L289-V298 HydrophobicContact CD1-CG2 3.79Å; L289-A299 CarbonylContact C-O 3.51Å; L289-A299 WeakPolarHBondContact CA-O 3.41Å; L289-F300 HydrophobicContact CD1-CB 4.2Å
290	S	98.3	Very high	96.9	Very high	14 Å²	14	17.9 Å²	17.9	10%	0.098	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	133.4	173.6	-169.8	0	0	0	0	110.2	A299	S290-A299 PolarHBondContact N-O 2.89Å; S290-A299 PolarHBondContact O-N 2.8Å
291	L	98.3	Very high	96.9	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.9	177.2	178.8	62.2	0	0	0	109.9	H206 C208 T215 M225 V298 Y311	H206-L291 HydrophobicContact CB-CB 4.25Å; H206-L291 PolarHBondContact ND1-N 3.41Å; C208-L291 HydrophobicContact CB-CD2 4.06Å; T215-L291 HydrophobicContact CG2-CB 3.88Å; T215-L291 HydrophobicContact CG2-CD1 4.41Å; T215-L291 HydrophobicContact CG2-CD2 4.22Å; T215-L291 HydrophobicContact CG2-CG 4.4Å; M225-L291 HydrophobicContact CE-CD1 3.76Å; L291-V298 HydrophobicContact CD1-CB 4.47Å; L291-Y311 HydrophobicContact CD1-CE1 3.61Å
292	H	97.8	Very high	97	Very high	15 Å²	15	14.5 Å²	14.5	7%	0.069	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	92.5	167.2	-157.1	-73.9	0	0	0	109.8	E294 W295 K296 L297 F411	H292-E294 VanDerWaalsContact C-N 3.3Å; H292-E294 PolarHBondContact O-N 3.13Å; H292-W295 HydrophobicContact CB-CB 4.3Å; H292-W295 HydrophobicContact CB-CE3 4.15Å; H292-W295 AromaticContact CD2-CD2 3.92Å; H292-W295 AromaticContact CD2-CE3 3.65Å; H292-W295 AromaticContact CD2-CZ3 3.79Å; H292-W295 AromaticContact CE1-CD1 3.56Å; H292-W295 AromaticContact CE1-CD2 3.22Å; H292-W295 AromaticContact CE1-CE2 3.2Å; H292-W295 AromaticContact CE1-CE3 3.78Å; H292-W295 AromaticContact CE1-CG 3.45Å; H292-W295 VanDerWaalsContact CE1-CG 3.45Å; H292-W295 AromaticContact CE1-CZ2 3.74Å; H292-W295 AromaticContact CE1-NE1 3.4Å; H292-W295 PolarHBondContact CE1-NE1 2.84Å; H292-W295 AromaticContact CG-CD2 3.61Å; H292-W295 AromaticContact CG-CE3 3.5Å; H292-W295 AromaticContact CG-CG 3.88Å; H292-W295 WeakPolarHBondContact ND1-CB 3.35Å; H292-W295 AromaticContact ND1-CD1 3.56Å; H292-W295 AromaticContact ND1-CD2 3.14Å; H292-W295 AromaticContact ND1-CE2 3.68Å; H292-W295 AromaticContact ND1-CE3 3.59Å; H292-W295 AromaticContact ND1-CG 3.07Å; H292-W295 PolarHBondContact ND1-N 3.46Å; H292-W295 AromaticContact ND1-NE1 3.87Å; H292-W295 AromaticContact NE2-CD2 3.71Å; H292-W295 AromaticContact NE2-CE2 3.64Å; H292-W295 AromaticContact NE2-CE3 3.83Å; H292-W295 AromaticContact NE2-CH2 3.81Å; H292-W295 AromaticContact NE2-CZ2 3.7Å; H292-W295 AromaticContact NE2-CZ3 3.88Å; H292-W295 PolarHBondContact O-N 3.19Å; H292-K296 PolarHBondContact O-N 2.83Å; H292-L297 PolarHBondContact N-O 2.85Å; H292-L297 PolarHBondContact O-N 3.4Å; H292-L297 VanDerWaalsContact O-N 3.16Å; H292-F411 HydrophobicContact CB-CB 4.47Å; H292-F411 HydrophobicContact CB-CD2 3.7Å; H292-F411 HydrophobicContact CB-CE2 3.94Å; H292-F411 HydrophobicContact CB-CG 4.01Å; H292-F411 HydrophobicContact CB-CZ 4.46Å
293	S	95.4	Very high	96.9	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.007	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-26.6	-171.3	53.2	0	0	0	0	114.7	C208 S211 K296 Y311 L486	C208-S293 VanDerWaalsContact SG-CB 3.53Å; C208-S293 PolarHBondContact SG-OG 3.31Å; S211-S293 WeakPolarHBondContact OG-CB 3.42Å; S293-K296 VanDerWaalsContact O-CD 3.32Å; S293-K296 WeakPolarHBondContact O-CD 3.42Å; S293-K296 WeakPolarHBondContact O-CE 3.35Å; S293-K296 PolarHBondContact O-NZ 3Å; S293-Y311 WeakPolarHBondContact CA-OH 3.04Å; S293-L486 WeakPolarHBondContact OG-CD1 3.33Å
294	E	94.5	Very high	96.8	Very high	95 Å²	95	14.3 Å²	14.3	44%	0.444	7%	0.072	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-39.5	175.5	-170.3	174.9	147.2	0	0	111.7	H292 K296 L486	H292-E294 VanDerWaalsContact C-N 3.3Å; H292-E294 PolarHBondContact O-N 3.13Å; E294-K296 VanDerWaalsContact C-N 3.35Å; E294-L486 HydrophobicContact CB-CD2 3.6Å; E294-L486 HydrophobicContact CB-CG 3.92Å; E294-L486 HydrophobicContact CG-CD2 3.66Å; E294-L486 HydrophobicContact CG-CG 4.49Å; E294-L486 PolarHBondContact OE2-N 2.9Å
295	W	95.5	Very high	96.9	Very high	25 Å²	25	14.2 Å²	14.2	10%	0.095	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-7.8	-176.8	-62.2	-13.5	0	0	0	112.9	H292 L297 F411 D413 P424 L440 I442 R448	H292-W295 HydrophobicContact CB-CB 4.3Å; H292-W295 HydrophobicContact CB-CE3 4.15Å; H292-W295 AromaticContact CD2-CD2 3.92Å; H292-W295 AromaticContact CD2-CE3 3.65Å; H292-W295 AromaticContact CD2-CZ3 3.79Å; H292-W295 AromaticContact CE1-CD1 3.56Å; H292-W295 AromaticContact CE1-CD2 3.22Å; H292-W295 AromaticContact CE1-CE2 3.2Å; H292-W295 AromaticContact CE1-CE3 3.78Å; H292-W295 AromaticContact CE1-CG 3.45Å; H292-W295 VanDerWaalsContact CE1-CG 3.45Å; H292-W295 AromaticContact CE1-CZ2 3.74Å; H292-W295 AromaticContact CE1-NE1 3.4Å; H292-W295 PolarHBondContact CE1-NE1 2.84Å; H292-W295 AromaticContact CG-CD2 3.61Å; H292-W295 AromaticContact CG-CE3 3.5Å; H292-W295 AromaticContact CG-CG 3.88Å; H292-W295 WeakPolarHBondContact ND1-CB 3.35Å; H292-W295 AromaticContact ND1-CD1 3.56Å; H292-W295 AromaticContact ND1-CD2 3.14Å; H292-W295 AromaticContact ND1-CE2 3.68Å; H292-W295 AromaticContact ND1-CE3 3.59Å; H292-W295 AromaticContact ND1-CG 3.07Å; H292-W295 PolarHBondContact ND1-N 3.46Å; H292-W295 AromaticContact ND1-NE1 3.87Å; H292-W295 AromaticContact NE2-CD2 3.71Å; H292-W295 AromaticContact NE2-CE2 3.64Å; H292-W295 AromaticContact NE2-CE3 3.83Å; H292-W295 AromaticContact NE2-CH2 3.81Å; H292-W295 AromaticContact NE2-CZ2 3.7Å; H292-W295 AromaticContact NE2-CZ3 3.88Å; H292-W295 PolarHBondContact O-N 3.19Å; W295-L297 VanDerWaalsContact C-N 3.3Å; W295-L297 HydrophobicContact CB-CD1 4.15Å; W295-L297 HydrophobicContact CB-CG 4.06Å; W295-L297 HydrophobicContact CE3-CD1 4.47Å; W295-F411 HydrophobicContact CE3-CD1 4.07Å; W295-F411 HydrophobicContact CZ3-CB 4.02Å; W295-F411 AromaticContact CZ3-CD1 3.83Å; W295-F411 HydrophobicContact CZ3-CD1 3.83Å; W295-F411 HydrophobicContact CZ3-CG 4.26Å; W295-D413 HydrophobicContact CH2-CB 4.22Å; W295-D413 HydrophobicContact CZ2-CB 4.02Å; W295-P424 HydrophobicContact CD2-CB 4.32Å; W295-P424 HydrophobicContact CE3-CB 4.17Å; W295-P424 HydrophobicContact CH2-CB 3.51Å; W295-P424 HydrophobicContact CH2-CG 4.21Å; W295-P424 HydrophobicContact CZ2-CB 3.64Å; W295-P424 HydrophobicContact CZ2-CG 3.84Å; W295-P424 HydrophobicContact CZ3-CB 3.77Å; W295-L440 HydrophobicContact CE3-CD1 4.33Å; W295-L440 HydrophobicContact CZ3-CD1 4.27Å; W295-I442 HydrophobicContact CB-CD1 3.74Å; W295-I442 HydrophobicContact CD2-CD1 3.38Å; W295-I442 HydrophobicContact CE3-CD1 3.83Å; W295-I442 HydrophobicContact CG-CD1 3.33Å; W295-R448 PolarHBondContact O-NH2 3.19Å; W295-R448 VanDerWaalsContact O-NH2 3.12Å
296	K	96.3	Very high	97	Very high	52 Å²	52	12.6 Å²	12.6	23%	0.226	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	40.5	-173.6	-47.7	-63.5	173.9	-165.8	0	113.1	Y213 H292 S293 E294 Y311 L312	Y213-K296 HydrophobicContact CE2-CD 4.43Å; H292-K296 PolarHBondContact O-N 2.83Å; S293-K296 VanDerWaalsContact O-CD 3.32Å; S293-K296 WeakPolarHBondContact O-CD 3.42Å; S293-K296 WeakPolarHBondContact O-CE 3.35Å; S293-K296 PolarHBondContact O-NZ 3Å; E294-K296 VanDerWaalsContact C-N 3.35Å; K296-Y311 VanDerWaalsContact C-CD1 3.41Å; K296-Y311 VanDerWaalsContact CA-CE1 3.5Å; K296-Y311 HydrophobicContact CB-CD2 4.35Å; K296-Y311 HydrophobicContact CB-CE1 4.33Å; K296-Y311 HydrophobicContact CB-CE2 3.95Å; K296-Y311 HydrophobicContact CD-CE2 3.82Å; K296-Y311 HydrophobicContact CG-CE2 4.47Å; K296-Y311 WeakPolarHBondContact O-CD1 3.48Å; K296-Y311 WeakPolarHBondContact O-CE1 3.22Å; K296-Y311 PolarHBondContact O-N 2.87Å; K296-Y311 VanDerWaalsContact O-N 3.11Å; K296-L312 HydrophobicContact CB-CB 3.67Å; K296-L312 HydrophobicContact CG-CB 4.03Å; K296-L312 HydrophobicContact CG-CD2 4.29Å
297	L	98	Very high	97	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.4	-178.9	-63.8	-178.6	0	0	0	112	H292 W295 V308 Y309 D310 Y311 V317 F411 L440 L453	H292-L297 PolarHBondContact N-O 2.85Å; H292-L297 PolarHBondContact O-N 3.4Å; H292-L297 VanDerWaalsContact O-N 3.16Å; W295-L297 VanDerWaalsContact C-N 3.3Å; W295-L297 HydrophobicContact CB-CD1 4.15Å; W295-L297 HydrophobicContact CB-CG 4.06Å; W295-L297 HydrophobicContact CE3-CD1 4.47Å; L297-V308 HydrophobicContact CB-CG1 4.26Å; L297-V308 HydrophobicContact CD1-CG1 4.12Å; L297-V308 HydrophobicContact CD2-CG1 4.02Å; L297-V308 HydrophobicContact CG-CG1 4.37Å; L297-Y309 WeakPolarHBondContact CA-O 3.35Å; L297-D310 HydrophobicContact CD2-CB 3.88Å; L297-Y311 VanDerWaalsContact N-CE1 3.31Å; L297-V317 HydrophobicContact CD2-CG2 4.26Å; L297-F411 HydrophobicContact CB-CE1 4.31Å; L297-F411 HydrophobicContact CB-CZ 3.87Å; L297-F411 HydrophobicContact CD1-CE1 4.13Å; L297-F411 HydrophobicContact CD1-CZ 4.48Å; L297-L440 HydrophobicContact CD1-CD1 3.88Å; L297-L453 HydrophobicContact CD1-CD1 4Å; L297-L453 HydrophobicContact CD1-CD2 4.39Å; L297-L453 HydrophobicContact CD2-CD1 3.98Å; L297-L453 HydrophobicContact CG-CD1 4.31Å
298	V	98.5	Very high	97	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.5	165.4	64.1	0	0	0	0	109.2	T215 M225 L289 L291 V308 Y309 Y311	T215-V298 HydrophobicContact CG2-CG2 4.24Å; M225-V298 HydrophobicContact SD-CB 3.85Å; M225-V298 HydrophobicContact SD-CG1 3.79Å; M225-V298 HydrophobicContact SD-CG2 4.01Å; L289-V298 HydrophobicContact CD1-CG2 3.79Å; L291-V298 HydrophobicContact CD1-CB 4.47Å; V298-V308 WeakPolarHBondContact O-CA 3.23Å; V298-Y309 HydrophobicContact CG1-CD1 4.04Å; V298-Y309 HydrophobicContact CG1-CG 4.47Å; V298-Y309 PolarHBondContact N-O 2.84Å; V298-Y309 PolarHBondContact O-N 3.31Å; V298-Y311 HydrophobicContact CB-CD1 4.38Å; V298-Y311 HydrophobicContact CG1-CD1 4.42Å
299	A	98.8	Very high	97	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.3	172.6	0	0	0	0	0	109.5	L289 S290 G307 V308 L409 F411 L426	L289-A299 CarbonylContact C-O 3.51Å; L289-A299 WeakPolarHBondContact CA-O 3.41Å; S290-A299 PolarHBondContact N-O 2.89Å; S290-A299 PolarHBondContact O-N 2.8Å; A299-G307 VanDerWaalsContact CA-O 3.32Å; A299-G307 WeakPolarHBondContact CA-O 3.33Å; A299-V308 HydrophobicContact CB-CG2 4.26Å; A299-L409 HydrophobicContact CB-CB 4.49Å; A299-L409 HydrophobicContact CB-CD1 3.99Å; A299-F411 HydrophobicContact CB-CE2 3.83Å; A299-F411 HydrophobicContact CB-CZ 3.71Å; A299-L426 HydrophobicContact CB-CD1 3.59Å; A299-L426 HydrophobicContact CB-CD2 4.45Å
300	F	98.8	Very high	97	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.5	-179	53.3	-88.6	0	0	0	110.4	I223 V242 L244 V278 C280 V286 A288 L289 F306 G307 L409	I223-F300 HydrophobicContact CD1-CB 3.72Å; I223-F300 HydrophobicContact CD1-CD1 3.95Å; I223-F300 HydrophobicContact CD1-CD2 3.6Å; I223-F300 HydrophobicContact CD1-CE2 4.2Å; I223-F300 HydrophobicContact CD1-CG 3.46Å; I223-F300 VanDerWaalsContact CD1-CG 3.46Å; I223-F300 HydrophobicContact CG1-CB 4.14Å; I223-F300 HydrophobicContact CG1-CG 4.33Å; V242-F300 HydrophobicContact CB-CE2 4.45Å; V242-F300 HydrophobicContact CB-CZ 4.16Å; V242-F300 HydrophobicContact CG1-CE2 4.17Å; V242-F300 HydrophobicContact CG1-CZ 3.95Å; V242-F300 HydrophobicContact CG2-CZ 4.17Å; L244-F300 HydrophobicContact CD2-CE2 4.32Å; V278-F300 HydrophobicContact CG1-CE1 3.8Å; V278-F300 HydrophobicContact CG1-CE2 4.35Å; V278-F300 HydrophobicContact CG1-CZ 3.63Å; C280-F300 VanDerWaalsContact SG-CD2 3.59Å; V286-F300 HydrophobicContact CG1-CB 4.32Å; A288-F300 WeakPolarHBondContact O-CA 3.44Å; L289-F300 HydrophobicContact CD1-CB 4.2Å; F300-F306 CarbonylContact O-C 3.57Å; F300-F306 WeakPolarHBondContact O-CA 3.47Å; F300-F306 WeakPolarHBondContact O-CB 3.41Å; F300-G307 PolarHBondContact N-O 3.46Å; F300-G307 VanDerWaalsContact N-O 3.08Å; F300-G307 PolarHBondContact O-N 3.19Å; F300-L409 VanDerWaalsContact C-CD1 3.43Å
301	G	98.3	Very high	96.8	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	148.9	179.9	0	0	0	0	0	112	V286 T287 A288 G305	V286-G301 CarbonylContact C-O 3.6Å; V286-G301 WeakPolarHBondContact CA-O 3.42Å; T287-G301 PolarHBondContact N-O 2.9Å; T287-G301 PolarHBondContact OG1-O 2.87Å; T287-G301 VanDerWaalsContact OG1-O 3.12Å; A288-G301 PolarHBondContact N-O 3.36Å; A288-G301 PolarHBondContact O-N 3.06Å; G301-G305 CarbonylContact C-O 3.39Å; G301-G305 WeakPolarHBondContact CA-O 3.48Å
302	T	97.1	Very high	96.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.065	C	C	.	.			trans	-124.7	-169.4	175.7	70.8	0	0	0	0	110.1	L244 C280 T287 H304 G305 V406	L244-T302 HydrophobicContact CD1-CG2 3.67Å; L244-T302 WeakPolarHBondContact CD1-OG1 3.42Å; C280-T302 HydrophobicContact CB-CG2 4.29Å; T287-T302 WeakPolarHBondContact OG1-CA 3.4Å; T287-T302 PolarHBondContact OG1-O 3.39Å; T302-H304 PolarHBondContact O-N 3.37Å; T302-H304 PolarHBondContact OG1-N 2.86Å; T302-H304 VanDerWaalsContact OG1-N 3.13Å; T302-G305 PolarHBondContact N-O 3.03Å; T302-V406 PolarHBondContact O-N 2.9Å
303	S	92.8	Very high	96.4	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.014	7%	0.069	C	C	.	.	S	Bend	trans	-65.3	-17.4	169.2	56	0	0	0	0	114.7	L335	S303-L335 VanDerWaalsContact OG-CD1 3.23Å; S303-L335 WeakPolarHBondContact OG-CD1 3.49Å
304	H	92.1	Very high	96.4	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.009	8%	0.083	C	C	.	.	S	Bend	trans	-103.5	-30.2	-172	-50.7	91.5	0	0	0	112.8	L245 F251 W253 A284 T302 T322 L323	L245-H304 HydrophobicContact CD2-CB 4.08Å; F251-H304 AromaticContact CZ-CD2 3.85Å; F251-H304 AromaticContact CZ-NE2 3.59Å; W253-H304 AromaticContact CZ3-CE1 3.74Å; A284-H304 WeakPolarHBondContact CB-CE1 3.28Å; T302-H304 PolarHBondContact O-N 3.37Å; T302-H304 PolarHBondContact OG1-N 2.86Å; T302-H304 VanDerWaalsContact OG1-N 3.13Å; H304-T322 VanDerWaalsContact C-OG1 3.29Å; H304-T322 PolarHBondContact O-N 3.35Å; H304-T322 PolarHBondContact O-OG1 2.92Å; H304-L323 HydrophobicContact CB-CD1 4.17Å; H304-L323 HydrophobicContact CB-CG 4.27Å; H304-L323 PolarHBondContact O-N 3.1Å
305	G	95.5	Very high	96.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.7	-174.2	-172	0	0	0	0	0	112.1	G301 T302 K320 T322	G301-G305 CarbonylContact C-O 3.39Å; G301-G305 WeakPolarHBondContact CA-O 3.48Å; T302-G305 PolarHBondContact N-O 3.03Å; G305-K320 CarbonylContact C-O 3.54Å; G305-K320 WeakPolarHBondContact CA-O 3.42Å; G305-T322 WeakPolarHBondContact CA-OG1 3.35Å; G305-T322 PolarHBondContact N-OG1 3.1Å
306	F	98.3	Very high	96.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	163	173.8	61.5	-83.7	0	0	0	110.9	F300 L318 K320 T322 V406 L409 L426 A428 F436 Y438	F300-F306 CarbonylContact O-C 3.57Å; F300-F306 WeakPolarHBondContact O-CA 3.47Å; F300-F306 WeakPolarHBondContact O-CB 3.41Å; F306-L318 HydrophobicContact CE2-CD2 3.95Å; F306-K320 HydrophobicContact CD1-CB 4.16Å; F306-K320 HydrophobicContact CD1-CG 4.34Å; F306-K320 HydrophobicContact CD2-CB 4.41Å; F306-K320 HydrophobicContact CE1-CB 3.68Å; F306-K320 HydrophobicContact CE1-CG 3.54Å; F306-K320 HydrophobicContact CE2-CB 3.96Å; F306-K320 HydrophobicContact CZ-CB 3.57Å; F306-K320 HydrophobicContact CZ-CG 3.64Å; F306-K320 PolarHBondContact N-O 2.91Å; F306-K320 PolarHBondContact O-N 2.88Å; F306-T322 HydrophobicContact CD1-CG2 3.87Å; F306-T322 HydrophobicContact CE1-CG2 3.8Å; F306-V406 HydrophobicContact CB-CG1 4.23Å; F306-V406 HydrophobicContact CB-CG2 4.06Å; F306-V406 HydrophobicContact CD1-CG2 3.86Å; F306-V406 HydrophobicContact CG-CG2 4.43Å; F306-L409 HydrophobicContact CB-CD2 4.26Å; F306-L409 HydrophobicContact CD2-CD2 4.33Å; F306-L409 HydrophobicContact CG-CD2 4.37Å; F306-L426 HydrophobicContact CD2-CD2 4.15Å; F306-L426 HydrophobicContact CE2-CD2 4.04Å; F306-A428 HydrophobicContact CD1-CB 4Å; F306-A428 HydrophobicContact CD2-CB 4.11Å; F306-A428 HydrophobicContact CE1-CB 3.75Å; F306-A428 HydrophobicContact CE2-CB 3.87Å; F306-A428 HydrophobicContact CG-CB 4.17Å; F306-A428 HydrophobicContact CZ-CB 3.67Å; F306-F436 AromaticContact CE1-CD2 3.85Å; F306-F436 HydrophobicContact CE1-CD2 3.85Å; F306-F436 HydrophobicContact CE1-CE2 4.39Å; F306-F436 HydrophobicContact CE1-CG 4.37Å; F306-F436 HydrophobicContact CZ-CB 4.13Å; F306-F436 HydrophobicContact CZ-CD2 4.22Å; F306-F436 HydrophobicContact CZ-CG 4.31Å; F306-Y438 HydrophobicContact CE2-CD2 4.41Å; F306-Y438 HydrophobicContact CE2-CE2 4.1Å; F306-Y438 HydrophobicContact CZ-CD2 4.44Å; F306-Y438 AromaticContact CZ-CE2 3.8Å; F306-Y438 HydrophobicContact CZ-CE2 3.8Å
307	G	98	Very high	96.3	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	168.5	173.6	0	0	0	0	0	113.1	A299 F300 L318	A299-G307 VanDerWaalsContact CA-O 3.32Å; A299-G307 WeakPolarHBondContact CA-O 3.33Å; F300-G307 PolarHBondContact N-O 3.46Å; F300-G307 VanDerWaalsContact N-O 3.08Å; F300-G307 PolarHBondContact O-N 3.19Å; G307-L318 CarbonylContact C-O 3.6Å; G307-L318 WeakPolarHBondContact CA-O 3.13Å
308	V	98.6	Very high	96.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.1	171.3	-179.4	0	0	0	0	107.8	L297 V298 A299 N316 V317 L318 F411 L426	L297-V308 HydrophobicContact CB-CG1 4.26Å; L297-V308 HydrophobicContact CD1-CG1 4.12Å; L297-V308 HydrophobicContact CD2-CG1 4.02Å; L297-V308 HydrophobicContact CG-CG1 4.37Å; V298-V308 WeakPolarHBondContact O-CA 3.23Å; A299-V308 HydrophobicContact CB-CG2 4.26Å; V308-N316 PolarHBondContact O-OD1 2.97Å; V308-N316 VanDerWaalsContact O-OD1 3.06Å; V308-V317 HydrophobicContact CB-CB 4.14Å; V308-V317 HydrophobicContact CB-CG1 4.49Å; V308-V317 HydrophobicContact CG1-CB 4.09Å; V308-V317 HydrophobicContact CG1-CG1 4.4Å; V308-V317 HydrophobicContact CG1-CG2 4.45Å; V308-V317 WeakPolarHBondContact O-CB 3.37Å; V308-V317 PolarHBondContact O-N 2.92Å; V308-L318 HydrophobicContact CB-CB 4.03Å; V308-L318 HydrophobicContact CG2-CB 4.11Å; V308-L318 HydrophobicContact CG2-CD2 4.18Å; V308-L318 PolarHBondContact N-O 3.44Å; V308-L318 PolarHBondContact O-N 3.26Å; V308-F411 HydrophobicContact CG1-CZ 4.49Å; V308-L426 HydrophobicContact CG2-CD2 3.35Å; V308-L426 HydrophobicContact CG2-CG 4.37Å
309	Y	98.1	Very high	96.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.5	177.7	-178.7	-103.7	0	0	0	109.9	K240 T276 V278 L297 V298 K314 N315	K240-Y309 HydrophobicContact CB-CE2 4.06Å; K240-Y309 HydrophobicContact CG-CE2 3.94Å; T276-Y309 HydrophobicContact CG2-CE1 4.14Å; T276-Y309 PolarHBondContact OG1-OH 2.81Å; V278-Y309 HydrophobicContact CG2-CD1 3.38Å; V278-Y309 HydrophobicContact CG2-CD2 4Å; V278-Y309 HydrophobicContact CG2-CE1 3.57Å; V278-Y309 HydrophobicContact CG2-CE2 4.19Å; V278-Y309 HydrophobicContact CG2-CG 3.59Å; L297-Y309 WeakPolarHBondContact CA-O 3.35Å; V298-Y309 HydrophobicContact CG1-CD1 4.04Å; V298-Y309 HydrophobicContact CG1-CG 4.47Å; V298-Y309 PolarHBondContact N-O 2.84Å; V298-Y309 PolarHBondContact O-N 3.31Å; Y309-K314 VanDerWaalsContact CE2-C 3.45Å; Y309-K314 WeakPolarHBondContact CE2-O 3.22Å; Y309-K314 VanDerWaalsContact CZ-C 3.47Å; Y309-K314 WeakPolarHBondContact OH-CA 3.35Å; Y309-K314 VanDerWaalsContact OH-CB 3.27Å; Y309-K314 WeakPolarHBondContact OH-CB 3.24Å; Y309-K314 PolarHBondContact OH-O 3.12Å; Y309-K314 VanDerWaalsContact OH-O 3.09Å; Y309-N315 VanDerWaalsContact CD2-O 3.26Å; Y309-N315 WeakPolarHBondContact CD2-O 3.5Å
310	D	97.3	Very high	96	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	105.6	170.5	177	3.8	0	0	0	108.5	L297 L312 Q313 K314 N315 V317 R448	L297-D310 HydrophobicContact CD2-CB 3.88Å; D310-L312 VanDerWaalsContact C-N 3.29Å; D310-L312 WeakPolarHBondContact OD1-CB 3.1Å; D310-L312 PolarHBondContact OD1-N 3.19Å; D310-Q313 PolarHBondContact OD1-N 2.87Å; D310-Q313 WeakPolarHBondContact OD2-CB 3.38Å; D310-K314 CarbonylContact O-C 3.57Å; D310-K314 WeakPolarHBondContact O-CA 3.36Å; D310-K314 PolarHBondContact O-N 2.81Å; D310-N315 WeakPolarHBondContact CB-O 3.49Å; D310-N315 PolarHBondContact N-O 3.19Å; D310-N315 PolarHBondContact O-N 3.48Å; D310-V317 HydrophobicContact CB-CG2 3.76Å; D310-R448 IonicContact OD1-CZ 2.87Å; D310-R448 IonicContact OD1-NH1 2.84Å; D310-R448 IonicContact OD1-NH2 3.15Å; D310-R448 PolarHBondContact OD1-NH2 3.33Å; D310-R448 IonicContact OD2-CZ 3.65Å; D310-R448 VanDerWaalsContact OD2-CZ 3.23Å; D310-R448 IonicContact OD2-NH1 3.09Å; D310-R448 PolarHBondContact OD2-NH1 3.39Å; D310-R448 IonicContact OD2-NH2 3.51Å; D310-R448 PolarHBondContact OD2-NH2 2.82Å
311	Y	95.8	Very high	95.8	Very high	7 Å²	7	23.7 Å²	23.7	3%	0.027	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-4.1	-177.6	64.7	-102.8	0	0	0	113.1	Y213 M225 F275 L291 S293 K296 L297 V298	Y213-Y311 HydrophobicContact CD2-CE2 4.31Å; Y213-Y311 HydrophobicContact CE1-CE2 4.44Å; Y213-Y311 HydrophobicContact CE2-CE2 4.26Å; Y213-Y311 HydrophobicContact CG-CE2 4.49Å; M225-Y311 HydrophobicContact CE-CD1 3.56Å; M225-Y311 HydrophobicContact CE-CD2 4.25Å; M225-Y311 HydrophobicContact CE-CE1 3.71Å; M225-Y311 HydrophobicContact CE-CE2 4.38Å; M225-Y311 HydrophobicContact CE-CG 3.83Å; M225-Y311 HydrophobicContact CG-CG 4.5Å; M225-Y311 HydrophobicContact SD-CD1 4.37Å; F275-Y311 HydrophobicContact CE2-CD2 4.19Å; F275-Y311 AromaticContact CZ-CD2 3.84Å; F275-Y311 HydrophobicContact CZ-CD2 3.84Å; F275-Y311 HydrophobicContact CZ-CE2 4.46Å; F275-Y311 HydrophobicContact CZ-CG 4.48Å; L291-Y311 HydrophobicContact CD1-CE1 3.61Å; S293-Y311 WeakPolarHBondContact CA-OH 3.04Å; K296-Y311 VanDerWaalsContact C-CD1 3.41Å; K296-Y311 VanDerWaalsContact CA-CE1 3.5Å; K296-Y311 HydrophobicContact CB-CD2 4.35Å; K296-Y311 HydrophobicContact CB-CE1 4.33Å; K296-Y311 HydrophobicContact CB-CE2 3.95Å; K296-Y311 HydrophobicContact CD-CE2 3.82Å; K296-Y311 HydrophobicContact CG-CE2 4.47Å; K296-Y311 WeakPolarHBondContact O-CD1 3.48Å; K296-Y311 WeakPolarHBondContact O-CE1 3.22Å; K296-Y311 PolarHBondContact O-N 2.87Å; K296-Y311 VanDerWaalsContact O-N 3.11Å; L297-Y311 VanDerWaalsContact N-CE1 3.31Å; V298-Y311 HydrophobicContact CB-CD1 4.38Å; V298-Y311 HydrophobicContact CG1-CD1 4.42Å
312	L	93.8	Very high	95.6	Very high	88 Å²	88	24.4 Å²	24.4	46%	0.461	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-54.3	170.2	-179.5	71.2	0	0	0	110.5	K296 D310 K314 R448	K296-L312 HydrophobicContact CB-CB 3.67Å; K296-L312 HydrophobicContact CG-CB 4.03Å; K296-L312 HydrophobicContact CG-CD2 4.29Å; D310-L312 VanDerWaalsContact C-N 3.29Å; D310-L312 WeakPolarHBondContact OD1-CB 3.1Å; D310-L312 PolarHBondContact OD1-N 3.19Å; L312-K314 VanDerWaalsContact C-N 3.28Å; L312-R448 HydrophobicContact CD2-CG 3.69Å
313	Q	93.3	Very high	95	Very high	36 Å²	36	25.1 Å²	25.1	17%	0.168	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.5	177	-65.9	-177.5	-0.4	0	0	113.4	D310 N315 R448 E451	D310-Q313 PolarHBondContact OD1-N 2.87Å; D310-Q313 WeakPolarHBondContact OD2-CB 3.38Å; Q313-N315 HydrophobicContact CB-CB 4.41Å; Q313-N315 PolarHBondContact O-N 2.72Å; Q313-N315 PolarHBondContact O-ND2 3.27Å; Q313-R448 PolarHBondContact NE2-O 2.77Å; Q313-E451 PolarHBondContact NE2-O 3.38Å
314	K	94.5	Very high	94.2	Very high	67 Å²	67	28.1 Å²	28.1	29%	0.291	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	34.7	-176.9	-56.3	-171.9	-173	-175.6	0	113.9	E238 Y309 D310 L312	E238-K314 WeakPolarHBondContact OE2-CD 3.28Å; E238-K314 WeakPolarHBondContact OE2-CE 3.44Å; E238-K314 IonicContact OE2-NZ 3.9Å; E238-K314 PolarHBondContact OE2-NZ 3.26Å; Y309-K314 VanDerWaalsContact CE2-C 3.45Å; Y309-K314 WeakPolarHBondContact CE2-O 3.22Å; Y309-K314 VanDerWaalsContact CZ-C 3.47Å; Y309-K314 WeakPolarHBondContact OH-CA 3.35Å; Y309-K314 VanDerWaalsContact OH-CB 3.27Å; Y309-K314 WeakPolarHBondContact OH-CB 3.24Å; Y309-K314 PolarHBondContact OH-O 3.12Å; Y309-K314 VanDerWaalsContact OH-O 3.09Å; D310-K314 CarbonylContact O-C 3.57Å; D310-K314 WeakPolarHBondContact O-CA 3.36Å; D310-K314 PolarHBondContact O-N 2.81Å; L312-K314 VanDerWaalsContact C-N 3.28Å
315	N	93.9	Very high	92.9	Very high	75 Å²	75	32.7 Å²	32.7	40%	0.401	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	149.2	-174.5	-79.4	-35.9	0	0	0	112.7	Y309 D310 Q313	Y309-N315 VanDerWaalsContact CD2-O 3.26Å; Y309-N315 WeakPolarHBondContact CD2-O 3.5Å; D310-N315 WeakPolarHBondContact CB-O 3.49Å; D310-N315 PolarHBondContact N-O 3.19Å; D310-N315 PolarHBondContact O-N 3.48Å; Q313-N315 HydrophobicContact CB-CB 4.41Å; Q313-N315 PolarHBondContact O-N 2.72Å; Q313-N315 PolarHBondContact O-ND2 3.27Å
316	N	94.7	Very high	91.3	Very high	52 Å²	52	36.3 Å²	36.3	28%	0.278	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.1	175.8	-173.3	14.9	0	0	0	109.9	V242 V308 L318 V319	V242-N316 HydrophobicContact CG2-CB 4.47Å; V308-N316 PolarHBondContact O-OD1 2.97Å; V308-N316 VanDerWaalsContact O-OD1 3.06Å; N316-L318 PolarHBondContact OD1-O 2.9Å; N316-V319 WeakPolarHBondContact ND2-CG2 3.2Å
317	V	96.4	Very high	89.5	Confident	27 Å²	27	36.5 Å²	36.5	16%	0.164	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-44.8	-175.6	172.4	0	0	0	0	111.1	L297 V308 D310 L453 A455	L297-V317 HydrophobicContact CD2-CG2 4.26Å; V308-V317 HydrophobicContact CB-CB 4.14Å; V308-V317 HydrophobicContact CB-CG1 4.49Å; V308-V317 HydrophobicContact CG1-CB 4.09Å; V308-V317 HydrophobicContact CG1-CG1 4.4Å; V308-V317 HydrophobicContact CG1-CG2 4.45Å; V308-V317 WeakPolarHBondContact O-CB 3.37Å; V308-V317 PolarHBondContact O-N 2.92Å; D310-V317 HydrophobicContact CB-CG2 3.76Å; V317-L453 HydrophobicContact CB-CD2 4.21Å; V317-L453 HydrophobicContact CG1-CD2 3.27Å; V317-L453 HydrophobicContact CG2-CB 4.25Å; V317-L453 HydrophobicContact CG2-CD2 3.88Å; V317-A455 HydrophobicContact CG1-CB 3.85Å
318	L	96.7	Very high	87.6	Confident	17 Å²	17	39.6 Å²	39.6	9%	0.089	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	136.4	-173	174.8	63.9	0	0	0	109.4	F306 G307 V308 N316 L426 Y438 A455	F306-L318 HydrophobicContact CE2-CD2 3.95Å; G307-L318 CarbonylContact C-O 3.6Å; G307-L318 WeakPolarHBondContact CA-O 3.13Å; V308-L318 HydrophobicContact CB-CB 4.03Å; V308-L318 HydrophobicContact CG2-CB 4.11Å; V308-L318 HydrophobicContact CG2-CD2 4.18Å; V308-L318 PolarHBondContact N-O 3.44Å; V308-L318 PolarHBondContact O-N 3.26Å; N316-L318 PolarHBondContact OD1-O 2.9Å; L318-L426 HydrophobicContact CD2-CD2 4.23Å; L318-Y438 HydrophobicContact CD1-CD1 3.89Å; L318-Y438 HydrophobicContact CD1-CE1 3.48Å; L318-Y438 VanDerWaalsContact CD1-CE1 3.48Å; L318-Y438 HydrophobicContact CD2-CD1 3.66Å; L318-Y438 HydrophobicContact CD2-CD2 3.94Å; L318-Y438 HydrophobicContact CD2-CE1 3.86Å; L318-Y438 HydrophobicContact CD2-CE2 4.14Å; L318-Y438 HydrophobicContact CD2-CG 3.71Å; L318-Y438 HydrophobicContact CG-CD1 4.45Å; L318-Y438 HydrophobicContact CG-CE1 4.34Å; L318-A455 HydrophobicContact CB-CB 4Å; L318-A455 HydrophobicContact CD1-CB 4.43Å; L318-A455 HydrophobicContact CD2-CB 4.37Å; L318-A455 HydrophobicContact CG-CB 4.49Å
319	V	96.8	Very high	85.3	Confident	30 Å²	30	46.5 Å²	46.5	18%	0.182	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.3	162.9	-176.5	0	0	0	0	109.3	V242 D243 L244 N316	V242-V319 HydrophobicContact CG1-CG2 3.68Å; D243-V319 WeakPolarHBondContact O-CG1 3.32Å; L244-V319 HydrophobicContact CD2-CG1 3.9Å; N316-V319 WeakPolarHBondContact ND2-CG2 3.2Å
320	K	95.9	Very high	83	Confident	67 Å²	67	48.8 Å²	48.8	29%	0.291	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	110.1	176.6	179.2	58.9	173.5	-177	0	110	G305 F306 T322 Y438	G305-K320 CarbonylContact C-O 3.54Å; G305-K320 WeakPolarHBondContact CA-O 3.42Å; F306-K320 HydrophobicContact CD1-CB 4.16Å; F306-K320 HydrophobicContact CD1-CG 4.34Å; F306-K320 HydrophobicContact CD2-CB 4.41Å; F306-K320 HydrophobicContact CE1-CB 3.68Å; F306-K320 HydrophobicContact CE1-CG 3.54Å; F306-K320 HydrophobicContact CE2-CB 3.96Å; F306-K320 HydrophobicContact CZ-CB 3.57Å; F306-K320 HydrophobicContact CZ-CG 3.64Å; F306-K320 PolarHBondContact N-O 2.91Å; F306-K320 PolarHBondContact O-N 2.88Å; K320-T322 HydrophobicContact CG-CG2 4.26Å; K320-Y438 WeakPolarHBondContact CD-OH 3.29Å
321	C	94.4	Very high	80.8	Confident	27 Å²	27	49.8 Å²	49.8	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	137.6	163.2	-173.5	0	0	0	0	109.7	L244	L244-C321 VanDerWaalsContact O-CB 3.27Å; L244-C321 WeakPolarHBondContact O-CB 3.35Å
322	T	92.8	Very high	78.4	Confident	14 Å²	14	55.9 Å²	55.9	9%	0.086	31%	0.305	C	S	.	.			trans	-123.8	3.2	-177.6	54	0	0	0	0	112.8	H304 G305 F306 K320 G404 V406 T430 F436	H304-T322 VanDerWaalsContact C-OG1 3.29Å; H304-T322 PolarHBondContact O-N 3.35Å; H304-T322 PolarHBondContact O-OG1 2.92Å; G305-T322 WeakPolarHBondContact CA-OG1 3.35Å; G305-T322 PolarHBondContact N-OG1 3.1Å; F306-T322 HydrophobicContact CD1-CG2 3.87Å; F306-T322 HydrophobicContact CE1-CG2 3.8Å; K320-T322 HydrophobicContact CG-CG2 4.26Å; T322-G404 WeakPolarHBondContact CB-O 3.15Å; T322-G404 WeakPolarHBondContact O-CA 3.43Å; T322-G404 PolarHBondContact OG1-O 2.84Å; T322-V406 HydrophobicContact CG2-CG2 4.43Å; T322-T430 HydrophobicContact CG2-CG2 4.46Å; T322-F436 HydrophobicContact CG2-CE2 3.95Å; T322-F436 HydrophobicContact CG2-CZ 4.47Å
323	L	85.8	Confident	76	Confident	15 Å²	15	53.5 Å²	53.5	8%	0.079	30%	0.302	C	S	.	.			trans	-70.3	140.2	175.4	-64.3	174.2	0	0	0	110.7	L245 H304 M331	L245-L323 HydrophobicContact CD2-CD1 3.51Å; H304-L323 HydrophobicContact CB-CD1 4.17Å; H304-L323 HydrophobicContact CB-CG 4.27Å; H304-L323 PolarHBondContact O-N 3.1Å; L323-M331 HydrophobicContact CD2-CE 4.14Å
324	N	74.9	Confident	73.3	Confident	66 Å²	66	54.9 Å²	54.9	35%	0.353	31%	0.314	S	S	.	.			trans	-78.2	147.2	162.8	-67.7	-37.3	0	0	0	109.6	S326 D327 T403	N324-S326 PolarHBondContact O-N 2.86Å; N324-S326 VanDerWaalsContact O-N 3.11Å; N324-D327 HydrophobicContact CB-CB 4.43Å; N324-D327 WeakPolarHBondContact O-CB 3.4Å; N324-D327 PolarHBondContact O-N 2.76Å; N324-T403 PolarHBondContact ND2-OG1 3.42Å
325	P	65.5	Low	71.1	Confident	97 Å²	97	54.1 Å²	54.1	63%	0.63	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-54.6	-30.3	174.4	-27	34.9	0	0	0	113.6
326	S	61.4	Low	68.6	Low	76 Å²	76	54.1 Å²	54.1	53%	0.531	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-70.7	-26.8	175	51.5	0	0	0	0	114	N324 Q328	N324-S326 PolarHBondContact O-N 2.86Å; N324-S326 VanDerWaalsContact O-N 3.11Å; S326-Q328 VanDerWaalsContact C-N 3.3Å; S326-Q328 PolarHBondContact O-N 3.49Å
327	D	61.4	Low	66	Low	5 Å²	5	61.2 Å²	61.2	3%	0.027	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-79.1	-13.9	-177.2	-72.1	-22.2	0	0	0	112.6	N324 L329 A330 M331 T403	N324-D327 HydrophobicContact CB-CB 4.43Å; N324-D327 WeakPolarHBondContact O-CB 3.4Å; N324-D327 PolarHBondContact O-N 2.76Å; D327-L329 PolarHBondContact O-N 3.45Å; D327-A330 PolarHBondContact O-N 3.02Å; D327-A330 VanDerWaalsContact O-N 3.07Å; D327-M331 WeakPolarHBondContact O-CG 3.21Å; D327-T403 PolarHBondContact OD2-OG1 3.07Å; D327-T403 VanDerWaalsContact OD2-OG1 3.12Å
328	Q	57.2	Low	63.1	Low	65 Å²	65	66 Å²	66	30%	0.304	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.3	176.6	-66.6	-175.5	-9.4	0	0	112.5	S326	S326-Q328 VanDerWaalsContact C-N 3.3Å; S326-Q328 PolarHBondContact O-N 3.49Å
329	L	50.3	Low	60.4	Low	145 Å²	145	72.7 Å²	72.7	76%	0.759	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-88.3	-17.7	178.5	-70	163.1	0	0	0	113.3	D327	D327-L329 PolarHBondContact O-N 3.45Å
330	A	49.3	Very low	57.5	Low	48 Å²	48	74.9 Å²	74.9	40%	0.397	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-13.4	-174.5	0	0	0	0	0	113.7	D327 E332	D327-A330 PolarHBondContact O-N 3.02Å; D327-A330 VanDerWaalsContact O-N 3.07Å; A330-E332 PolarHBondContact O-N 3.32Å
331	M	51.6	Low	55	Low	22 Å²	22	75.6 Å²	75.6	11%	0.108	42%	0.422	C	S	.	.			trans	-85.2	21.4	-176.6	-64.3	-75.7	167.7	0	0	113.4	L323 D327 G333 F402	L323-M331 HydrophobicContact CD2-CE 4.14Å; D327-M331 WeakPolarHBondContact O-CG 3.21Å; M331-G333 PolarHBondContact O-N 3.34Å; M331-F402 HydrophobicContact CE-CB 4.2Å; M331-F402 HydrophobicContact CE-CD1 3.22Å; M331-F402 HydrophobicContact CE-CD2 4.44Å; M331-F402 HydrophobicContact CE-CE1 3.57Å; M331-F402 HydrophobicContact CE-CG 3.71Å; M331-F402 HydrophobicContact CE-CZ 4.28Å; M331-F402 HydrophobicContact SD-CD1 3.49Å; M331-F402 WeakPolarHBondContact SD-CD1 3.24Å; M331-F402 HydrophobicContact SD-CE1 3.11Å; M331-F402 WeakPolarHBondContact SD-CE1 3.41Å; M331-F402 HydrophobicContact SD-CG 4.37Å; M331-F402 HydrophobicContact SD-CZ 3.74Å
332	E	46.3	Very low	52.5	Low	134 Å²	134	83.2 Å²	83.2	63%	0.626	45%	0.452	S	S	*	.			trans	-70.1	18.4	-176.8	-70.6	-155.4	127.2	0	0	115.8	K254 A330	K254-E332 IonicContact NZ-OE1 2.92Å; K254-E332 PolarHBondContact NZ-OE1 3.42Å; A330-E332 PolarHBondContact O-N 3.32Å
333	G	43.4	Very low	50.1	Low	38 Å²	38	90 Å²	90	39%	0.392	48%	0.48	S	S	.	.	S	Bend	trans	-142.9	144.1	177	0	0	0	0	0	112.6	M331 L335	M331-G333 PolarHBondContact O-N 3.34Å; G333-L335 PolarHBondContact O-N 3.16Å
334	P	36.9	Very low	47.8	Very low	66 Å²	66	92.5 Å²	92.5	43%	0.429	50%	0.499	S	S	.	.			trans	-54.6	127.5	171	-22.3	31.6	0	0	0	110.8	S336 R337	P334-S336 VanDerWaalsContact CB-OG 3.28Å; P334-S336 WeakPolarHBondContact CB-OG 3.5Å; P334-S336 PolarHBondContact O-N 3.48Å; P334-R337 PolarHBondContact O-N 3.38Å; P334-R337 VanDerWaalsContact O-N 3.16Å
335	L	47.1	Very low	46.2	Very low	50 Å²	50	94.2 Å²	94.2	26%	0.262	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-11.9	165.8	-86	136.3	0	0	0	112.5	S303 G333 R337 V338 F402 L405	S303-L335 VanDerWaalsContact OG-CD1 3.23Å; S303-L335 WeakPolarHBondContact OG-CD1 3.49Å; G333-L335 PolarHBondContact O-N 3.16Å; L335-R337 CarbonylContact O-C 3.57Å; L335-R337 PolarHBondContact O-N 3.42Å; L335-R337 VanDerWaalsContact O-N 3.1Å; L335-V338 PolarHBondContact O-N 2.78Å; L335-F402 HydrophobicContact CD1-CE1 4.01Å; L335-F402 HydrophobicContact CD2-CD1 4Å; L335-F402 HydrophobicContact CD2-CE1 3.65Å; L335-F402 HydrophobicContact CD2-CZ 4.44Å; L335-F402 HydrophobicContact CG-CE1 3.77Å; L335-F402 HydrophobicContact CG-CZ 4.49Å; L335-L405 HydrophobicContact CD2-CD1 4.21Å
336	S	41	Very low	45.3	Very low	76 Å²	76	99 Å²	99	53%	0.531	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-7.3	172.1	72.3	0	0	0	0	114	P334 V338	P334-S336 VanDerWaalsContact CB-OG 3.28Å; P334-S336 WeakPolarHBondContact CB-OG 3.5Å; P334-S336 PolarHBondContact O-N 3.48Å; S336-V338 PolarHBondContact O-N 3.46Å
337	R	39.8	Very low	44.2	Very low	201 Å²	201	102.8 Å²	102.8	76%	0.758	52%	0.522	S	S	*	.			trans	-84.7	52.5	152.3	-82.3	-171.2	-176.4	173.6	7.1	111.6	P334 L335 K339	P334-R337 PolarHBondContact O-N 3.38Å; P334-R337 VanDerWaalsContact O-N 3.16Å; L335-R337 CarbonylContact O-C 3.57Å; L335-R337 PolarHBondContact O-N 3.42Å; L335-R337 VanDerWaalsContact O-N 3.1Å; R337-K339 PolarHBondContact O-N 2.94Å
338	V	36.7	Very low	43	Very low	127 Å²	127	105.4 Å²	105.4	77%	0.77	54%	0.541	S	S	*	.	S	Bend	trans	-55	104.3	135.8	176.2	0	0	0	0	103.1	L335 S336 S340	L335-V338 PolarHBondContact O-N 2.78Å; S336-V338 PolarHBondContact O-N 3.46Å; V338-S340 PolarHBondContact O-N 3.26Å
339	K	39	Very low	42.4	Very low	158 Å²	158	109.5 Å²	109.5	69%	0.687	56%	0.558	S	S	*	*			trans	-44	112	-168.2	-69.2	170	-179.5	171.1	0	108.5	R337 I341	R337-K339 PolarHBondContact O-N 2.94Å; K339-I341 PolarHBondContact O-N 3.26Å
340	S	37.2	Very low	42.4	Very low	76 Å²	76	112.6 Å²	112.6	53%	0.531	56%	0.56	S	S	.	*			trans	-42.8	103.2	150.5	172.7	0	0	0	0	106.4	V338 K342 K343	V338-S340 PolarHBondContact O-N 3.26Å; S340-K342 PolarHBondContact O-N 3.21Å; S340-K343 PolarHBondContact O-N 3.09Å
341	I	43.5	Very low	42.1	Very low	82 Å²	82	121.1 Å²	121.1	42%	0.421	58%	0.582	S	S	.	*	H	α-helix	trans	-53	-25.7	-179.9	-79.4	162.7	0	0	0	109.9	K339 K343 L345 V588	K339-I341 PolarHBondContact O-N 3.26Å; I341-K343 VanDerWaalsContact C-N 3.33Å; I341-K343 PolarHBondContact O-N 3.23Å; I341-L345 HydrophobicContact CG2-CD1 4.33Å; I341-V588 HydrophobicContact CD1-CB 3.91Å; I341-V588 HydrophobicContact CD1-CG1 3.85Å
342	K	41.2	Very low	41.7	Very low	186 Å²	186	127 Å²	127	81%	0.809	61%	0.612	S	S	*	*	H	α-helix	trans	-61.2	-28.1	174.1	-76.1	-179.1	174	174.2	0	114.7	S340	S340-K342 PolarHBondContact O-N 3.21Å
343	K	41.8	Very low	41.5	Very low	157 Å²	157	131.7 Å²	131.7	68%	0.683	62%	0.624	S	S	*	*	H	α-helix	trans	-91.6	-31.3	-177.8	-119.8	177.2	-175.7	172.9	0	114.3	S340 I341 L345 R346	S340-K343 PolarHBondContact O-N 3.09Å; I341-K343 VanDerWaalsContact C-N 3.33Å; I341-K343 PolarHBondContact O-N 3.23Å; K343-L345 VanDerWaalsContact C-N 3.33Å; K343-L345 PolarHBondContact O-N 2.84Å; K343-R346 PolarHBondContact O-N 2.68Å
344	S	38.5	Very low	41.3	Very low	67 Å²	67	141.2 Å²	141.2	47%	0.469	65%	0.648	S	S	.	*	H	α-helix	trans	-67.5	-33	176.8	-179.1	0	0	0	0	112.4	R346 Q347 S348	S344-R346 PolarHBondContact O-N 3.24Å; S344-Q347 PolarHBondContact O-N 2.9Å; S344-S348 PolarHBondContact O-N 2.74Å
345	L	41.2	Very low	41	Very low	103 Å²	103	143.7 Å²	143.7	54%	0.539	67%	0.667	S	S	.	*	H	α-helix	trans	-60.8	-29.1	178.9	-121.9	113.4	0	0	0	113.1	I341 K343 S348 F349	I341-L345 HydrophobicContact CG2-CD1 4.33Å; K343-L345 VanDerWaalsContact C-N 3.33Å; K343-L345 PolarHBondContact O-N 2.84Å; L345-S348 PolarHBondContact O-OG 3.36Å; L345-F349 HydrophobicContact CD2-CE2 4.24Å; L345-F349 WeakPolarHBondContact O-CD2 3.26Å
346	R	46.3	Very low	40.4	Very low	198 Å²	198	153 Å²	153	75%	0.747	70%	0.698	S	S	*	*	H	α-helix	trans	-83.5	-13.6	-176.6	-139.7	175.8	-156	-97.3	1.7	114.1	K343 S344	K343-R346 PolarHBondContact O-N 2.68Å; S344-R346 PolarHBondContact O-N 3.24Å
347	Q	38.6	Very low	39.9	Very low	155 Å²	155	156.4 Å²	156.4	72%	0.724	72%	0.716	S	S	*	*	H	α-helix	trans	-100.8	-28.2	-179.5	-74.8	-163.6	-11.9	0	0	114	S344 F349 R350	S344-Q347 PolarHBondContact O-N 2.9Å; Q347-F349 PolarHBondContact O-N 3.08Å; Q347-R350 PolarHBondContact O-N 3.17Å
348	S	35.6	Very low	39.4	Very low	59 Å²	59	152 Å²	152	41%	0.413	72%	0.715	S	S	.	*	H	α-helix	trans	-66.7	-33.8	-179.7	52.4	0	0	0	0	113.2	S344 L345 R350 R351	S344-S348 PolarHBondContact O-N 2.74Å; L345-S348 PolarHBondContact O-OG 3.36Å; S348-R350 VanDerWaalsContact C-N 3.28Å; S348-R350 PolarHBondContact O-N 3.36Å; S348-R351 PolarHBondContact O-N 3.05Å
349	F	44.7	Very low	39.1	Very low	151 Å²	151	154.3 Å²	154.3	66%	0.662	72%	0.723	S	S	*	*	H	α-helix	trans	-70.6	-15.3	179.2	-70.4	-70.7	0	0	0	115	L345 Q347	L345-F349 HydrophobicContact CD2-CE2 4.24Å; L345-F349 WeakPolarHBondContact O-CD2 3.26Å; Q347-F349 PolarHBondContact O-N 3.08Å
350	R	50	Low	38.6	Very low	211 Å²	211	158.2 Å²	158.2	80%	0.796	73%	0.733	S	S	*	*	H	α-helix	trans	-92.5	-12.5	179.1	-73.6	-175	178.8	-178.8	-1.5	114.4	Q347 S348	Q347-R350 PolarHBondContact O-N 3.17Å; S348-R350 VanDerWaalsContact C-N 3.28Å; S348-R350 PolarHBondContact O-N 3.36Å
351	R	43.6	Very low	38.4	Very low	227 Å²	227	164.1 Å²	164.1	86%	0.857	75%	0.749	S	S	*	*	H	α-helix	trans	-97.1	-10.4	-178.2	-149.7	178	-92.5	177.3	-6.6	113.8	S348	S348-R351 PolarHBondContact O-N 3.05Å
352	I	42.4	Very low	37.7	Very low	144 Å²	144	169.5 Å²	169.5	74%	0.738	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-3.9	-177.9	-68.2	172	0	0	0	113.5
353	R	42.5	Very low	37.3	Very low	233 Å²	233	168.7 Å²	168.7	88%	0.879	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	15.8	-175.3	-104.1	-175.5	179.6	-179.9	0.8	117.2
354	R	38.6	Very low	36.9	Very low	239 Å²	239	169.1 Å²	169.1	90%	0.902	78%	0.779	S	S	*	*	S	Bend	trans	-148.3	81.1	173.6	-70.7	-172.3	179.2	156.1	-1.3	113.4
355	S	31	Very low	36.9	Very low	118 Å²	118	169.9 Å²	169.9	83%	0.825	79%	0.785	S	S	*	*			trans	-169	72.3	149.4	57.2	0	0	0	0	112.4
356	R	34.7	Very low	36.8	Very low	244 Å²	244	171 Å²	171	92%	0.921	79%	0.791	S	S	*	*			trans	-139.4	116.2	152.4	-76.7	-171.4	177.9	175	-1.4	107.4
357	V	30.3	Very low	37.1	Very low	148 Å²	148	166.5 Å²	166.5	90%	0.897	79%	0.785	S	S	*	*			trans	159.8	111.9	143.6	170.9	0	0	0	0	107.4
358	S	30.2	Very low	38	Very low	108 Å²	108	165.6 Å²	165.6	76%	0.755	79%	0.786	S	S	*	*				175.9	108.7	124.6	-170	0	0	0	0	109.3
359	L	29.3	Very low	38.7	Very low	176 Å²	176	171.6 Å²	171.6	92%	0.921	80%	0.804	S	S	*	*			trans	-100.4	127.7	167.7	-92.5	143.4	0	0	0	107.5
360	R	30.1	Very low	39.2	Very low	241 Å²	241	168.5 Å²	168.5	91%	0.909	79%	0.794	S	S	*	*			trans	-134.9	130.4	157.8	-81.4	-169.8	176.7	179.2	-0.9	110.7
361	K	31.5	Very low	39.3	Very low	199 Å²	199	165.1 Å²	165.1	87%	0.865	79%	0.787	S	S	*	*			trans	-74.3	150.2	177.6	-80.6	176.1	168.6	178.4	0	111.7
362	H	29.8	Very low	39.8	Very low	195 Å²	195	161.8 Å²	161.8	90%	0.903	78%	0.781	S	S	*	*			trans	-146.6	138.6	141	-116.2	-76.6	0	0	0	111
363	H	32.8	Very low	40.4	Very low	170 Å²	170	157.2 Å²	157.2	79%	0.787	77%	0.765	S	S	*	*			trans	-93.7	152.9	179.8	-125.5	-79	0	0	0	110.1
364	I	33.5	Very low	41.1	Very low	165 Å²	165	149.7 Å²	149.7	85%	0.846	74%	0.742	S	S	*	*				-178.8	131.8	123.2	-85.9	151.1	0	0	0	112
365	S	37.5	Very low	42.2	Very low	84 Å²	84	140.9 Å²	140.9	59%	0.587	72%	0.721	S	S	*	*			trans	-9.4	132.1	161.6	178.5	0	0	0	0	122.8
366	N	39.9	Very low	43.7	Very low	126 Å²	126	144.8 Å²	144.8	67%	0.674	72%	0.717	S	S	*	*				-168.3	98.6	124.7	-104.1	-16.8	0	0	0	112	I370	N366-I370 WeakPolarHBondContact O-CD1 3.49Å; N366-I370 VanDerWaalsContact O-CG1 3.31Å; N366-I370 WeakPolarHBondContact O-CG1 3.26Å
367	T	52.8	Low	44.9	Very low	103 Å²	103	137.3 Å²	137.3	63%	0.632	70%	0.695	S	S	*	*	H	α-helix	trans	-80.1	-15.8	-160.9	30.2	0	0	0	0	117.4
368	N	57	Low	46.3	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	68%	0.68	S	S	*	*	H	α-helix	trans	-100.6	-12.9	-170.5	-66.8	-4.7	0	0	0	115.5
369	K	49.7	Very low	47.7	Very low	186 Å²	186	133.9 Å²	133.9	81%	0.809	67%	0.667	S	S	*	*	H	α-helix	trans	-94.3	-19.1	168.8	-74.4	-174.8	177.2	-178.7	0	113.1
370	I	55.3	Low	48.9	Very low	85 Å²	85	131.3 Å²	131.3	44%	0.436	65%	0.651	S	S	.	*	H	α-helix	trans	-72	-33.2	178.3	-69.2	174.5	0	0	0	110.6	N366 A373 N374	N366-I370 WeakPolarHBondContact O-CD1 3.49Å; N366-I370 VanDerWaalsContact O-CG1 3.31Å; N366-I370 WeakPolarHBondContact O-CG1 3.26Å; I370-A373 PolarHBondContact O-N 3.18Å; I370-N374 VanDerWaalsContact CG2-ND2 3.26Å; I370-N374 WeakPolarHBondContact CG2-ND2 3.14Å; I370-N374 WeakPolarHBondContact O-CB 3.23Å; I370-N374 PolarHBondContact O-N 2.88Å; I370-N374 PolarHBondContact O-OD1 3.42Å
371	Q	52.5	Low	49.8	Very low	140 Å²	140	124.6 Å²	124.6	65%	0.654	63%	0.629	S	S	*	*	H	α-helix	trans	-73.4	-35.2	-172.4	-146.5	155.8	-0.2	0	0	113.3	A375	Q371-A375 WeakPolarHBondContact O-CB 3.25Å; Q371-A375 PolarHBondContact O-N 2.51Å; Q371-A375 VanDerWaalsContact O-N 3.07Å
372	E	53.7	Low	50.7	Low	158 Å²	158	117.4 Å²	117.4	74%	0.738	61%	0.607	S	S	*	*	H	α-helix	trans	-75.5	-35.1	173.6	-119.9	178.9	174.8	0	0	112.5	R376	E372-R376 PolarHBondContact O-N 2.82Å
373	A	55.2	Low	51.7	Low	47 Å²	47	115.2 Å²	115.2	39%	0.388	60%	0.597	S	S	.	*	H	α-helix	trans	-69.5	-38.9	173	0	0	0	0	0	111.6	I370 R376 L377	I370-A373 PolarHBondContact O-N 3.18Å; A373-R376 PolarHBondContact O-N 3.33Å; A373-L377 WeakPolarHBondContact O-CB 3.11Å; A373-L377 PolarHBondContact O-N 2.7Å
374	N	57.4	Low	52.3	Low	75 Å²	75	113.6 Å²	113.6	40%	0.401	59%	0.592	S	S	.	*	H	α-helix	trans	-67.8	-37.9	176.4	-74.4	-0.1	0	0	0	111.8	I370 R376 L377 E378	I370-N374 VanDerWaalsContact CG2-ND2 3.26Å; I370-N374 WeakPolarHBondContact CG2-ND2 3.14Å; I370-N374 WeakPolarHBondContact O-CB 3.23Å; I370-N374 PolarHBondContact O-N 2.88Å; I370-N374 PolarHBondContact O-OD1 3.42Å; N374-R376 VanDerWaalsContact C-N 3.35Å; N374-R376 PolarHBondContact O-N 3.39Å; N374-L377 CarbonylContact O-C 3.49Å; N374-L377 PolarHBondContact O-N 3.06Å; N374-E378 VanDerWaalsContact O-CB 3.24Å; N374-E378 WeakPolarHBondContact O-CB 3.39Å; N374-E378 VanDerWaalsContact O-CG 3.29Å; N374-E378 WeakPolarHBondContact O-CG 3.36Å; N374-E378 PolarHBondContact O-N 3.45Å
375	A	61.6	Low	53	Low	55 Å²	55	113.5 Å²	113.5	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-67.6	-34.1	176	0	0	0	0	0	112.6	Q371 A379	Q371-A375 WeakPolarHBondContact O-CB 3.25Å; Q371-A375 PolarHBondContact O-N 2.51Å; Q371-A375 VanDerWaalsContact O-N 3.07Å; A375-A379 WeakPolarHBondContact O-CB 3.2Å; A375-A379 PolarHBondContact O-N 3.02Å
376	R	62.8	Low	53.4	Low	199 Å²	199	117.7 Å²	117.7	75%	0.751	60%	0.6	S	S	*	*	H	α-helix	trans	-71.8	-40.2	170.8	-80.6	-175.5	176.8	176.8	0.4	112.4	E372 A373 N374 E378 A379 E380	E372-R376 PolarHBondContact O-N 2.82Å; A373-R376 PolarHBondContact O-N 3.33Å; N374-R376 VanDerWaalsContact C-N 3.35Å; N374-R376 PolarHBondContact O-N 3.39Å; R376-E378 VanDerWaalsContact C-N 3.33Å; R376-A379 PolarHBondContact O-N 3.45Å; R376-E380 WeakPolarHBondContact O-CB 3.37Å; R376-E380 PolarHBondContact O-N 3.21Å
377	L	59	Low	53.6	Low	87 Å²	87	114 Å²	114	46%	0.455	59%	0.587	S	S	.	*	H	α-helix	trans	-66.2	-33.4	173.3	-102.6	134	0	0	0	112.2	A373 N374 Q381	A373-L377 WeakPolarHBondContact O-CB 3.11Å; A373-L377 PolarHBondContact O-N 2.7Å; N374-L377 CarbonylContact O-C 3.49Å; N374-L377 PolarHBondContact O-N 3.06Å; L377-Q381 WeakPolarHBondContact O-CA 3.11Å; L377-Q381 WeakPolarHBondContact O-CB 3.44Å; L377-Q381 WeakPolarHBondContact O-CG 3.5Å; L377-Q381 PolarHBondContact O-N 3.38Å; L377-Q381 PolarHBondContact O-OE1 2.83Å
378	E	60.3	Low	53.3	Low	127 Å²	127	114.5 Å²	114.5	59%	0.593	59%	0.592	S	S	*	*	H	α-helix	trans	-73.2	-35.2	174.9	-82	175.2	178.5	0	0	111.1	N374 R376 A382	N374-E378 VanDerWaalsContact O-CB 3.24Å; N374-E378 WeakPolarHBondContact O-CB 3.39Å; N374-E378 VanDerWaalsContact O-CG 3.29Å; N374-E378 WeakPolarHBondContact O-CG 3.36Å; N374-E378 PolarHBondContact O-N 3.45Å; R376-E378 VanDerWaalsContact C-N 3.33Å; E378-A382 WeakPolarHBondContact O-CB 3.45Å; E378-A382 PolarHBondContact O-N 3.34Å
379	A	59.6	Low	53	Low	58 Å²	58	113.9 Å²	113.9	48%	0.479	59%	0.593	S	S	.	*	H	α-helix	trans	-70.4	-42.5	171.6	0	0	0	0	0	112.2	A375 R376 A382 E383	A375-A379 WeakPolarHBondContact O-CB 3.2Å; A375-A379 PolarHBondContact O-N 3.02Å; R376-A379 PolarHBondContact O-N 3.45Å; A379-A382 PolarHBondContact O-N 2.88Å; A379-E383 PolarHBondContact O-N 2.81Å
380	E	55.7	Low	53.3	Low	122 Å²	122	110.9 Å²	110.9	57%	0.57	58%	0.582	S	S	*	*	H	α-helix	trans	-68.2	-33.7	171.7	-82	-175.7	153.6	0	0	112.1	R376 M384	R376-E380 WeakPolarHBondContact O-CB 3.37Å; R376-E380 PolarHBondContact O-N 3.21Å; E380-M384 VanDerWaalsContact O-CB 3.23Å; E380-M384 WeakPolarHBondContact O-CB 3.28Å; E380-M384 WeakPolarHBondContact O-CG 3.35Å; E380-M384 PolarHBondContact O-N 2.8Å
381	Q	48.1	Very low	54	Low	100 Å²	100	114.9 Å²	114.9	47%	0.467	59%	0.591	S	S	.	*	H	α-helix	trans	-71	-38	172.9	-86.1	175.6	-51.5	0	0	111	L377 M384 E385	L377-Q381 WeakPolarHBondContact O-CA 3.11Å; L377-Q381 WeakPolarHBondContact O-CB 3.44Å; L377-Q381 WeakPolarHBondContact O-CG 3.5Å; L377-Q381 PolarHBondContact O-N 3.38Å; L377-Q381 PolarHBondContact O-OE1 2.83Å; Q381-M384 CarbonylContact O-C 3.58Å; Q381-M384 PolarHBondContact O-N 2.83Å; Q381-E385 WeakPolarHBondContact O-CA 3.09Å; Q381-E385 WeakPolarHBondContact O-CB 3.44Å; Q381-E385 VanDerWaalsContact O-CG 3.24Å; Q381-E385 WeakPolarHBondContact O-CG 3.21Å; Q381-E385 PolarHBondContact O-N 3.34Å
382	A	51.4	Low	54.6	Low	48 Å²	48	117 Å²	117	40%	0.397	60%	0.598	S	S	.	*	H	α-helix	trans	-66.5	-38.1	173.5	0	0	0	0	0	111.3	E378 A379 M386	E378-A382 WeakPolarHBondContact O-CB 3.45Å; E378-A382 PolarHBondContact O-N 3.34Å; A379-A382 PolarHBondContact O-N 2.88Å; A382-M386 WeakPolarHBondContact O-CB 3.34Å; A382-M386 WeakPolarHBondContact O-CG 3.13Å; A382-M386 PolarHBondContact O-N 2.92Å; A382-M386 VanDerWaalsContact O-N 3.14Å
383	E	49.3	Very low	55.4	Low	148 Å²	148	110.9 Å²	110.9	69%	0.692	57%	0.571	S	S	*	*	H	α-helix	trans	-68.9	-37.1	170.2	-81.5	-170.5	152.8	0	0	112.8	A379 M386 A387	A379-E383 PolarHBondContact O-N 2.81Å; E383-M386 PolarHBondContact O-N 3.14Å; E383-A387 PolarHBondContact O-N 3.44Å; E383-A387 VanDerWaalsContact O-N 3.09Å
384	M	46.8	Very low	56.2	Low	136 Å²	136	115.8 Å²	115.8	67%	0.67	59%	0.586	S	S	*	*	H	α-helix	trans	-72.5	-28.4	174	-90.7	178.7	54.2	0	0	113.7	E380 Q381 M386	E380-M384 VanDerWaalsContact O-CB 3.23Å; E380-M384 WeakPolarHBondContact O-CB 3.28Å; E380-M384 WeakPolarHBondContact O-CG 3.35Å; E380-M384 PolarHBondContact O-N 2.8Å; Q381-M384 CarbonylContact O-C 3.58Å; Q381-M384 PolarHBondContact O-N 2.83Å; M384-M386 VanDerWaalsContact C-N 3.33Å
385	E	48.2	Very low	56.7	Low	164 Å²	164	115.2 Å²	115.2	77%	0.766	59%	0.591	S	S	*	*	H	α-helix	trans	-76.5	-25.3	174.2	-81.6	-176.8	164.9	0	0	111.1	Q381	Q381-E385 WeakPolarHBondContact O-CA 3.09Å; Q381-E385 WeakPolarHBondContact O-CB 3.44Å; Q381-E385 VanDerWaalsContact O-CG 3.24Å; Q381-E385 WeakPolarHBondContact O-CG 3.21Å; Q381-E385 PolarHBondContact O-N 3.34Å
386	M	44.3	Very low	57.5	Low	171 Å²	171	115.2 Å²	115.2	84%	0.842	58%	0.58	S	S	*	*	H	α-helix	trans	-86.6	-20.4	175.2	-69.1	-104.8	-74.7	0	0	113.2	A382 E383 M384	A382-M386 WeakPolarHBondContact O-CB 3.34Å; A382-M386 WeakPolarHBondContact O-CG 3.13Å; A382-M386 PolarHBondContact O-N 2.92Å; A382-M386 VanDerWaalsContact O-N 3.14Å; E383-M386 PolarHBondContact O-N 3.14Å; M384-M386 VanDerWaalsContact C-N 3.33Å
387	A	44	Very low	57.7	Low	50 Å²	50	108.8 Å²	108.8	41%	0.413	57%	0.565	S	S	.	*	S	Bend	trans	-90.5	132.5	172.8	0	0	0	0	0	110.7	E383 V389	E383-A387 PolarHBondContact O-N 3.44Å; E383-A387 VanDerWaalsContact O-N 3.09Å; A387-V389 PolarHBondContact O-N 2.85Å
388	P	46.8	Very low	57.8	Low	112 Å²	112	107.4 Å²	107.4	73%	0.727	56%	0.562	S	S	*	*			trans	-57.5	120.3	177	21.8	-30.6	0	0	0	110	Q390	P388-Q390 PolarHBondContact O-N 2.91Å
389	V	51.2	Low	57.9	Low	124 Å²	124	107.7 Å²	107.7	75%	0.752	57%	0.568	S	S	*	*			trans	-61.7	91.4	-176.1	179.9	0	0	0	0	110.3	A387	A387-V389 PolarHBondContact O-N 2.85Å
390	Q	56.5	Low	58.1	Low	122 Å²	122	108.4 Å²	108.4	57%	0.57	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-81.5	121.8	174	-71.9	-174.2	4.9	0	0	110	P388 A530	P388-Q390 PolarHBondContact O-N 2.91Å; Q390-A530 WeakPolarHBondContact CA-O 3.44Å; Q390-A530 HydrophobicContact CB-CB 4.44Å
391	R	68.6	Low	58.5	Low	169 Å²	169	105.3 Å²	105.3	64%	0.638	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.2	140.6	174.8	-65.1	179.7	-177.9	159.8	3	110.7	I393 A530	R391-I393 PolarHBondContact O-N 2.76Å; R391-A530 PolarHBondContact N-O 3.06Å; R391-A530 WeakPolarHBondContact O-CB 3.12Å
392	K	66.3	Low	59.8	Low	184 Å²	184	102.9 Å²	102.9	80%	0.8	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-66.6	126.9	172.6	-167	177.8	-179.8	-176	0	109.2
393	I	71.3	Confident	61.4	Low	30 Å²	30	101.6 Å²	101.6	15%	0.154	53%	0.531	C	S	.	.			trans	-88.5	111.1	171.1	-63.3	172.7	0	0	0	107.2	R391 H465 E510 Q511 K527 A530	R391-I393 PolarHBondContact O-N 2.76Å; I393-H465 HydrophobicContact CG2-CB 3.9Å; I393-E510 WeakPolarHBondContact CG2-OE2 3.36Å; I393-Q511 HydrophobicContact CD1-CG 3.96Å; I393-K527 HydrophobicContact CD1-CB 3.81Å; I393-K527 HydrophobicContact CD1-CD 4.27Å; I393-K527 HydrophobicContact CD1-CG 4.15Å; I393-A530 HydrophobicContact CD1-CB 3.88Å; I393-A530 HydrophobicContact CG1-CB 3.99Å
394	E	70.7	Confident	63.2	Low	151 Å²	151	94.7 Å²	94.7	71%	0.706	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-82.2	144.4	175.2	-65	-176.2	167	0	0	110.4
395	A	68.9	Low	65.5	Low	63 Å²	63	89.2 Å²	89.2	52%	0.521	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-69.4	138.6	176.4	0	0	0	0	0	110.2	M464	A395-M464 WeakPolarHBondContact CB-O 3.39Å
396	R	78.7	Confident	67.8	Low	55 Å²	55	81.4 Å²	81.4	21%	0.208	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-66.6	148.7	171.6	-58.5	-171.4	-175	-174.9	6.3	110.9	H465 R466 P468 E509 E510	R396-H465 PolarHBondContact N-O 3.21Å; R396-R466 HydrophobicContact CB-CB 4.22Å; R396-R466 VanDerWaalsContact O-CD 3.28Å; R396-R466 WeakPolarHBondContact O-CD 3.31Å; R396-P468 VanDerWaalsContact CZ-CD 3.41Å; R396-E509 IonicContact CZ-OE2 2.76Å; R396-E509 IonicContact NH1-OE2 3.68Å; R396-E509 IonicContact NH2-OE2 3.23Å; R396-E509 PolarHBondContact NH2-OE2 3.33Å; R396-E510 IonicContact CZ-OE1 2.75Å; R396-E510 IonicContact NE-OE1 3.66Å; R396-E510 PolarHBondContact NE-OE1 3.33Å; R396-E510 IonicContact NH2-OE1 3.92Å; R396-E510 PolarHBondContact NH2-OE1 3.38Å
397	S	66	Low	70.3	Confident	63 Å²	63	76.9 Å²	76.9	44%	0.441	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-61.5	144.6	177.3	35.6	0	0	0	0	111.1	D399 D400	S397-D399 PolarHBondContact O-N 3.08Å; S397-D400 PolarHBondContact OG-OD1 2.86Å
398	S	62.3	Low	72.9	Confident	58 Å²	58	75.5 Å²	75.5	41%	0.406	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.3	169.8	35.1	0	0	0	0	112.9	D400 R466	S398-D400 VanDerWaalsContact C-N 3.27Å; S398-D400 PolarHBondContact O-N 2.94Å; S398-R466 VanDerWaalsContact CB-NH1 3.34Å
399	D	60.7	Low	75.4	Confident	134 Å²	134	70.8 Å²	70.8	72%	0.717	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	4.6	-175.7	-49.5	-19.3	0	0	0	112.3	S397 S401	S397-D399 PolarHBondContact O-N 3.08Å; D399-S401 PolarHBondContact O-N 3.27Å
400	D	64.5	Low	77.6	Confident	73 Å²	73	67.1 Å²	67.1	39%	0.39	34%	0.338	S	S	.	.			trans	-63.7	127.9	170.6	-91	2.8	0	0	0	109	S397 S398 T403	S397-D400 PolarHBondContact OG-OD1 2.86Å; S398-D400 VanDerWaalsContact C-N 3.27Å; S398-D400 PolarHBondContact O-N 2.94Å; D400-T403 HydrophobicContact CB-CG2 4.33Å; D400-T403 VanDerWaalsContact O-CG2 3.29Å; D400-T403 WeakPolarHBondContact O-CG2 3.5Å
401	S	64.3	Low	79.6	Confident	56 Å²	56	62 Å²	62	39%	0.392	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	148.8	173.4	54	0	0	0	0	110.4	D399	D399-S401 PolarHBondContact O-N 3.27Å
402	F	74.9	Confident	81	Confident	49 Å²	49	54.1 Å²	54.1	22%	0.215	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	28.6	178.2	-48.3	-92.8	0	0	0	115.1	M331 L335 G404 L405 N431	M331-F402 HydrophobicContact CE-CB 4.2Å; M331-F402 HydrophobicContact CE-CD1 3.22Å; M331-F402 HydrophobicContact CE-CD2 4.44Å; M331-F402 HydrophobicContact CE-CE1 3.57Å; M331-F402 HydrophobicContact CE-CG 3.71Å; M331-F402 HydrophobicContact CE-CZ 4.28Å; M331-F402 HydrophobicContact SD-CD1 3.49Å; M331-F402 WeakPolarHBondContact SD-CD1 3.24Å; M331-F402 HydrophobicContact SD-CE1 3.11Å; M331-F402 WeakPolarHBondContact SD-CE1 3.41Å; M331-F402 HydrophobicContact SD-CG 4.37Å; M331-F402 HydrophobicContact SD-CZ 3.74Å; L335-F402 HydrophobicContact CD1-CE1 4.01Å; L335-F402 HydrophobicContact CD2-CD1 4Å; L335-F402 HydrophobicContact CD2-CE1 3.65Å; L335-F402 HydrophobicContact CD2-CZ 4.44Å; L335-F402 HydrophobicContact CG-CE1 3.77Å; L335-F402 HydrophobicContact CG-CZ 4.49Å; F402-G404 PolarHBondContact O-N 3.07Å; F402-L405 HydrophobicContact CB-CB 4.26Å; F402-L405 WeakPolarHBondContact O-CB 3.47Å; F402-L405 PolarHBondContact O-N 3.1Å; F402-N431 VanDerWaalsContact O-CB 3.29Å; F402-N431 WeakPolarHBondContact O-CB 3.29Å; F402-N431 PolarHBondContact O-ND2 3.41Å; F402-N431 VanDerWaalsContact O-ND2 3.1Å
403	T	84.8	Confident	82.4	Confident	21 Å²	21	48.3 Å²	48.3	13%	0.129	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.6	172.4	51.1	0	0	0	0	112.4	N324 D327 D400 L405 N431 G432	N324-T403 PolarHBondContact ND2-OG1 3.42Å; D327-T403 PolarHBondContact OD2-OG1 3.07Å; D327-T403 VanDerWaalsContact OD2-OG1 3.12Å; D400-T403 HydrophobicContact CB-CG2 4.33Å; D400-T403 VanDerWaalsContact O-CG2 3.29Å; D400-T403 WeakPolarHBondContact O-CG2 3.5Å; T403-L405 VanDerWaalsContact C-N 3.3Å; T403-L405 PolarHBondContact O-N 3.43Å; T403-N431 PolarHBondContact O-N 3.26Å; T403-G432 PolarHBondContact O-N 3.27Å
404	G	87.8	Confident	83.5	Confident	4 Å²	4	46.9 Å²	46.9	4%	0.041	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.7	175.9	0	0	0	0	0	115.8	T322 F402 V406	T322-G404 WeakPolarHBondContact CB-O 3.15Å; T322-G404 WeakPolarHBondContact O-CA 3.43Å; T322-G404 PolarHBondContact OG1-O 2.84Å; F402-G404 PolarHBondContact O-N 3.07Å; G404-V406 PolarHBondContact O-N 3.42Å
405	L	94	Very high	84.7	Confident	20 Å²	20	40.1 Å²	40.1	11%	0.105	22%	0.224	C	C	.	.			trans	-57.8	124.8	-170.8	179.3	145.1	0	0	0	112.5	T287 L335 F402 T403 R407 T430 N431	T287-L405 HydrophobicContact CG2-CD1 4.23Å; T287-L405 HydrophobicContact CG2-CG 4.34Å; L335-L405 HydrophobicContact CD2-CD1 4.21Å; F402-L405 HydrophobicContact CB-CB 4.26Å; F402-L405 WeakPolarHBondContact O-CB 3.47Å; F402-L405 PolarHBondContact O-N 3.1Å; T403-L405 VanDerWaalsContact C-N 3.3Å; T403-L405 PolarHBondContact O-N 3.43Å; L405-R407 HydrophobicContact CD2-CG 3.87Å; L405-T430 CarbonylContact O-C 3.52Å; L405-T430 WeakPolarHBondContact O-CA 3.44Å; L405-N431 HydrophobicContact CB-CB 4Å; L405-N431 HydrophobicContact CD2-CB 4.22Å; L405-N431 WeakPolarHBondContact O-CB 3.45Å; L405-N431 PolarHBondContact O-N 3.39Å
406	V	97.9	Very high	85.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	120.3	-174.4	-177	0	0	0	0	110.1	T287 A288 T302 F306 T322 G404 L409	T287-V406 VanDerWaalsContact CB-O 3.22Å; T287-V406 WeakPolarHBondContact CB-O 3.36Å; T287-V406 PolarHBondContact OG1-O 3.32Å; A288-V406 HydrophobicContact CB-CG1 4.14Å; T302-V406 PolarHBondContact O-N 2.9Å; F306-V406 HydrophobicContact CB-CG1 4.23Å; F306-V406 HydrophobicContact CB-CG2 4.06Å; F306-V406 HydrophobicContact CD1-CG2 3.86Å; F306-V406 HydrophobicContact CG-CG2 4.43Å; T322-V406 HydrophobicContact CG2-CG2 4.43Å; G404-V406 PolarHBondContact O-N 3.42Å; V406-L409 HydrophobicContact CG1-CD2 4.1Å; V406-L409 HydrophobicContact CG1-CG 4.22Å
407	R	96.8	Very high	86.3	Confident	76 Å²	76	38.1 Å²	38.1	29%	0.287	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-34.3	-172.5	-67.2	-66.4	-65.8	-94.4	-2.7	113.5	L405 G429 N431 V469	L405-R407 HydrophobicContact CD2-CG 3.87Å; R407-G429 PolarHBondContact N-O 2.9Å; R407-N431 HydrophobicContact CG-CB 4.28Å; R407-N431 PolarHBondContact NH1-OD1 2.84Å; R407-N431 VanDerWaalsContact NH1-OD1 3.12Å; R407-V469 WeakPolarHBondContact CB-O 3.49Å
408	T	97.9	Very high	87.4	Confident	21 Å²	21	37.8 Å²	37.8	13%	0.129	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	138.3	-173.4	-52.6	0	0	0	0	109.7	A428 G429 V470 I472	T408-A428 WeakPolarHBondContact O-CA 3.14Å; T408-G429 PolarHBondContact N-O 3.01Å; T408-G429 PolarHBondContact O-N 3.1Å; T408-V470 PolarHBondContact OG1-O 3.15Å; T408-V470 VanDerWaalsContact OG1-O 3.09Å; T408-I472 HydrophobicContact CG2-CG1 4.38Å
409	L	98.7	Very high	88.6	Confident	14 Å²	14	39.7 Å²	39.7	7%	0.073	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.8	170.1	-67.2	167.2	0	0	0	107.6	A288 A299 F300 F306 V406 W427 A428	A288-L409 HydrophobicContact CB-CD1 3.82Å; A288-L409 HydrophobicContact CB-CG 3.87Å; A299-L409 HydrophobicContact CB-CB 4.49Å; A299-L409 HydrophobicContact CB-CD1 3.99Å; F300-L409 VanDerWaalsContact C-CD1 3.43Å; F306-L409 HydrophobicContact CB-CD2 4.26Å; F306-L409 HydrophobicContact CD2-CD2 4.33Å; F306-L409 HydrophobicContact CG-CD2 4.37Å; V406-L409 HydrophobicContact CG1-CD2 4.1Å; V406-L409 HydrophobicContact CG1-CG 4.22Å; L409-W427 CarbonylContact C-O 3.58Å; L409-W427 WeakPolarHBondContact CA-O 3.41Å; L409-A428 HydrophobicContact CD2-CB 3.61Å
410	Y	98.5	Very high	89.8	Confident	47 Å²	47	37 Å²	37	18%	0.184	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	122.7	-178	-177.9	-106.7	0	0	0	109.9	A412 W427 I472 V474	Y410-A412 HydrophobicContact CD1-CB 4.12Å; Y410-A412 HydrophobicContact CE1-CB 3.74Å; Y410-W427 PolarHBondContact N-O 3.1Å; Y410-W427 PolarHBondContact O-N 2.92Å; Y410-I472 HydrophobicContact CD1-CG2 4.16Å; Y410-V474 HydrophobicContact CD1-CG2 4.39Å; Y410-V474 HydrophobicContact CE1-CB 4.01Å; Y410-V474 HydrophobicContact CE1-CG2 3.8Å
411	F	98.4	Very high	90.9	Very high	14 Å²	14	39.4 Å²	39.4	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	143.4	169.3	-73.5	-73.2	0	0	0	109.8	H292 W295 L297 A299 V308 S425 L426 L440	H292-F411 HydrophobicContact CB-CB 4.47Å; H292-F411 HydrophobicContact CB-CD2 3.7Å; H292-F411 HydrophobicContact CB-CE2 3.94Å; H292-F411 HydrophobicContact CB-CG 4.01Å; H292-F411 HydrophobicContact CB-CZ 4.46Å; W295-F411 HydrophobicContact CE3-CD1 4.07Å; W295-F411 HydrophobicContact CZ3-CB 4.02Å; W295-F411 AromaticContact CZ3-CD1 3.83Å; W295-F411 HydrophobicContact CZ3-CD1 3.83Å; W295-F411 HydrophobicContact CZ3-CG 4.26Å; L297-F411 HydrophobicContact CB-CE1 4.31Å; L297-F411 HydrophobicContact CB-CZ 3.87Å; L297-F411 HydrophobicContact CD1-CE1 4.13Å; L297-F411 HydrophobicContact CD1-CZ 4.48Å; A299-F411 HydrophobicContact CB-CE2 3.83Å; A299-F411 HydrophobicContact CB-CZ 3.71Å; V308-F411 HydrophobicContact CG1-CZ 4.49Å; F411-S425 WeakPolarHBondContact CA-O 3.32Å; F411-L426 HydrophobicContact CD1-CB 4.27Å; F411-L426 HydrophobicContact CD1-CD1 3.85Å; F411-L426 HydrophobicContact CD2-CD1 4.45Å; F411-L426 HydrophobicContact CE1-CB 4.2Å; F411-L426 HydrophobicContact CE1-CD1 3.65Å; F411-L426 HydrophobicContact CE1-CG 4.49Å; F411-L426 HydrophobicContact CE2-CD1 4.27Å; F411-L426 HydrophobicContact CG-CD1 4.27Å; F411-L426 HydrophobicContact CZ-CD1 3.88Å; F411-L440 HydrophobicContact CD1-CD1 3.93Å; F411-L440 HydrophobicContact CE1-CD1 3.72Å
412	A	97.3	Very high	92.2	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.033	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	139.6	177	0	0	0	0	0	110.3	Y410 T414 S425 V474 L482	Y410-A412 HydrophobicContact CD1-CB 4.12Å; Y410-A412 HydrophobicContact CE1-CB 3.74Å; A412-T414 HydrophobicContact CB-CG2 3.99Å; A412-S425 PolarHBondContact N-O 2.89Å; A412-S425 WeakPolarHBondContact O-CA 3.38Å; A412-S425 WeakPolarHBondContact O-CB 3.24Å; A412-S425 PolarHBondContact O-N 3.29Å; A412-S425 PolarHBondContact O-OG 3.08Å; A412-V474 HydrophobicContact CB-CB 4.24Å; A412-V474 HydrophobicContact CB-CG2 3.82Å; A412-L482 HydrophobicContact CB-CD1 3.9Å
413	D	95.4	Very high	93.1	Very high	62 Å²	62	38 Å²	38	33%	0.332	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	105.9	164.5	-172.3	6	0	0	0	108.8	W295 N422 T423 L482	W295-D413 HydrophobicContact CH2-CB 4.22Å; W295-D413 HydrophobicContact CZ2-CB 4.02Å; D413-N422 PolarHBondContact OD1-ND2 3.02Å; D413-N422 PolarHBondContact OD2-ND2 3.33Å; D413-T423 PolarHBondContact OD1-N 3.25Å; D413-L482 WeakPolarHBondContact O-CD1 2.91Å
414	T	96.1	Very high	93.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	172.3	-168.5	-175	0	0	0	0	112	A412 T423 W427 V474 H502 L517	A412-T414 HydrophobicContact CB-CG2 3.99Å; T414-T423 PolarHBondContact N-O 2.93Å; T414-T423 PolarHBondContact O-N 3.03Å; T414-T423 VanDerWaalsContact O-O 3.1Å; T414-W427 HydrophobicContact CG2-CZ2 4.36Å; T414-V474 HydrophobicContact CG2-CG1 4.37Å; T414-V474 HydrophobicContact CG2-CG2 4.47Å; T414-H502 PolarHBondContact OG1-ND1 3.35Å; T414-L517 HydrophobicContact CG2-CD1 4.11Å; T414-L517 WeakPolarHBondContact OG1-CD1 3.14Å
415	F	95.3	Very high	94.1	Very high	8 Å²	8	38 Å²	38	4%	0.035	21%	0.213	C	C	.	.			trans	-75.6	119.6	177.1	-55.9	-69.4	0	0	0	113.1	D418 N422 L498 H502 P518	F415-D418 WeakPolarHBondContact CB-O 3.01Å; F415-N422 HydrophobicContact CD1-CB 4.21Å; F415-N422 HydrophobicContact CE1-CB 3.94Å; F415-N422 HydrophobicContact CZ-CB 4.29Å; F415-L498 HydrophobicContact CZ-CB 4.33Å; F415-L498 WeakPolarHBondContact CZ-O 3.41Å; F415-H502 HydrophobicContact CD2-CB 4.04Å; F415-H502 AromaticContact CD2-CD2 3.94Å; F415-H502 AromaticContact CD2-CG 3.7Å; F415-H502 AromaticContact CD2-ND1 3.93Å; F415-H502 AromaticContact CE2-CD2 3.6Å; F415-H502 AromaticContact CE2-CE1 3.92Å; F415-H502 AromaticContact CE2-CG 3.82Å; F415-H502 AromaticContact CE2-NE2 3.67Å; F415-P518 HydrophobicContact CB-CB 4.37Å
416	L	92.7	Very high	94.4	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	21%	0.208	C	C	.	.	S	Bend	trans	-124.6	-37.2	176.6	-83.7	176	0	0	0	114.3	W427 A437 I439 A458 K459	L416-W427 HydrophobicContact CD2-CH2 3.78Å; L416-W427 HydrophobicContact CD2-CZ2 3.53Å; L416-W427 HydrophobicContact CG-CZ2 4.28Å; L416-A437 HydrophobicContact CD1-CB 4.48Å; L416-A437 HydrophobicContact CD2-CB 4.06Å; L416-I439 HydrophobicContact CB-CD1 4.08Å; L416-I439 HydrophobicContact CB-CG1 3.92Å; L416-I439 HydrophobicContact CD1-CG1 3.68Å; L416-I439 HydrophobicContact CG-CG1 4.47Å; L416-A458 HydrophobicContact CB-CB 4.49Å; L416-A458 HydrophobicContact CD1-CB 4.21Å; L416-K459 HydrophobicContact CD2-CG 4.11Å; L416-K459 WeakPolarHBondContact O-CE 3.14Å
417	S	89.2	Confident	94.4	Very high	74 Å²	74	37.1 Å²	37.1	52%	0.517	21%	0.208	S	C	.	.	S	Bend	trans	-88.8	-59.8	179.4	45.7	0	0	0	0	111.4
418	D	87.9	Confident	94.5	Very high	56 Å²	56	33.5 Å²	33.5	30%	0.299	19%	0.194	S	C	.	.			trans	-132	-179.3	-179.7	65.4	49.6	0	0	0	111.1	F415 S420 H421	F415-D418 WeakPolarHBondContact CB-O 3.01Å; D418-S420 WeakPolarHBondContact OD1-CA 3.39Å; D418-S420 PolarHBondContact OD1-N 3.41Å; D418-S420 PolarHBondContact OD1-OG 3.12Å; D418-H421 IonicContact OD1-CD2 3.62Å; D418-H421 PolarHBondContact OD1-N 3.46Å; D418-H421 IonicContact OD2-CD2 2.68Å
419	S	88.1	Confident	94.5	Very high	98 Å²	98	32.5 Å²	32.5	69%	0.685	19%	0.188	S	C	*	.	S	Bend	trans	-99.3	10.1	-179.1	58.2	0	0	0	0	113.5
420	S	85.2	Confident	94.4	Very high	78 Å²	78	32 Å²	32	55%	0.545	19%	0.186	S	C	.	.	S	Bend	trans	-110.8	-32.3	-175.7	35.2	0	0	0	0	112.6	D418	D418-S420 WeakPolarHBondContact OD1-CA 3.39Å; D418-S420 PolarHBondContact OD1-N 3.41Å; D418-S420 PolarHBondContact OD1-OG 3.12Å
421	H	87.2	Confident	94.3	Very high	123 Å²	123	31.6 Å²	31.6	57%	0.569	19%	0.186	S	C	*	.			trans	-121.1	113.5	-176.3	-60.9	-63.1	0	0	0	109.6	D418	D418-H421 IonicContact OD1-CD2 3.62Å; D418-H421 PolarHBondContact OD1-N 3.46Å; D418-H421 IonicContact OD2-CD2 2.68Å
422	N	91.9	Very high	94	Very high	50 Å²	50	31.3 Å²	31.3	27%	0.267	19%	0.187	S	C	.	.			trans	-73.9	148.3	166.6	61.3	-60.9	0	0	0	109.5	D413 F415	D413-N422 PolarHBondContact OD1-ND2 3.02Å; D413-N422 PolarHBondContact OD2-ND2 3.33Å; F415-N422 HydrophobicContact CD1-CB 4.21Å; F415-N422 HydrophobicContact CE1-CB 3.94Å; F415-N422 HydrophobicContact CZ-CB 4.29Å
423	T	93.9	Very high	93.9	Very high	25 Å²	25	31.1 Å²	31.1	15%	0.153	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	142.9	178.6	54	0	0	0	0	109.9	D413 T414 S425 I439	D413-T423 PolarHBondContact OD1-N 3.25Å; T414-T423 PolarHBondContact N-O 2.93Å; T414-T423 PolarHBondContact O-N 3.03Å; T414-T423 VanDerWaalsContact O-O 3.1Å; T423-S425 PolarHBondContact O-N 3.12Å; T423-I439 HydrophobicContact CG2-CG2 4.47Å
424	P	96.8	Very high	94	Very high	27 Å²	27	29 Å²	29	18%	0.175	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	135.5	167	-30.4	38.8	0	0	0	111.7	W295 L440 I442	W295-P424 HydrophobicContact CD2-CB 4.32Å; W295-P424 HydrophobicContact CE3-CB 4.17Å; W295-P424 HydrophobicContact CH2-CB 3.51Å; W295-P424 HydrophobicContact CH2-CG 4.21Å; W295-P424 HydrophobicContact CZ2-CB 3.64Å; W295-P424 HydrophobicContact CZ2-CG 3.84Å; W295-P424 HydrophobicContact CZ3-CB 3.77Å; P424-L440 HydrophobicContact CB-CB 4.09Å; P424-L440 PolarHBondContact O-N 3.49Å; P424-I442 HydrophobicContact CB-CD1 3.6Å; P424-I442 HydrophobicContact CB-CG1 3.98Å; P424-I442 HydrophobicContact CG-CD1 3.8Å; P424-I442 HydrophobicContact CG-CG1 4.05Å
425	S	97.7	Very high	94.1	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	151.6	-175.1	69.3	0	0	0	0	113.3	F411 A412 T423 W427 Y438	F411-S425 WeakPolarHBondContact CA-O 3.32Å; A412-S425 PolarHBondContact N-O 2.89Å; A412-S425 WeakPolarHBondContact O-CA 3.38Å; A412-S425 WeakPolarHBondContact O-CB 3.24Å; A412-S425 PolarHBondContact O-N 3.29Å; A412-S425 PolarHBondContact O-OG 3.08Å; T423-S425 PolarHBondContact O-N 3.12Å; S425-W427 PolarHBondContact OG-NE1 3.18Å; S425-Y438 CarbonylContact C-O 3.53Å; S425-Y438 WeakPolarHBondContact CA-O 3Å; S425-Y438 VanDerWaalsContact CB-O 3.26Å; S425-Y438 WeakPolarHBondContact CB-O 3.4Å
426	L	98.6	Very high	94.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133.6	169.1	179	78.5	0	0	0	110	A299 F306 V308 L318 F411 A437 Y438 L440	A299-L426 HydrophobicContact CB-CD1 3.59Å; A299-L426 HydrophobicContact CB-CD2 4.45Å; F306-L426 HydrophobicContact CD2-CD2 4.15Å; F306-L426 HydrophobicContact CE2-CD2 4.04Å; V308-L426 HydrophobicContact CG2-CD2 3.35Å; V308-L426 HydrophobicContact CG2-CG 4.37Å; L318-L426 HydrophobicContact CD2-CD2 4.23Å; F411-L426 HydrophobicContact CD1-CB 4.27Å; F411-L426 HydrophobicContact CD1-CD1 3.85Å; F411-L426 HydrophobicContact CD2-CD1 4.45Å; F411-L426 HydrophobicContact CE1-CB 4.2Å; F411-L426 HydrophobicContact CE1-CD1 3.65Å; F411-L426 HydrophobicContact CE1-CG 4.49Å; F411-L426 HydrophobicContact CE2-CD1 4.27Å; F411-L426 HydrophobicContact CG-CD1 4.27Å; F411-L426 HydrophobicContact CZ-CD1 3.88Å; L426-A437 CarbonylContact O-C 3.53Å; L426-A437 WeakPolarHBondContact O-CA 3.37Å; L426-Y438 PolarHBondContact N-O 2.78Å; L426-Y438 PolarHBondContact O-N 3.09Å; L426-L440 HydrophobicContact CB-CD1 4.38Å
427	W	98.7	Very high	94.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131.7	173.4	-60.3	73.5	0	0	0	110.4	L409 Y410 T414 L416 S425 V435 F436 A437 I461 I472 V504 L517 L520	L409-W427 CarbonylContact C-O 3.58Å; L409-W427 WeakPolarHBondContact CA-O 3.41Å; Y410-W427 PolarHBondContact N-O 3.1Å; Y410-W427 PolarHBondContact O-N 2.92Å; T414-W427 HydrophobicContact CG2-CZ2 4.36Å; L416-W427 HydrophobicContact CD2-CH2 3.78Å; L416-W427 HydrophobicContact CD2-CZ2 3.53Å; L416-W427 HydrophobicContact CG-CZ2 4.28Å; S425-W427 PolarHBondContact OG-NE1 3.18Å; W427-V435 HydrophobicContact CE3-CG1 3.85Å; W427-V435 HydrophobicContact CZ3-CG1 4.45Å; W427-F436 CarbonylContact C-O 3.59Å; W427-F436 VanDerWaalsContact CA-O 3.28Å; W427-F436 WeakPolarHBondContact CA-O 3.28Å; W427-A437 HydrophobicContact CD2-CB 3.89Å; W427-A437 HydrophobicContact CE3-CB 3.73Å; W427-A437 HydrophobicContact CH2-CB 3.96Å; W427-A437 HydrophobicContact CZ2-CB 4.12Å; W427-A437 HydrophobicContact CZ3-CB 3.77Å; W427-I461 HydrophobicContact CZ3-CD1 4.22Å; W427-I472 HydrophobicContact CB-CD1 3.94Å; W427-I472 HydrophobicContact CB-CG2 4.08Å; W427-I472 HydrophobicContact CG-CG2 4.36Å; W427-V504 HydrophobicContact CE3-CG2 4.27Å; W427-V504 HydrophobicContact CH2-CB 4.37Å; W427-V504 HydrophobicContact CH2-CG1 4.21Å; W427-V504 HydrophobicContact CH2-CG2 4.31Å; W427-V504 HydrophobicContact CZ3-CG1 4.3Å; W427-V504 HydrophobicContact CZ3-CG2 4.07Å; W427-L517 HydrophobicContact CH2-CD2 3.84Å; W427-L517 HydrophobicContact CZ2-CD2 4.21Å; W427-L520 HydrophobicContact CH2-CD2 4.25Å
428	A	98.7	Very high	95	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.8	179.2	0	0	0	0	0	110.9	F306 T408 L409 V435 F436	F306-A428 HydrophobicContact CD1-CB 4Å; F306-A428 HydrophobicContact CD2-CB 4.11Å; F306-A428 HydrophobicContact CE1-CB 3.75Å; F306-A428 HydrophobicContact CE2-CB 3.87Å; F306-A428 HydrophobicContact CG-CB 4.17Å; F306-A428 HydrophobicContact CZ-CB 3.67Å; T408-A428 WeakPolarHBondContact O-CA 3.14Å; L409-A428 HydrophobicContact CD2-CB 3.61Å; A428-V435 CarbonylContact O-C 3.51Å; A428-V435 VanDerWaalsContact O-CA 3.26Å; A428-V435 WeakPolarHBondContact O-CA 3.39Å; A428-F436 HydrophobicContact CB-CB 4.42Å; A428-F436 PolarHBondContact N-O 2.83Å; A428-F436 PolarHBondContact O-N 3.48Å
429	G	98.3	Very high	95.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.8	178.1	0	0	0	0	0	112.4	R407 T408 T434	R407-G429 PolarHBondContact N-O 2.9Å; T408-G429 PolarHBondContact N-O 3.01Å; T408-G429 PolarHBondContact O-N 3.1Å; G429-T434 WeakPolarHBondContact CA-O 3.48Å
430	T	97.4	Very high	95.9	Very high	3 Å²	3	20 Å²	20	2%	0.018	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	167.7	-178.7	71.2	0	0	0	0	113.3	T322 L405 G432 G433 T434 F436 V469	T322-T430 HydrophobicContact CG2-CG2 4.46Å; L405-T430 CarbonylContact O-C 3.52Å; L405-T430 WeakPolarHBondContact O-CA 3.44Å; T430-G432 VanDerWaalsContact C-N 3.27Å; T430-G432 PolarHBondContact O-N 3.26Å; T430-G432 PolarHBondContact OG1-N 3.02Å; T430-G433 PolarHBondContact O-N 3.45Å; T430-T434 PolarHBondContact N-O 3.12Å; T430-T434 WeakPolarHBondContact OG1-CB 3.41Å; T430-T434 PolarHBondContact OG1-N 3.32Å; T430-T434 VanDerWaalsContact OG1-N 3.13Å; T430-T434 PolarHBondContact OG1-O 3.2Å; T430-T434 PolarHBondContact OG1-OG1 2.9Å; T430-F436 HydrophobicContact CG2-CD2 4.26Å; T430-F436 HydrophobicContact CG2-CE2 3.71Å; T430-V469 PolarHBondContact O-N 3.42Å
431	N	94.9	Very high	96.4	Very high	38 Å²	38	21.6 Å²	21.6	20%	0.203	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.2	176.1	-163.6	62.3	0	0	0	112.7	F402 T403 L405 R407 G433 P468	F402-N431 VanDerWaalsContact O-CB 3.29Å; F402-N431 WeakPolarHBondContact O-CB 3.29Å; F402-N431 PolarHBondContact O-ND2 3.41Å; F402-N431 VanDerWaalsContact O-ND2 3.1Å; T403-N431 PolarHBondContact O-N 3.26Å; L405-N431 HydrophobicContact CB-CB 4Å; L405-N431 HydrophobicContact CD2-CB 4.22Å; L405-N431 WeakPolarHBondContact O-CB 3.45Å; L405-N431 PolarHBondContact O-N 3.39Å; R407-N431 HydrophobicContact CG-CB 4.28Å; R407-N431 PolarHBondContact NH1-OD1 2.84Å; R407-N431 VanDerWaalsContact NH1-OD1 3.12Å; N431-G433 VanDerWaalsContact C-N 3.26Å; N431-G433 PolarHBondContact O-N 2.85Å; N431-P468 VanDerWaalsContact O-CA 3.24Å; N431-P468 WeakPolarHBondContact O-CA 3.34Å; N431-P468 WeakPolarHBondContact O-CD 3.44Å; N431-P468 VanDerWaalsContact O-CG 3.32Å; N431-P468 WeakPolarHBondContact O-CG 3.49Å; N431-P468 WeakPolarHBondContact OD1-CB 3.45Å; N431-P468 WeakPolarHBondContact OD1-CG 3.49Å
432	G	93.2	Very high	96.7	Very high	8 Å²	8	17.9 Å²	17.9	8%	0.082	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	3.5	173.7	0	0	0	0	0	114.9	T403 T430 Q462 R466	T403-G432 PolarHBondContact O-N 3.27Å; T430-G432 VanDerWaalsContact C-N 3.27Å; T430-G432 PolarHBondContact O-N 3.26Å; T430-G432 PolarHBondContact OG1-N 3.02Å; G432-Q462 PolarHBondContact O-NE2 3.41Å; G432-R466 WeakPolarHBondContact O-CA 3.43Å
433	G	95.5	Very high	96.8	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	77.4	22.3	-178.9	0	0	0	0	0	114	T430 N431 Q462 L463 A467	T430-G433 PolarHBondContact O-N 3.45Å; N431-G433 VanDerWaalsContact C-N 3.26Å; N431-G433 PolarHBondContact O-N 2.85Å; G433-Q462 PolarHBondContact O-NE2 2.85Å; G433-L463 VanDerWaalsContact O-CB 3.31Å; G433-L463 WeakPolarHBondContact O-CB 3.4Å; G433-L463 VanDerWaalsContact O-CG 3.31Å; G433-L463 WeakPolarHBondContact O-CG 3.22Å; G433-L463 PolarHBondContact O-N 3.38Å; G433-A467 WeakPolarHBondContact CA-O 3.34Å
434	T	96.9	Very high	96.5	Very high	18 Å²	18	19.1 Å²	19.1	11%	0.11	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	138	173.4	-40	0	0	0	0	109.3	G429 T430 F436 E460 I461 Q462	G429-T434 WeakPolarHBondContact CA-O 3.48Å; T430-T434 PolarHBondContact N-O 3.12Å; T430-T434 WeakPolarHBondContact OG1-CB 3.41Å; T430-T434 PolarHBondContact OG1-N 3.32Å; T430-T434 VanDerWaalsContact OG1-N 3.13Å; T430-T434 PolarHBondContact OG1-O 3.2Å; T430-T434 PolarHBondContact OG1-OG1 2.9Å; T434-F436 HydrophobicContact CG2-CD2 4.49Å; T434-F436 HydrophobicContact CG2-CE1 4.05Å; T434-F436 HydrophobicContact CG2-CE2 3.92Å; T434-F436 HydrophobicContact CG2-CZ 3.67Å; T434-E460 HydrophobicContact CG2-CG 3.84Å; T434-I461 CarbonylContact C-O 3.55Å; T434-I461 WeakPolarHBondContact CA-O 3.22Å; T434-Q462 PolarHBondContact OG1-OE1 2.98Å
435	V	98.3	Very high	96	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.1	171.7	-178.4	0	0	0	0	109	W427 A428 E460 I461 V469 I472 V506	W427-V435 HydrophobicContact CE3-CG1 3.85Å; W427-V435 HydrophobicContact CZ3-CG1 4.45Å; A428-V435 CarbonylContact O-C 3.51Å; A428-V435 VanDerWaalsContact O-CA 3.26Å; A428-V435 WeakPolarHBondContact O-CA 3.39Å; V435-E460 CarbonylContact O-C 3.34Å; V435-E460 WeakPolarHBondContact O-CA 3.49Å; V435-I461 HydrophobicContact CB-CB 4.18Å; V435-I461 PolarHBondContact N-O 3.38Å; V435-I461 PolarHBondContact O-N 3.41Å; V435-V469 HydrophobicContact CG2-CG1 4.32Å; V435-V469 HydrophobicContact CG2-CG2 3.82Å; V435-I472 HydrophobicContact CG1-CD1 3.78Å; V435-I472 HydrophobicContact CG2-CD1 4.47Å; V435-V506 HydrophobicContact CG2-CG1 3.77Å; V435-V506 HydrophobicContact CG2-CG2 4.35Å
436	F	98.3	Very high	95.6	Very high	18 Å²	18	32.4 Å²	32.4	8%	0.079	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	140.7	172.4	-56.7	-81.9	0	0	0	109.9	F306 T322 W427 A428 T430 T434 Y438 E460	F306-F436 AromaticContact CE1-CD2 3.85Å; F306-F436 HydrophobicContact CE1-CD2 3.85Å; F306-F436 HydrophobicContact CE1-CE2 4.39Å; F306-F436 HydrophobicContact CE1-CG 4.37Å; F306-F436 HydrophobicContact CZ-CB 4.13Å; F306-F436 HydrophobicContact CZ-CD2 4.22Å; F306-F436 HydrophobicContact CZ-CG 4.31Å; T322-F436 HydrophobicContact CG2-CE2 3.95Å; T322-F436 HydrophobicContact CG2-CZ 4.47Å; W427-F436 CarbonylContact C-O 3.59Å; W427-F436 VanDerWaalsContact CA-O 3.28Å; W427-F436 WeakPolarHBondContact CA-O 3.28Å; A428-F436 HydrophobicContact CB-CB 4.42Å; A428-F436 PolarHBondContact N-O 2.83Å; A428-F436 PolarHBondContact O-N 3.48Å; T430-F436 HydrophobicContact CG2-CD2 4.26Å; T430-F436 HydrophobicContact CG2-CE2 3.71Å; T434-F436 HydrophobicContact CG2-CD2 4.49Å; T434-F436 HydrophobicContact CG2-CE1 4.05Å; T434-F436 HydrophobicContact CG2-CE2 3.92Å; T434-F436 HydrophobicContact CG2-CZ 3.67Å; F436-Y438 HydrophobicContact CB-CD2 4.38Å; F436-Y438 HydrophobicContact CB-CE2 3.94Å; F436-E460 HydrophobicContact CD1-CB 4.43Å; F436-E460 HydrophobicContact CD1-CG 3.88Å; F436-E460 VanDerWaalsContact CE1-CD 3.47Å; F436-E460 HydrophobicContact CE1-CG 3.79Å
437	A	98.3	Very high	95.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.8	170.7	0	0	0	0	0	109.9	L416 L426 W427 A458 K459	L416-A437 HydrophobicContact CD1-CB 4.48Å; L416-A437 HydrophobicContact CD2-CB 4.06Å; L426-A437 CarbonylContact O-C 3.53Å; L426-A437 WeakPolarHBondContact O-CA 3.37Å; W427-A437 HydrophobicContact CD2-CB 3.89Å; W427-A437 HydrophobicContact CE3-CB 3.73Å; W427-A437 HydrophobicContact CH2-CB 3.96Å; W427-A437 HydrophobicContact CZ2-CB 4.12Å; W427-A437 HydrophobicContact CZ3-CB 3.77Å; A437-A458 PolarHBondContact O-N 2.8Å; A437-K459 HydrophobicContact CB-CB 4.04Å; A437-K459 PolarHBondContact N-O 3.29Å; A437-K459 PolarHBondContact O-N 2.85Å; A437-K459 VanDerWaalsContact O-N 3.09Å
438	Y	98.4	Very high	94.8	Very high	15 Å²	15	37.2 Å²	37.2	6%	0.059	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.8	177.6	-75.1	-102.9	0	0	0	109.8	F306 L318 K320 S425 L426 F436 A455 Q456 P457	F306-Y438 HydrophobicContact CE2-CD2 4.41Å; F306-Y438 HydrophobicContact CE2-CE2 4.1Å; F306-Y438 HydrophobicContact CZ-CD2 4.44Å; F306-Y438 AromaticContact CZ-CE2 3.8Å; F306-Y438 HydrophobicContact CZ-CE2 3.8Å; L318-Y438 HydrophobicContact CD1-CD1 3.89Å; L318-Y438 HydrophobicContact CD1-CE1 3.48Å; L318-Y438 VanDerWaalsContact CD1-CE1 3.48Å; L318-Y438 HydrophobicContact CD2-CD1 3.66Å; L318-Y438 HydrophobicContact CD2-CD2 3.94Å; L318-Y438 HydrophobicContact CD2-CE1 3.86Å; L318-Y438 HydrophobicContact CD2-CE2 4.14Å; L318-Y438 HydrophobicContact CD2-CG 3.71Å; L318-Y438 HydrophobicContact CG-CD1 4.45Å; L318-Y438 HydrophobicContact CG-CE1 4.34Å; K320-Y438 WeakPolarHBondContact CD-OH 3.29Å; S425-Y438 CarbonylContact C-O 3.53Å; S425-Y438 WeakPolarHBondContact CA-O 3Å; S425-Y438 VanDerWaalsContact CB-O 3.26Å; S425-Y438 WeakPolarHBondContact CB-O 3.4Å; L426-Y438 PolarHBondContact N-O 2.78Å; L426-Y438 PolarHBondContact O-N 3.09Å; F436-Y438 HydrophobicContact CB-CD2 4.38Å; F436-Y438 HydrophobicContact CB-CE2 3.94Å; Y438-A455 HydrophobicContact CD1-CB 4.47Å; Y438-Q456 CarbonylContact C-O 3.55Å; Y438-Q456 VanDerWaalsContact CA-O 3.27Å; Y438-Q456 WeakPolarHBondContact CA-O 3.42Å; Y438-P457 HydrophobicContact CD1-CB 4.14Å; Y438-P457 HydrophobicContact CE1-CB 3.7Å; Y438-P457 HydrophobicContact CE1-CG 4.33Å
439	I	97.9	Very high	94.2	Very high	13 Å²	13	40.8 Å²	40.8	7%	0.067	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	136.7	166.6	-67.9	161	0	0	0	107.7	L416 T423 Y441 A455 Q456 A458	L416-I439 HydrophobicContact CB-CD1 4.08Å; L416-I439 HydrophobicContact CB-CG1 3.92Å; L416-I439 HydrophobicContact CD1-CG1 3.68Å; L416-I439 HydrophobicContact CG-CG1 4.47Å; T423-I439 HydrophobicContact CG2-CG2 4.47Å; I439-Y441 HydrophobicContact CG2-CD2 4.47Å; I439-Y441 HydrophobicContact CG2-CE1 4.09Å; I439-Y441 HydrophobicContact CG2-CE2 4.07Å; I439-A455 CarbonylContact O-C 3.58Å; I439-A455 WeakPolarHBondContact O-CA 3.09Å; I439-Q456 PolarHBondContact N-O 3.22Å; I439-Q456 PolarHBondContact O-N 2.97Å; I439-A458 HydrophobicContact CD1-CB 3.73Å; I439-A458 HydrophobicContact CG1-CB 3.74Å
440	L	97.4	Very high	93.7	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.8	177.4	-53.1	173.8	0	0	0	108.4	W295 L297 F411 P424 L426 I442 L453 A455	W295-L440 HydrophobicContact CE3-CD1 4.33Å; W295-L440 HydrophobicContact CZ3-CD1 4.27Å; L297-L440 HydrophobicContact CD1-CD1 3.88Å; F411-L440 HydrophobicContact CD1-CD1 3.93Å; F411-L440 HydrophobicContact CE1-CD1 3.72Å; P424-L440 HydrophobicContact CB-CB 4.09Å; P424-L440 PolarHBondContact O-N 3.49Å; L426-L440 HydrophobicContact CB-CD1 4.38Å; L440-I442 HydrophobicContact CB-CG1 4.23Å; L440-I442 PolarHBondContact O-N 3.37Å; L440-L453 HydrophobicContact CB-CD2 4.46Å; L440-A455 HydrophobicContact CD2-CB 3.72Å
441	Y	95.8	Very high	93.4	Very high	111 Å²	111	52 Å²	52	44%	0.435	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	95.4	174.9	-62.4	-78.5	0	0	0	108.8	I439 L453 T454 Q456	I439-Y441 HydrophobicContact CG2-CD2 4.47Å; I439-Y441 HydrophobicContact CG2-CE1 4.09Å; I439-Y441 HydrophobicContact CG2-CE2 4.07Å; Y441-L453 WeakPolarHBondContact O-CG 3.38Å; Y441-T454 PolarHBondContact N-O 3.25Å; Y441-T454 PolarHBondContact O-N 3.12Å; Y441-Q456 HydrophobicContact CE2-CB 3.88Å; Y441-Q456 PolarHBondContact OH-OE1 3.14Å
442	I	94.1	Very high	93.2	Very high	46 Å²	46	53.4 Å²	53.4	24%	0.236	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-92.1	118.9	-177.4	-46.5	-165.9	0	0	0	108.3	W295 P424 L440 L453	W295-I442 HydrophobicContact CB-CD1 3.74Å; W295-I442 HydrophobicContact CD2-CD1 3.38Å; W295-I442 HydrophobicContact CE3-CD1 3.83Å; W295-I442 HydrophobicContact CG-CD1 3.33Å; P424-I442 HydrophobicContact CB-CD1 3.6Å; P424-I442 HydrophobicContact CB-CG1 3.98Å; P424-I442 HydrophobicContact CG-CD1 3.8Å; P424-I442 HydrophobicContact CG-CG1 4.05Å; L440-I442 HydrophobicContact CB-CG1 4.23Å; L440-I442 PolarHBondContact O-N 3.37Å; I442-L453 HydrophobicContact CB-CD1 4.09Å; I442-L453 HydrophobicContact CD1-CD1 4.28Å; I442-L453 HydrophobicContact CG1-CD1 3.74Å; I442-L453 HydrophobicContact CG1-CG 4.4Å; I442-L453 HydrophobicContact CG2-CD1 3.98Å
443	P	93.3	Very high	93.2	Very high	15 Å²	15	53.6 Å²	53.6	10%	0.097	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-60.4	149.3	174.1	-23.5	34.3	0	0	0	111.4	H447 E451	P443-H447 HydrophobicContact CB-CB 4.36Å; P443-E451 HydrophobicContact CB-CB 3.96Å; P443-E451 HydrophobicContact CG-CB 3.69Å
444	P	89.2	Confident	93.2	Very high	85 Å²	85	57.2 Å²	57.2	55%	0.552	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-54.3	155	170.6	-23.1	33.5	0	0	0	111.6	E446 H447 R448	P444-E446 PolarHBondContact O-N 2.65Å; P444-H447 CarbonylContact O-C 3.56Å; P444-H447 PolarHBondContact O-N 3.12Å; P444-R448 PolarHBondContact O-N 3.48Å
445	V	86.3	Confident	93.2	Very high	139 Å²	139	57.6 Å²	57.6	84%	0.842	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-51.6	-37.8	-175.5	179.8	0	0	0	0	112.6	H447 R448	V445-H447 VanDerWaalsContact C-N 3.31Å; V445-H447 PolarHBondContact O-N 3.39Å; V445-R448 WeakPolarHBondContact O-CB 3.23Å; V445-R448 PolarHBondContact O-N 3.38Å
446	E	88.7	Confident	93.2	Very high	167 Å²	167	62.2 Å²	62.2	78%	0.78	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-63.3	-33.2	179.6	-62.2	178.4	-170.7	0	0	113.5	P444	P444-E446 PolarHBondContact O-N 2.65Å
447	H	89.7	Confident	93.1	Very high	83 Å²	83	65.7 Å²	65.7	38%	0.384	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-104.5	2.1	-179.1	-60.4	-51.8	0	0	0	112.6	P443 P444 V445 A449 D450 E451	P443-H447 HydrophobicContact CB-CB 4.36Å; P444-H447 CarbonylContact O-C 3.56Å; P444-H447 PolarHBondContact O-N 3.12Å; V445-H447 VanDerWaalsContact C-N 3.31Å; V445-H447 PolarHBondContact O-N 3.39Å; H447-A449 PolarHBondContact O-N 3.17Å; H447-D450 PolarHBondContact O-N 3.09Å; H447-D450 VanDerWaalsContact O-N 3.09Å; H447-E451 HydrophobicContact CB-CB 4.49Å; H447-E451 HydrophobicContact CB-CG 4.1Å; H447-E451 PolarHBondContact O-N 3.2Å
448	R	89.5	Confident	93	Very high	18 Å²	18	67.2 Å²	67.2	7%	0.068	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-20.7	-171.5	-172.2	60	-174.1	83.2	3.6	113.6	W295 D310 L312 Q313 P444 V445	W295-R448 PolarHBondContact O-NH2 3.19Å; W295-R448 VanDerWaalsContact O-NH2 3.12Å; D310-R448 IonicContact OD1-CZ 2.87Å; D310-R448 IonicContact OD1-NH1 2.84Å; D310-R448 IonicContact OD1-NH2 3.15Å; D310-R448 PolarHBondContact OD1-NH2 3.33Å; D310-R448 IonicContact OD2-CZ 3.65Å; D310-R448 VanDerWaalsContact OD2-CZ 3.23Å; D310-R448 IonicContact OD2-NH1 3.09Å; D310-R448 PolarHBondContact OD2-NH1 3.39Å; D310-R448 IonicContact OD2-NH2 3.51Å; D310-R448 PolarHBondContact OD2-NH2 2.82Å; L312-R448 HydrophobicContact CD2-CG 3.69Å; Q313-R448 PolarHBondContact NE2-O 2.77Å; P444-R448 PolarHBondContact O-N 3.48Å; V445-R448 WeakPolarHBondContact O-CB 3.23Å; V445-R448 PolarHBondContact O-N 3.38Å
449	A	86.5	Confident	92.9	Very high	76 Å²	76	70.2 Å²	70.2	63%	0.628	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-30.4	174.4	0	0	0	0	0	112.9	H447	H447-A449 PolarHBondContact O-N 3.17Å
450	D	87.9	Confident	92.8	Very high	138 Å²	138	75.8 Å²	75.8	74%	0.738	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-36.3	-169	-58.5	-40.4	0	0	0	113	H447	H447-D450 PolarHBondContact O-N 3.09Å; H447-D450 VanDerWaalsContact O-N 3.09Å
451	E	91.7	Very high	92.7	Very high	100 Å²	100	76.5 Å²	76.5	47%	0.467	42%	0.423	S	S	.	.	S	Bend	trans	-94.1	130	-177.3	-68.2	-174.1	179.2	0	0	111.5	Q313 P443 H447	Q313-E451 PolarHBondContact NE2-O 3.38Å; P443-E451 HydrophobicContact CB-CB 3.96Å; P443-E451 HydrophobicContact CG-CB 3.69Å; H447-E451 HydrophobicContact CB-CB 4.49Å; H447-E451 HydrophobicContact CB-CG 4.1Å; H447-E451 PolarHBondContact O-N 3.2Å
452	A	90.5	Very high	92.7	Very high	69 Å²	69	75.2 Å²	75.2	57%	0.57	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-74.5	135.7	179	0	0	0	0	0	111.5
453	L	94.1	Very high	92.7	Very high	11 Å²	11	73.2 Å²	73.2	6%	0.058	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-70.8	137.3	173.1	-167.8	148.9	0	0	0	110.3	L297 V317 L440 Y441 I442	L297-L453 HydrophobicContact CD1-CD1 4Å; L297-L453 HydrophobicContact CD1-CD2 4.39Å; L297-L453 HydrophobicContact CD2-CD1 3.98Å; L297-L453 HydrophobicContact CG-CD1 4.31Å; V317-L453 HydrophobicContact CB-CD2 4.21Å; V317-L453 HydrophobicContact CG1-CD2 3.27Å; V317-L453 HydrophobicContact CG2-CB 4.25Å; V317-L453 HydrophobicContact CG2-CD2 3.88Å; L440-L453 HydrophobicContact CB-CD2 4.46Å; Y441-L453 WeakPolarHBondContact O-CG 3.38Å; I442-L453 HydrophobicContact CB-CD1 4.09Å; I442-L453 HydrophobicContact CD1-CD1 4.28Å; I442-L453 HydrophobicContact CG1-CD1 3.74Å; I442-L453 HydrophobicContact CG1-CG 4.4Å; I442-L453 HydrophobicContact CG2-CD1 3.98Å
454	T	95.4	Very high	92.7	Very high	77 Å²	77	80.6 Å²	80.6	47%	0.472	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.6	177.6	62.2	0	0	0	0	111.7	Y441	Y441-T454 PolarHBondContact N-O 3.25Å; Y441-T454 PolarHBondContact O-N 3.12Å
455	A	97.1	Very high	92.8	Very high	26 Å²	26	77 Å²	77	22%	0.215	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.9	176.3	0	0	0	0	0	110.5	V317 L318 Y438 I439 L440	V317-A455 HydrophobicContact CG1-CB 3.85Å; L318-A455 HydrophobicContact CB-CB 4Å; L318-A455 HydrophobicContact CD1-CB 4.43Å; L318-A455 HydrophobicContact CD2-CB 4.37Å; L318-A455 HydrophobicContact CG-CB 4.49Å; Y438-A455 HydrophobicContact CD1-CB 4.47Å; I439-A455 CarbonylContact O-C 3.58Å; I439-A455 WeakPolarHBondContact O-CA 3.09Å; L440-A455 HydrophobicContact CD2-CB 3.72Å
456	Q	96.7	Very high	93.1	Very high	97 Å²	97	75 Å²	75	45%	0.453	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.6	178.8	-175	-179.4	1.5	0	0	110.6	Y438 I439 Y441 A458	Y438-Q456 CarbonylContact C-O 3.55Å; Y438-Q456 VanDerWaalsContact CA-O 3.27Å; Y438-Q456 WeakPolarHBondContact CA-O 3.42Å; I439-Q456 PolarHBondContact N-O 3.22Å; I439-Q456 PolarHBondContact O-N 2.97Å; Y441-Q456 HydrophobicContact CE2-CB 3.88Å; Y441-Q456 PolarHBondContact OH-OE1 3.14Å; Q456-A458 PolarHBondContact O-N 2.77Å
457	P	96.6	Very high	93.4	Very high	90 Å²	90	67 Å²	67	58%	0.584	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	126.9	173.5	26.4	-33.4	0	0	0	110.2	Y438	Y438-P457 HydrophobicContact CD1-CB 4.14Å; Y438-P457 HydrophobicContact CE1-CB 3.7Å; Y438-P457 HydrophobicContact CE1-CG 4.33Å
458	A	96	Very high	93.7	Very high	33 Å²	33	63.1 Å²	63.1	27%	0.273	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-49.4	-176.5	0	0	0	0	0	112.1	L416 A437 I439 Q456	L416-A458 HydrophobicContact CB-CB 4.49Å; L416-A458 HydrophobicContact CD1-CB 4.21Å; A437-A458 PolarHBondContact O-N 2.8Å; I439-A458 HydrophobicContact CD1-CB 3.73Å; I439-A458 HydrophobicContact CG1-CB 3.74Å; Q456-A458 PolarHBondContact O-N 2.77Å
459	K	95.9	Very high	94.1	Very high	79 Å²	79	62.2 Å²	62.2	34%	0.343	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.1	-177.2	-54.7	-71	-175.2	-170.8	0	111.5	L416 A437 L520	L416-K459 HydrophobicContact CD2-CG 4.11Å; L416-K459 WeakPolarHBondContact O-CE 3.14Å; A437-K459 HydrophobicContact CB-CB 4.04Å; A437-K459 PolarHBondContact N-O 3.29Å; A437-K459 PolarHBondContact O-N 2.85Å; A437-K459 VanDerWaalsContact O-N 3.09Å; K459-L520 HydrophobicContact CB-CD1 3.66Å; K459-L520 HydrophobicContact CD-CD1 3.78Å; K459-L520 HydrophobicContact CG-CD1 3.57Å
460	E	96.1	Very high	94.6	Very high	129 Å²	129	59.6 Å²	59.6	60%	0.603	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	121.3	169.4	-173.6	176.1	154.1	0	0	108.8	T434 V435 F436	T434-E460 HydrophobicContact CG2-CG 3.84Å; V435-E460 CarbonylContact O-C 3.34Å; V435-E460 WeakPolarHBondContact O-CA 3.49Å; F436-E460 HydrophobicContact CD1-CB 4.43Å; F436-E460 HydrophobicContact CD1-CG 3.88Å; F436-E460 VanDerWaalsContact CE1-CD 3.47Å; F436-E460 HydrophobicContact CE1-CG 3.79Å
461	I	95.6	Very high	95.1	Very high	18 Å²	18	53.3 Å²	53.3	9%	0.092	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	113.3	-177.1	-48.7	171.1	0	0	0	108.3	W427 T434 V435 F515 L520	W427-I461 HydrophobicContact CZ3-CD1 4.22Å; T434-I461 CarbonylContact C-O 3.55Å; T434-I461 WeakPolarHBondContact CA-O 3.22Å; V435-I461 HydrophobicContact CB-CB 4.18Å; V435-I461 PolarHBondContact N-O 3.38Å; V435-I461 PolarHBondContact O-N 3.41Å; I461-F515 HydrophobicContact CG2-CE1 4.43Å; I461-F515 HydrophobicContact CG2-CZ 3.99Å; I461-L520 HydrophobicContact CD1-CD1 3.65Å; I461-L520 HydrophobicContact CD1-CD2 3.68Å; I461-L520 HydrophobicContact CD1-CG 4.23Å; I461-L520 HydrophobicContact CG1-CD1 3.76Å
462	Q	96	Very high	95.4	Very high	84 Å²	84	48.9 Å²	48.9	39%	0.393	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.4	169.5	-176.1	58	57.8	0	0	110.4	G432 G433 T434 M464	G432-Q462 PolarHBondContact O-NE2 3.41Å; G433-Q462 PolarHBondContact O-NE2 2.85Å; T434-Q462 PolarHBondContact OG1-OE1 2.98Å; Q462-M464 PolarHBondContact O-N 2.9Å
463	L	94.9	Very high	95.8	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	24%	0.241	C	C	.	.			trans	-69.5	129.4	170.3	-62.1	179	0	0	0	109.7	G433 H465 R466 V469 V506 K513 F515	G433-L463 VanDerWaalsContact O-CB 3.31Å; G433-L463 WeakPolarHBondContact O-CB 3.4Å; G433-L463 VanDerWaalsContact O-CG 3.31Å; G433-L463 WeakPolarHBondContact O-CG 3.22Å; G433-L463 PolarHBondContact O-N 3.38Å; L463-H465 VanDerWaalsContact C-N 3.26Å; L463-H465 PolarHBondContact O-N 3.07Å; L463-R466 PolarHBondContact O-N 2.84Å; L463-V469 HydrophobicContact CD1-CG2 4.11Å; L463-V506 HydrophobicContact CD1-CG1 4.01Å; L463-V506 HydrophobicContact CD2-CG1 4.31Å; L463-K513 HydrophobicContact CD2-CD 4.42Å; L463-F515 HydrophobicContact CD2-CZ 4.36Å
464	M	92.6	Very high	96	Very high	170 Å²	170	45.7 Å²	45.7	84%	0.837	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.1	-176.8	-70.3	-176.9	135.9	0	0	113.5	A395 Q462 R466	A395-M464 WeakPolarHBondContact CB-O 3.39Å; Q462-M464 PolarHBondContact O-N 2.9Å; M464-R466 VanDerWaalsContact C-N 3.31Å
465	H	90.9	Very high	96	Very high	11 Å²	11	42 Å²	42	5%	0.051	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.5	178.3	59.7	75.2	0	0	0	113.1	I393 R396 L463 A467 S508 Q511	I393-H465 HydrophobicContact CG2-CB 3.9Å; R396-H465 PolarHBondContact N-O 3.21Å; L463-H465 VanDerWaalsContact C-N 3.26Å; L463-H465 PolarHBondContact O-N 3.07Å; H465-A467 WeakPolarHBondContact ND1-CB 3.38Å; H465-A467 PolarHBondContact ND1-N 2.73Å; H465-A467 PolarHBondContact O-N 3.48Å; H465-A467 VanDerWaalsContact O-N 3.1Å; H465-S508 PolarHBondContact CE1-OG 3.32Å; H465-Q511 PolarHBondContact CD2-NE2 3.18Å; H465-Q511 VanDerWaalsContact CD2-NE2 3.25Å; H465-Q511 PolarHBondContact CD2-OE1 2.82Å
466	R	93.4	Very high	95.9	Very high	95 Å²	95	41.3 Å²	41.3	36%	0.358	21%	0.208	S	C	.	.			trans	52.6	32	176.8	-61.6	179.6	168	-179.5	-3.7	114.6	R396 S398 G432 L463 M464	R396-R466 HydrophobicContact CB-CB 4.22Å; R396-R466 VanDerWaalsContact O-CD 3.28Å; R396-R466 WeakPolarHBondContact O-CD 3.31Å; S398-R466 VanDerWaalsContact CB-NH1 3.34Å; G432-R466 WeakPolarHBondContact O-CA 3.43Å; L463-R466 PolarHBondContact O-N 2.84Å; M464-R466 VanDerWaalsContact C-N 3.31Å
467	A	93.9	Very high	95.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-86.6	148.4	176	0	0	0	0	0	110.1	G433 H465 V469 E510	G433-A467 WeakPolarHBondContact CA-O 3.34Å; H465-A467 WeakPolarHBondContact ND1-CB 3.38Å; H465-A467 PolarHBondContact ND1-N 2.73Å; H465-A467 PolarHBondContact O-N 3.48Å; H465-A467 VanDerWaalsContact O-N 3.1Å; A467-V469 PolarHBondContact O-N 3.27Å; A467-E510 HydrophobicContact CB-CB 4.05Å; A467-E510 HydrophobicContact CB-CG 3.75Å
468	P	96	Very high	95.6	Very high	1 Å²	1	41 Å²	41	1%	0.006	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-54.5	132.8	-179.1	-25.3	31.1	0	0	0	112	R396 N431 S508 E509	R396-P468 VanDerWaalsContact CZ-CD 3.41Å; N431-P468 VanDerWaalsContact O-CA 3.24Å; N431-P468 WeakPolarHBondContact O-CA 3.34Å; N431-P468 WeakPolarHBondContact O-CD 3.44Å; N431-P468 VanDerWaalsContact O-CG 3.32Å; N431-P468 WeakPolarHBondContact O-CG 3.49Å; N431-P468 WeakPolarHBondContact OD1-CB 3.45Å; N431-P468 WeakPolarHBondContact OD1-CG 3.49Å; P468-S508 CarbonylContact O-C 3.54Å; P468-S508 WeakPolarHBondContact O-CA 3.46Å; P468-S508 WeakPolarHBondContact O-CB 3.37Å; P468-E509 HydrophobicContact CB-CG 4.06Å; P468-E509 HydrophobicContact CG-CG 4.17Å; P468-E509 PolarHBondContact O-N 2.99Å
469	V	98.1	Very high	95.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.4	171.3	-175	0	0	0	0	107.9	R407 T430 V435 L463 A467 I472 V506 I507	R407-V469 WeakPolarHBondContact CB-O 3.49Å; T430-V469 PolarHBondContact O-N 3.42Å; V435-V469 HydrophobicContact CG2-CG1 4.32Å; V435-V469 HydrophobicContact CG2-CG2 3.82Å; L463-V469 HydrophobicContact CD1-CG2 4.11Å; A467-V469 PolarHBondContact O-N 3.27Å; V469-I472 HydrophobicContact CG1-CD1 4.32Å; V469-I472 HydrophobicContact CG1-CG1 3.93Å; V469-V506 HydrophobicContact CG1-CG1 4.15Å; V469-V506 HydrophobicContact CG2-CG1 4.44Å; V469-I507 CarbonylContact C-O 3.56Å
470	V	97.4	Very high	95.3	Very high	20 Å²	20	37.8 Å²	37.8	12%	0.121	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-18.3	-178.6	-61.8	0	0	0	0	112.7	T408 I507 E509 V536	T408-V470 PolarHBondContact OG1-O 3.15Å; T408-V470 VanDerWaalsContact OG1-O 3.09Å; V470-I507 HydrophobicContact CG2-CB 4.26Å; V470-I507 HydrophobicContact CG2-CG2 3.69Å; V470-I507 WeakPolarHBondContact CG2-O 3.34Å; V470-I507 PolarHBondContact N-O 3.46Å; V470-E509 HydrophobicContact CG1-CG 3.83Å; V470-V536 HydrophobicContact CG2-CB 4.17Å; V470-V536 HydrophobicContact CG2-CG1 3.79Å
471	G	98	Very high	95.3	Very high	7 Å²	7	32.7 Å²	32.7	7%	0.072	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	148.8	179.7	0	0	0	0	0	112.1	I507	G471-I507 PolarHBondContact N-O 2.86Å; G471-I507 WeakPolarHBondContact O-CB 3.47Å; G471-I507 PolarHBondContact O-N 3.43Å
472	I	98.5	Very high	95.3	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.3	172.2	-58.5	174.8	0	0	0	105.9	T408 Y410 W427 V435 V469 V504 L505	T408-I472 HydrophobicContact CG2-CG1 4.38Å; Y410-I472 HydrophobicContact CD1-CG2 4.16Å; W427-I472 HydrophobicContact CB-CD1 3.94Å; W427-I472 HydrophobicContact CB-CG2 4.08Å; W427-I472 HydrophobicContact CG-CG2 4.36Å; V435-I472 HydrophobicContact CG1-CD1 3.78Å; V435-I472 HydrophobicContact CG2-CD1 4.47Å; V469-I472 HydrophobicContact CG1-CD1 4.32Å; V469-I472 HydrophobicContact CG1-CG1 3.93Å; I472-V504 HydrophobicContact CG2-CG2 3.93Å; I472-L505 WeakPolarHBondContact CA-O 3.39Å
473	V	98	Very high	95.1	Very high	13 Å²	13	30.6 Å²	30.6	8%	0.079	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.8	177.3	-177.1	0	0	0	0	108	L475 P481 L505 I507 V541	V473-L475 HydrophobicContact CG1-CD2 3.95Å; V473-P481 HydrophobicContact CG1-CB 4.02Å; V473-P481 HydrophobicContact CG1-CG 4.44Å; V473-L505 HydrophobicContact CB-CB 4.46Å; V473-L505 PolarHBondContact N-O 2.75Å; V473-L505 PolarHBondContact O-N 2.94Å; V473-I507 HydrophobicContact CG2-CD1 4.29Å; V473-V541 HydrophobicContact CG1-CG2 4.17Å; V473-V541 HydrophobicContact CG2-CG2 3.94Å
474	V	97.9	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.8	170.6	177.4	0	0	0	0	108.7	Y410 A412 T414 P481 L482 H503 V504 L517	Y410-V474 HydrophobicContact CD1-CG2 4.39Å; Y410-V474 HydrophobicContact CE1-CB 4.01Å; Y410-V474 HydrophobicContact CE1-CG2 3.8Å; A412-V474 HydrophobicContact CB-CB 4.24Å; A412-V474 HydrophobicContact CB-CG2 3.82Å; T414-V474 HydrophobicContact CG2-CG1 4.37Å; T414-V474 HydrophobicContact CG2-CG2 4.47Å; V474-P481 WeakPolarHBondContact O-CA 3.38Å; V474-L482 HydrophobicContact CB-CD1 3.79Å; V474-L482 HydrophobicContact CB-CG 4.09Å; V474-L482 HydrophobicContact CG1-CD1 3.67Å; V474-L482 HydrophobicContact CG1-CG 3.98Å; V474-L482 PolarHBondContact O-N 3.04Å; V474-H503 CarbonylContact C-O 3.54Å; V474-H503 WeakPolarHBondContact CA-O 3.31Å; V474-V504 HydrophobicContact CG2-CB 4.34Å; V474-V504 HydrophobicContact CG2-CG2 4.19Å; V474-L517 HydrophobicContact CG1-CD1 4.19Å
475	L	97	Very high	94.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.2	177.5	-48	177.3	0	0	0	108.9	V473 A480 P481 H502 H503 L571 P572	V473-L475 HydrophobicContact CG1-CD2 3.95Å; L475-A480 CarbonylContact C-O 3.53Å; L475-A480 WeakPolarHBondContact CA-O 3.2Å; L475-P481 HydrophobicContact CD2-CB 4.24Å; L475-P481 HydrophobicContact CD2-CG 3.85Å; L475-H502 CarbonylContact O-C 3.46Å; L475-H502 VanDerWaalsContact O-CA 3.28Å; L475-H502 WeakPolarHBondContact O-CA 3.32Å; L475-H502 WeakPolarHBondContact O-CB 3.38Å; L475-H503 HydrophobicContact CB-CB 4.32Å; L475-H503 PolarHBondContact N-O 3.44Å; L475-H503 PolarHBondContact O-N 2.84Å; L475-L571 HydrophobicContact CD1-CD2 4.36Å; L475-L571 HydrophobicContact CD2-CD1 4.23Å; L475-P572 HydrophobicContact CD1-CB 3.75Å
476	D	95.3	Very high	94.9	Very high	11 Å²	11	28.1 Å²	28.1	6%	0.059	16%	0.156	C	C	.	.			trans	-74.1	-174.1	177.4	76.9	-4.4	0	0	0	112.8	H478 G479 A480 L482 P496 D497	D476-H478 PolarHBondContact O-N 3.4Å; D476-H478 WeakPolarHBondContact OD1-CA 3.44Å; D476-H478 PolarHBondContact OD1-N 3.36Å; D476-G479 PolarHBondContact O-N 2.76Å; D476-G479 PolarHBondContact OD1-N 2.99Å; D476-A480 PolarHBondContact N-O 3.01Å; D476-A480 PolarHBondContact OD1-N 3.1Å; D476-L482 HydrophobicContact CB-CD2 4.22Å; D476-P496 HydrophobicContact CB-CB 4.2Å; D476-D497 PolarHBondContact OD2-N 2.86Å
477	G	92.9	Very high	94.7	Very high	26 Å²	26	24.9 Å²	24.9	27%	0.268	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.5	179.4	0	0	0	0	0	115.5	D497	G477-D497 VanDerWaalsContact CA-OD2 3.27Å; G477-D497 WeakPolarHBondContact CA-OD2 3.38Å; G477-D497 PolarHBondContact N-O 3.44Å; G477-D497 VanDerWaalsContact N-O 3.14Å
478	H	92.8	Very high	94.5	Very high	154 Å²	154	27.1 Å²	27.1	71%	0.713	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.5	171.9	-71.5	-48.6	0	0	0	113.2	D476 A480 D497	D476-H478 PolarHBondContact O-N 3.4Å; D476-H478 WeakPolarHBondContact OD1-CA 3.44Å; D476-H478 PolarHBondContact OD1-N 3.36Å; H478-A480 VanDerWaalsContact C-N 3.35Å; H478-D497 VanDerWaalsContact CD2-CB 3.49Å; H478-D497 WeakPolarHBondContact CD2-CB 3.46Å
479	G	92.3	Very high	94.1	Very high	7 Å²	7	30.3 Å²	30.3	7%	0.072	19%	0.185	C	C	.	.	S	Bend	trans	81.5	14.3	-176.6	0	0	0	0	0	113.6	D476	D476-G479 PolarHBondContact O-N 2.76Å; D476-G479 PolarHBondContact OD1-N 2.99Å
480	A	93.5	Very high	93.5	Very high	38 Å²	38	34.7 Å²	34.7	31%	0.314	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-86.4	141.8	173.5	0	0	0	0	0	110.2	L475 D476 H478	L475-A480 CarbonylContact C-O 3.53Å; L475-A480 WeakPolarHBondContact CA-O 3.2Å; D476-A480 PolarHBondContact N-O 3.01Å; D476-A480 PolarHBondContact OD1-N 3.1Å; H478-A480 VanDerWaalsContact C-N 3.35Å
481	P	95.7	Very high	92.9	Very high	23 Å²	23	41.1 Å²	41.1	15%	0.149	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-57.9	143.9	172.5	-23.9	35.1	0	0	0	112.2	V473 V474 L475 V541 L571	V473-P481 HydrophobicContact CG1-CB 4.02Å; V473-P481 HydrophobicContact CG1-CG 4.44Å; V474-P481 WeakPolarHBondContact O-CA 3.38Å; L475-P481 HydrophobicContact CD2-CB 4.24Å; L475-P481 HydrophobicContact CD2-CG 3.85Å; P481-V541 HydrophobicContact CB-CG1 4.14Å; P481-V541 HydrophobicContact CG-CG1 3.65Å; P481-L571 HydrophobicContact CG-CD1 3.86Å
482	L	95.3	Very high	92	Very high	22 Å²	22	46 Å²	46	12%	0.115	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-59.6	143.3	172.8	-63.3	-176.2	0	0	0	111.1	A412 D413 V474 D476 P496	A412-L482 HydrophobicContact CB-CD1 3.9Å; D413-L482 WeakPolarHBondContact O-CD1 2.91Å; V474-L482 HydrophobicContact CB-CD1 3.79Å; V474-L482 HydrophobicContact CB-CG 4.09Å; V474-L482 HydrophobicContact CG1-CD1 3.67Å; V474-L482 HydrophobicContact CG1-CG 3.98Å; V474-L482 PolarHBondContact O-N 3.04Å; D476-L482 HydrophobicContact CB-CD2 4.22Å; L482-P496 HydrophobicContact CD2-CB 3.78Å; L482-P496 HydrophobicContact CD2-CG 3.98Å
483	P	93.4	Very high	91.2	Very high	36 Å²	36	47.3 Å²	47.3	23%	0.234	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-68.9	162.9	-178.4	29.4	-34.8	0	0	0	111.9	E487 T488 A493 P496	P483-E487 HydrophobicContact CB-CB 4.22Å; P483-E487 HydrophobicContact CB-CG 4.46Å; P483-T488 WeakPolarHBondContact CG-OG1 3.17Å; P483-A493 HydrophobicContact CB-CB 3.92Å; P483-P496 HydrophobicContact CG-CG 3.94Å
484	E	91.9	Very high	90.5	Very high	75 Å²	75	58 Å²	58	35%	0.35	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66	156.1	173.3	-80.1	179.1	174.5	0	0	112	L486 E487 K598	E484-L486 PolarHBondContact O-N 3.24Å; E484-E487 HydrophobicContact CB-CB 4.09Å; E484-E487 WeakPolarHBondContact CB-OE2 3.45Å; E484-E487 PolarHBondContact N-OE2 3.43Å; E484-E487 WeakPolarHBondContact O-CB 3.18Å; E484-E487 PolarHBondContact O-N 3.17Å; E484-K598 VanDerWaalsContact CG-NZ 3.32Å; E484-K598 WeakPolarHBondContact OE1-CE 3.28Å; E484-K598 IonicContact OE1-NZ 3.09Å; E484-K598 PolarHBondContact OE1-NZ 3.4Å; E484-K598 IonicContact OE2-NZ 2.86Å; E484-K598 PolarHBondContact OE2-NZ 2.8Å
485	P	91.2	Very high	90	Very high	28 Å²	28	62.2 Å²	62.2	18%	0.182	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	133.6	174.6	-24.3	34.1	0	0	0	111.3	Y210 E487	Y210-P485 WeakPolarHBondContact CD2-O 3.4Å; P485-E487 PolarHBondContact O-N 3.36Å
486	L	91.3	Very high	89.8	Confident	28 Å²	28	63.9 Å²	63.9	15%	0.147	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	-1.3	-173.7	-56.3	172.4	0	0	0	116.7	Y210 S293 E294 E484 A489 H490	Y210-L486 HydrophobicContact CD2-CB 4.02Å; Y210-L486 HydrophobicContact CG-CB 4.18Å; S293-L486 WeakPolarHBondContact OG-CD1 3.33Å; E294-L486 HydrophobicContact CB-CD2 3.6Å; E294-L486 HydrophobicContact CB-CG 3.92Å; E294-L486 HydrophobicContact CG-CD2 3.66Å; E294-L486 HydrophobicContact CG-CG 4.49Å; E294-L486 PolarHBondContact OE2-N 2.9Å; E484-L486 PolarHBondContact O-N 3.24Å; L486-A489 HydrophobicContact CD2-CB 4.38Å; L486-A489 PolarHBondContact O-N 3.32Å; L486-H490 PolarHBondContact O-N 2.82Å; L486-H490 PolarHBondContact O-ND1 2.89Å
487	E	89.4	Confident	89.6	Confident	28 Å²	28	64.8 Å²	64.8	13%	0.131	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-41.8	-177.6	-174.6	168.1	-143	0	0	111.8	Y210 P483 E484 P485 H490 L492 A493 K598	Y210-E487 HydrophobicContact CE2-CB 3.84Å; Y210-E487 HydrophobicContact CE2-CG 4.41Å; Y210-E487 VanDerWaalsContact OH-CG 3.31Å; Y210-E487 WeakPolarHBondContact OH-CG 3.18Å; P483-E487 HydrophobicContact CB-CB 4.22Å; P483-E487 HydrophobicContact CB-CG 4.46Å; E484-E487 HydrophobicContact CB-CB 4.09Å; E484-E487 WeakPolarHBondContact CB-OE2 3.45Å; E484-E487 PolarHBondContact N-OE2 3.43Å; E484-E487 WeakPolarHBondContact O-CB 3.18Å; E484-E487 PolarHBondContact O-N 3.17Å; P485-E487 PolarHBondContact O-N 3.36Å; E487-H490 PolarHBondContact O-N 3.42Å; E487-L492 HydrophobicContact CG-CB 4.24Å; E487-L492 PolarHBondContact O-N 3.01Å; E487-A493 HydrophobicContact CG-CB 3.66Å; E487-K598 IonicContact OE1-NZ 3.99Å; E487-K598 PolarHBondContact OE1-NZ 3.2Å; E487-K598 IonicContact OE2-NZ 2.67Å
488	T	88.1	Confident	89.4	Confident	46 Å²	46	67.1 Å²	67.1	28%	0.282	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-67.9	-37.9	173.2	-46.7	0	0	0	0	111.9	P483 H490 D491	P483-T488 WeakPolarHBondContact CG-OG1 3.17Å; T488-H490 PolarHBondContact O-N 3.38Å; T488-D491 PolarHBondContact O-N 2.88Å
489	A	87.7	Confident	89.1	Confident	69 Å²	69	68 Å²	68	57%	0.57	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-66.3	-17.3	179.8	0	0	0	0	0	113.4	L486	L486-A489 HydrophobicContact CD2-CB 4.38Å; L486-A489 PolarHBondContact O-N 3.32Å
490	H	87.1	Confident	88.9	Confident	92 Å²	92	68.8 Å²	68.8	43%	0.426	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-101.4	10.6	174.1	-69.3	73.5	0	0	0	112.7	Y210 L486 E487 T488 L492	Y210-H490 HydrophobicContact CD1-CB 4.45Å; Y210-H490 AromaticContact CD1-CG 3.99Å; L486-H490 PolarHBondContact O-N 2.82Å; L486-H490 PolarHBondContact O-ND1 2.89Å; E487-H490 PolarHBondContact O-N 3.42Å; T488-H490 PolarHBondContact O-N 3.38Å; H490-L492 HydrophobicContact CB-CD1 4Å; H490-L492 HydrophobicContact CB-CG 4.24Å; H490-L492 PolarHBondContact O-N 2.87Å
491	D	82.8	Confident	88.8	Confident	154 Å²	154	69.8 Å²	69.8	82%	0.824	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	27.8	-178.2	-61.7	-44	0	0	0	114.4	T488	T488-D491 PolarHBondContact O-N 2.88Å
492	L	80.6	Confident	88.8	Confident	111 Å²	111	68.7 Å²	68.7	58%	0.581	38%	0.379	S	S	*	.	S	Bend	trans	-97.6	-13.4	-178.3	-69.8	169.5	0	0	0	113.6	Y210 E487 H490	Y210-L492 HydrophobicContact CD1-CD1 4.38Å; Y210-L492 HydrophobicContact CE1-CD1 3.45Å; Y210-L492 VanDerWaalsContact CE1-CD1 3.45Å; E487-L492 HydrophobicContact CG-CB 4.24Å; E487-L492 PolarHBondContact O-N 3.01Å; H490-L492 HydrophobicContact CB-CD1 4Å; H490-L492 HydrophobicContact CB-CG 4.24Å; H490-L492 PolarHBondContact O-N 2.87Å
493	A	81.2	Confident	88.9	Confident	33 Å²	33	68.4 Å²	68.4	27%	0.273	38%	0.377	S	S	.	.	S	Bend	trans	-132.1	156.6	170.1	0	0	0	0	0	110.5	P483 E487	P483-A493 HydrophobicContact CB-CB 3.92Å; E487-A493 HydrophobicContact CG-CB 3.66Å
494	R	83.6	Confident	89.1	Confident	236 Å²	236	66.7 Å²	66.7	89%	0.891	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-66.9	142.7	170.5	-65.5	-178.3	-178.8	177.8	1.1	109.2
495	S	88.1	Confident	89.4	Confident	89 Å²	89	63.1 Å²	63.1	62%	0.622	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-57.3	138.5	170.1	50.7	0	0	0	0	109.8	D497	S495-D497 PolarHBondContact O-N 2.99Å
496	P	91.1	Very high	89.7	Confident	36 Å²	36	61.9 Å²	61.9	23%	0.234	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-56.9	139.4	176.9	-25	34	0	0	0	111.5	D476 L482 P483 L498	D476-P496 HydrophobicContact CB-CB 4.2Å; L482-P496 HydrophobicContact CD2-CB 3.78Å; L482-P496 HydrophobicContact CD2-CG 3.98Å; P483-P496 HydrophobicContact CG-CG 3.94Å; P496-L498 HydrophobicContact CB-CD2 4.37Å; P496-L498 PolarHBondContact O-N 3.32Å; P496-L498 VanDerWaalsContact O-N 3.11Å
497	D	91.2	Very high	90.1	Very high	29 Å²	29	60.5 Å²	60.5	16%	0.155	33%	0.334	C	S	.	.			trans	-70.8	108.1	171.2	175.2	34.4	0	0	0	110.5	D476 G477 H478 S495 L499 G500 H502	D476-D497 PolarHBondContact OD2-N 2.86Å; G477-D497 VanDerWaalsContact CA-OD2 3.27Å; G477-D497 WeakPolarHBondContact CA-OD2 3.38Å; G477-D497 PolarHBondContact N-O 3.44Å; G477-D497 VanDerWaalsContact N-O 3.14Å; H478-D497 VanDerWaalsContact CD2-CB 3.49Å; H478-D497 WeakPolarHBondContact CD2-CB 3.46Å; S495-D497 PolarHBondContact O-N 2.99Å; D497-L499 WeakPolarHBondContact OD1-CB 3.31Å; D497-L499 PolarHBondContact OD1-N 2.85Å; D497-G500 PolarHBondContact OD2-N 2.88Å; D497-G500 VanDerWaalsContact OD2-N 3.16Å; D497-H502 PolarHBondContact O-CD2 2.9Å; D497-H502 PolarHBondContact O-NE2 2.84Å
498	L	89.1	Confident	90.5	Very high	76 Å²	76	59.2 Å²	59.2	40%	0.398	33%	0.328	S	S	.	.			trans	-90.3	-10.1	177.4	-57	-178	0	0	0	113	F415 P496	F415-L498 HydrophobicContact CZ-CB 4.33Å; F415-L498 WeakPolarHBondContact CZ-O 3.41Å; P496-L498 HydrophobicContact CB-CD2 4.37Å; P496-L498 PolarHBondContact O-N 3.32Å; P496-L498 VanDerWaalsContact O-N 3.11Å
499	L	87.1	Confident	90.9	Very high	173 Å²	173	57.5 Å²	57.5	91%	0.906	32%	0.317	S	S	*	.	S	Bend	trans	-79.7	-36.4	-179.9	-63.8	172.5	0	0	0	111.4	D497	D497-L499 WeakPolarHBondContact OD1-CB 3.31Å; D497-L499 PolarHBondContact OD1-N 2.85Å
500	G	87	Confident	91.3	Very high	22 Å²	22	54.6 Å²	54.6	23%	0.227	29%	0.292	C	S	.	.	S	Bend	trans	-79.3	163.9	175.3	0	0	0	0	0	113.8	D497 H502	D497-G500 PolarHBondContact OD2-N 2.88Å; D497-G500 VanDerWaalsContact OD2-N 3.16Å; G500-H502 PolarHBondContact O-N 2.92Å
501	S	91.1	Very high	91.7	Very high	59 Å²	59	51.2 Å²	51.2	41%	0.413	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-76.1	121.7	178.2	-177.4	0	0	0	0	111	T516 L517	S501-T516 WeakPolarHBondContact OG-CG2 3.27Å; S501-L517 PolarHBondContact OG-O 2.82Å
502	H	96.6	Very high	92.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-71	156.3	175.4	-70.9	-158.8	0	0	0	112.3	T414 F415 L475 D497 G500 L517	T414-H502 PolarHBondContact OG1-ND1 3.35Å; F415-H502 HydrophobicContact CD2-CB 4.04Å; F415-H502 AromaticContact CD2-CD2 3.94Å; F415-H502 AromaticContact CD2-CG 3.7Å; F415-H502 AromaticContact CD2-ND1 3.93Å; F415-H502 AromaticContact CE2-CD2 3.6Å; F415-H502 AromaticContact CE2-CE1 3.92Å; F415-H502 AromaticContact CE2-CG 3.82Å; F415-H502 AromaticContact CE2-NE2 3.67Å; L475-H502 CarbonylContact O-C 3.46Å; L475-H502 VanDerWaalsContact O-CA 3.28Å; L475-H502 WeakPolarHBondContact O-CA 3.32Å; L475-H502 WeakPolarHBondContact O-CB 3.38Å; D497-H502 PolarHBondContact O-CD2 2.9Å; D497-H502 PolarHBondContact O-NE2 2.84Å; G500-H502 PolarHBondContact O-N 2.92Å; H502-L517 HydrophobicContact CB-CB 4.31Å; H502-L517 HydrophobicContact CB-CD1 4.1Å; H502-L517 WeakPolarHBondContact O-CB 3.2Å; H502-L517 PolarHBondContact O-N 2.75Å
503	H	97	Very high	93.2	Very high	17 Å²	17	40.5 Å²	40.5	8%	0.079	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.7	179	-61	-49.3	0	0	0	111.3	V474 L475 V514 F515 K523	V474-H503 CarbonylContact C-O 3.54Å; V474-H503 WeakPolarHBondContact CA-O 3.31Å; L475-H503 HydrophobicContact CB-CB 4.32Å; L475-H503 PolarHBondContact N-O 3.44Å; L475-H503 PolarHBondContact O-N 2.84Å; H503-V514 HydrophobicContact CB-CG1 3.8Å; H503-F515 CarbonylContact C-O 3.43Å; H503-F515 VanDerWaalsContact CA-O 3.23Å; H503-F515 WeakPolarHBondContact CA-O 3.3Å; H503-K523 PolarHBondContact CE1-NZ 2.78Å; H503-K523 VanDerWaalsContact CE1-NZ 3.31Å; H503-K523 PolarHBondContact NE2-NZ 2.81Å
504	V	98	Very high	94	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.1	168.6	62.3	0	0	0	0	109.8	W427 I472 V474 V506 V514 F515 L517 L520	W427-V504 HydrophobicContact CE3-CG2 4.27Å; W427-V504 HydrophobicContact CH2-CB 4.37Å; W427-V504 HydrophobicContact CH2-CG1 4.21Å; W427-V504 HydrophobicContact CH2-CG2 4.31Å; W427-V504 HydrophobicContact CZ3-CG1 4.3Å; W427-V504 HydrophobicContact CZ3-CG2 4.07Å; I472-V504 HydrophobicContact CG2-CG2 3.93Å; V474-V504 HydrophobicContact CG2-CB 4.34Å; V474-V504 HydrophobicContact CG2-CG2 4.19Å; V504-V506 HydrophobicContact CG2-CG2 4.26Å; V504-V514 CarbonylContact O-C 3.56Å; V504-V514 WeakPolarHBondContact O-CA 3.39Å; V504-F515 HydrophobicContact CG1-CB 3.79Å; V504-F515 HydrophobicContact CG1-CD2 4.22Å; V504-F515 HydrophobicContact CG1-CG 4.44Å; V504-F515 PolarHBondContact N-O 3.32Å; V504-F515 PolarHBondContact O-N 2.84Å; V504-L517 HydrophobicContact CB-CD1 4.24Å; V504-L517 HydrophobicContact CB-CD2 4.37Å; V504-L517 HydrophobicContact CB-CG 4.37Å; V504-L517 HydrophobicContact CG1-CD2 3.92Å; V504-L517 HydrophobicContact CG1-CG 4.25Å; V504-L520 HydrophobicContact CG1-CD2 3.63Å
505	L	98.3	Very high	94.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	111.6	171.6	171.4	59.2	0	0	0	108.9	I472 V473 I507 F512 V514 L557 L571 I574	I472-L505 WeakPolarHBondContact CA-O 3.39Å; V473-L505 HydrophobicContact CB-CB 4.46Å; V473-L505 PolarHBondContact N-O 2.75Å; V473-L505 PolarHBondContact O-N 2.94Å; L505-I507 HydrophobicContact CD1-CG1 4.16Å; L505-I507 HydrophobicContact CD2-CD1 4.14Å; L505-I507 HydrophobicContact CD2-CG1 4.25Å; L505-I507 HydrophobicContact CG-CD1 4.12Å; L505-I507 HydrophobicContact CG-CG1 3.8Å; L505-F512 HydrophobicContact CD1-CB 4.27Å; L505-V514 HydrophobicContact CB-CG2 4.4Å; L505-V514 HydrophobicContact CD1-CG2 3.72Å; L505-L557 HydrophobicContact CD2-CD1 4.42Å; L505-L557 HydrophobicContact CD2-CD2 4.15Å; L505-L571 HydrophobicContact CD2-CD2 3.79Å; L505-I574 HydrophobicContact CD1-CG2 4.09Å; L505-I574 HydrophobicContact CD2-CG2 4.49Å
506	V	98.3	Very high	95.1	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.5	173.7	-178.5	0	0	0	0	109	V435 L463 V469 V504 K513 F515	V435-V506 HydrophobicContact CG2-CG1 3.77Å; V435-V506 HydrophobicContact CG2-CG2 4.35Å; L463-V506 HydrophobicContact CD1-CG1 4.01Å; L463-V506 HydrophobicContact CD2-CG1 4.31Å; V469-V506 HydrophobicContact CG1-CG1 4.15Å; V469-V506 HydrophobicContact CG2-CG1 4.44Å; V504-V506 HydrophobicContact CG2-CG2 4.26Å; V506-K513 PolarHBondContact N-O 3Å; V506-K513 PolarHBondContact O-N 3.42Å; V506-F515 HydrophobicContact CB-CE2 4.08Å; V506-F515 HydrophobicContact CG2-CD2 4.04Å; V506-F515 HydrophobicContact CG2-CE2 3.78Å
507	I	98.4	Very high	95.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117	-173.2	-51.7	159.8	0	0	0	107.1	V469 V470 G471 V473 L505 F512 V536 V539 L557	V469-I507 CarbonylContact C-O 3.56Å; V470-I507 HydrophobicContact CG2-CB 4.26Å; V470-I507 HydrophobicContact CG2-CG2 3.69Å; V470-I507 WeakPolarHBondContact CG2-O 3.34Å; V470-I507 PolarHBondContact N-O 3.46Å; G471-I507 PolarHBondContact N-O 2.86Å; G471-I507 WeakPolarHBondContact O-CB 3.47Å; G471-I507 PolarHBondContact O-N 3.43Å; V473-I507 HydrophobicContact CG2-CD1 4.29Å; L505-I507 HydrophobicContact CD1-CG1 4.16Å; L505-I507 HydrophobicContact CD2-CD1 4.14Å; L505-I507 HydrophobicContact CD2-CG1 4.25Å; L505-I507 HydrophobicContact CG-CD1 4.12Å; L505-I507 HydrophobicContact CG-CG1 3.8Å; I507-F512 HydrophobicContact CB-CD1 4.38Å; I507-F512 HydrophobicContact CG1-CD1 4.07Å; I507-F512 HydrophobicContact CG2-CD1 3.69Å; I507-F512 HydrophobicContact CG2-CE1 3.54Å; I507-F512 HydrophobicContact CG2-CZ 4.38Å; I507-V536 HydrophobicContact CG2-CG1 4.44Å; I507-V539 HydrophobicContact CD1-CG1 4.33Å; I507-V539 HydrophobicContact CD1-CG2 3.92Å; I507-L557 HydrophobicContact CD1-CD1 3.82Å; I507-L557 HydrophobicContact CD1-CD2 3.91Å; I507-L557 HydrophobicContact CD1-CG 4.48Å; I507-L557 HydrophobicContact CG1-CD2 4.45Å
508	S	98	Very high	95.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	171.8	175	67.7	0	0	0	0	111.1	H465 P468 E510 Q511	H465-S508 PolarHBondContact CE1-OG 3.32Å; P468-S508 CarbonylContact O-C 3.54Å; P468-S508 WeakPolarHBondContact O-CA 3.46Å; P468-S508 WeakPolarHBondContact O-CB 3.37Å; S508-E510 PolarHBondContact O-N 3.13Å; S508-E510 PolarHBondContact OG-N 2.88Å; S508-Q511 PolarHBondContact N-O 2.94Å; S508-Q511 PolarHBondContact OG-N 2.89Å; S508-Q511 PolarHBondContact OG-O 3.12Å
509	E	96.8	Very high	95.7	Very high	10 Å²	10	28.2 Å²	28.2	5%	0.047	15%	0.149	C	C	.	.	S	Bend	trans	-55.7	-22	172.3	-71	-166.8	155.9	0	0	113	R396 P468 V470 R535 V536 R537	R396-E509 IonicContact CZ-OE2 2.76Å; R396-E509 IonicContact NH1-OE2 3.68Å; R396-E509 IonicContact NH2-OE2 3.23Å; R396-E509 PolarHBondContact NH2-OE2 3.33Å; P468-E509 HydrophobicContact CB-CG 4.06Å; P468-E509 HydrophobicContact CG-CG 4.17Å; P468-E509 PolarHBondContact O-N 2.99Å; V470-E509 HydrophobicContact CG1-CG 3.83Å; E509-R535 HydrophobicContact CB-CB 4.47Å; E509-R535 CarbonylContact O-C 3.51Å; E509-R535 WeakPolarHBondContact O-CA 3.21Å; E509-R535 WeakPolarHBondContact O-CB 3.5Å; E509-V536 PolarHBondContact O-N 2.82Å; E509-R537 IonicContact OE1-NH1 3.79Å; E509-R537 PolarHBondContact OE1-NH1 3.31Å; E509-R537 VanDerWaalsContact OE1-NH1 3.09Å
510	E	95.9	Very high	96	Very high	9 Å²	9	21.4 Å²	21.4	4%	0.042	11%	0.113	C	C	.	.	S	Bend	trans	-120.7	-24.8	-169.8	-62.6	175	-169.3	0	0	114.9	I393 R396 A467 S508 L528 T529	I393-E510 WeakPolarHBondContact CG2-OE2 3.36Å; R396-E510 IonicContact CZ-OE1 2.75Å; R396-E510 IonicContact NE-OE1 3.66Å; R396-E510 PolarHBondContact NE-OE1 3.33Å; R396-E510 IonicContact NH2-OE1 3.92Å; R396-E510 PolarHBondContact NH2-OE1 3.38Å; A467-E510 HydrophobicContact CB-CB 4.05Å; A467-E510 HydrophobicContact CB-CG 3.75Å; S508-E510 PolarHBondContact O-N 3.13Å; S508-E510 PolarHBondContact OG-N 2.88Å; E510-L528 PolarHBondContact O-N 2.86Å; E510-T529 VanDerWaalsContact CA-OG1 3.22Å; E510-T529 WeakPolarHBondContact CA-OG1 3.49Å; E510-T529 WeakPolarHBondContact CB-OG1 3.3Å; E510-T529 WeakPolarHBondContact CG-OG1 3.45Å; E510-T529 PolarHBondContact O-N 3.13Å
511	Q	95.6	Very high	96.3	Very high	20 Å²	20	23.2 Å²	23.2	9%	0.093	12%	0.122	C	C	.	.			trans	-145.1	148	-173.9	-52.1	-174.2	15.8	0	0	111.9	I393 H465 S508 L526 K527	I393-Q511 HydrophobicContact CD1-CG 3.96Å; H465-Q511 PolarHBondContact CD2-NE2 3.18Å; H465-Q511 VanDerWaalsContact CD2-NE2 3.25Å; H465-Q511 PolarHBondContact CD2-OE1 2.82Å; S508-Q511 PolarHBondContact N-O 2.94Å; S508-Q511 PolarHBondContact OG-N 2.89Å; S508-Q511 PolarHBondContact OG-O 3.12Å; Q511-L526 CarbonylContact C-O 3.43Å; Q511-L526 VanDerWaalsContact CA-O 3.24Å; Q511-L526 WeakPolarHBondContact CA-O 3.39Å; Q511-K527 HydrophobicContact CG-CB 4.5Å; Q511-K527 HydrophobicContact CG-CG 4.19Å
512	F	97.6	Very high	96.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.9	164.5	-55.4	-100.1	0	0	0	107.6	L505 I507 K525 L526 L528 V536 L557 F559 L569 I574	L505-F512 HydrophobicContact CD1-CB 4.27Å; I507-F512 HydrophobicContact CB-CD1 4.38Å; I507-F512 HydrophobicContact CG1-CD1 4.07Å; I507-F512 HydrophobicContact CG2-CD1 3.69Å; I507-F512 HydrophobicContact CG2-CE1 3.54Å; I507-F512 HydrophobicContact CG2-CZ 4.38Å; F512-K525 CarbonylContact O-C 3.58Å; F512-K525 WeakPolarHBondContact O-CA 3.43Å; F512-L526 HydrophobicContact CB-CB 4.24Å; F512-L526 HydrophobicContact CD2-CB 4.23Å; F512-L526 HydrophobicContact CD2-CD2 3.95Å; F512-L526 HydrophobicContact CD2-CG 4.25Å; F512-L526 HydrophobicContact CE2-CD2 4.36Å; F512-L526 PolarHBondContact N-O 2.92Å; F512-L526 PolarHBondContact O-N 3.4Å; F512-L528 HydrophobicContact CE2-CB 4.13Å; F512-L528 HydrophobicContact CE2-CD2 4.29Å; F512-V536 HydrophobicContact CE1-CG2 4.42Å; F512-V536 HydrophobicContact CE2-CG2 3.96Å; F512-V536 HydrophobicContact CZ-CG2 3.59Å; F512-L557 HydrophobicContact CD1-CD2 3.76Å; F512-L557 HydrophobicContact CE1-CD2 3.56Å; F512-F559 HydrophobicContact CE1-CD1 4.2Å; F512-F559 HydrophobicContact CE1-CE1 4.46Å; F512-F559 HydrophobicContact CE1-CG 4.44Å; F512-F559 HydrophobicContact CE2-CE1 4.37Å; F512-F559 HydrophobicContact CE2-CE2 4.47Å; F512-F559 HydrophobicContact CE2-CZ 4.18Å; F512-F559 AromaticContact CZ-CD1 3.78Å; F512-F559 HydrophobicContact CZ-CD1 3.78Å; F512-F559 HydrophobicContact CZ-CD2 4.05Å; F512-F559 AromaticContact CZ-CE1 3.75Å; F512-F559 HydrophobicContact CZ-CE1 3.75Å; F512-F559 HydrophobicContact CZ-CE2 4.02Å; F512-F559 AromaticContact CZ-CG 3.92Å; F512-F559 HydrophobicContact CZ-CG 3.92Å; F512-F559 AromaticContact CZ-CZ 3.85Å; F512-F559 HydrophobicContact CZ-CZ 3.85Å; F512-L569 HydrophobicContact CD1-CD1 3.69Å; F512-L569 HydrophobicContact CD2-CD1 4.11Å; F512-L569 HydrophobicContact CE1-CD1 3.44Å; F512-L569 VanDerWaalsContact CE1-CD1 3.44Å; F512-L569 HydrophobicContact CE2-CD1 3.87Å; F512-L569 HydrophobicContact CG-CD1 4.04Å; F512-L569 HydrophobicContact CZ-CD1 3.54Å; F512-I574 HydrophobicContact CB-CD1 4.39Å
513	K	97.5	Very high	96.4	Very high	41 Å²	41	28.8 Å²	28.8	18%	0.178	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.3	-178.4	-167.7	171.8	175.2	-165.8	0	110.7	L463 V506 F515 S522 K525	L463-K513 HydrophobicContact CD2-CD 4.42Å; V506-K513 PolarHBondContact N-O 3Å; V506-K513 PolarHBondContact O-N 3.42Å; K513-F515 HydrophobicContact CB-CE2 4.02Å; K513-F515 HydrophobicContact CB-CZ 4.4Å; K513-F515 HydrophobicContact CD-CE1 3.9Å; K513-F515 HydrophobicContact CD-CE2 3.82Å; K513-F515 HydrophobicContact CD-CZ 3.32Å; K513-F515 HydrophobicContact CG-CD2 4.3Å; K513-F515 HydrophobicContact CG-CE1 4.26Å; K513-F515 HydrophobicContact CG-CE2 3.68Å; K513-F515 HydrophobicContact CG-CZ 3.69Å; K513-S522 WeakPolarHBondContact CE-OG 3.38Å; K513-K525 HydrophobicContact CG-CB 4.34Å
514	V	97.8	Very high	96.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132.6	177.9	-177.7	0	0	0	0	109.1	H503 V504 L505 K523 M524 I574	H503-V514 HydrophobicContact CB-CG1 3.8Å; V504-V514 CarbonylContact O-C 3.56Å; V504-V514 WeakPolarHBondContact O-CA 3.39Å; L505-V514 HydrophobicContact CB-CG2 4.4Å; L505-V514 HydrophobicContact CD1-CG2 3.72Å; V514-K523 HydrophobicContact CG1-CB 4.49Å; V514-K523 PolarHBondContact O-N 2.82Å; V514-M524 HydrophobicContact CB-CG 3.46Å; V514-M524 VanDerWaalsContact CB-CG 3.46Å; V514-M524 HydrophobicContact CB-SD 4.33Å; V514-M524 HydrophobicContact CG1-CG 4.28Å; V514-M524 HydrophobicContact CG2-CG 3.52Å; V514-M524 HydrophobicContact CG2-SD 3.94Å; V514-M524 PolarHBondContact N-O 3.49Å; V514-M524 PolarHBondContact O-N 3.08Å; V514-I574 HydrophobicContact CG2-CD1 4.29Å; V514-I574 HydrophobicContact CG2-CG2 3.91Å
515	F	97.2	Very high	96.1	Very high	8 Å²	8	36 Å²	36	4%	0.035	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144.1	175.9	-55.5	-97	0	0	0	110.6	I461 L463 H503 V504 V506 K513 L520 S521	I461-F515 HydrophobicContact CG2-CE1 4.43Å; I461-F515 HydrophobicContact CG2-CZ 3.99Å; L463-F515 HydrophobicContact CD2-CZ 4.36Å; H503-F515 CarbonylContact C-O 3.43Å; H503-F515 VanDerWaalsContact CA-O 3.23Å; H503-F515 WeakPolarHBondContact CA-O 3.3Å; V504-F515 HydrophobicContact CG1-CB 3.79Å; V504-F515 HydrophobicContact CG1-CD2 4.22Å; V504-F515 HydrophobicContact CG1-CG 4.44Å; V504-F515 PolarHBondContact N-O 3.32Å; V504-F515 PolarHBondContact O-N 2.84Å; V506-F515 HydrophobicContact CB-CE2 4.08Å; V506-F515 HydrophobicContact CG2-CD2 4.04Å; V506-F515 HydrophobicContact CG2-CE2 3.78Å; K513-F515 HydrophobicContact CB-CE2 4.02Å; K513-F515 HydrophobicContact CB-CZ 4.4Å; K513-F515 HydrophobicContact CD-CE1 3.9Å; K513-F515 HydrophobicContact CD-CE2 3.82Å; K513-F515 HydrophobicContact CD-CZ 3.32Å; K513-F515 HydrophobicContact CG-CD2 4.3Å; K513-F515 HydrophobicContact CG-CE1 4.26Å; K513-F515 HydrophobicContact CG-CE2 3.68Å; K513-F515 HydrophobicContact CG-CZ 3.69Å; F515-L520 HydrophobicContact CB-CD2 4.09Å; F515-L520 WeakPolarHBondContact CD1-O 3.4Å; F515-S521 CarbonylContact C-O 3.58Å; F515-S521 VanDerWaalsContact CA-O 3.26Å; F515-S521 WeakPolarHBondContact CA-O 3.42Å
516	T	96.9	Very high	95.9	Very high	30 Å²	30	37.6 Å²	37.6	18%	0.184	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	126.3	174.6	-53.5	0	0	0	0	110.7	S501 L520 S521	S501-T516 WeakPolarHBondContact OG-CG2 3.27Å; T516-L520 VanDerWaalsContact O-CA 3.27Å; T516-L520 WeakPolarHBondContact O-CA 3.36Å; T516-L520 PolarHBondContact O-N 3.46Å; T516-S521 PolarHBondContact N-O 2.97Å; T516-S521 PolarHBondContact O-N 3.21Å
517	L	96.4	Very high	95.7	Very high	6 Å²	6	41 Å²	41	3%	0.031	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	151.4	177.2	-66.7	174.8	0	0	0	111.4	T414 W427 V474 S501 H502 V504 L520	T414-L517 HydrophobicContact CG2-CD1 4.11Å; T414-L517 WeakPolarHBondContact OG1-CD1 3.14Å; W427-L517 HydrophobicContact CH2-CD2 3.84Å; W427-L517 HydrophobicContact CZ2-CD2 4.21Å; V474-L517 HydrophobicContact CG1-CD1 4.19Å; S501-L517 PolarHBondContact OG-O 2.82Å; H502-L517 HydrophobicContact CB-CB 4.31Å; H502-L517 HydrophobicContact CB-CD1 4.1Å; H502-L517 WeakPolarHBondContact O-CB 3.2Å; H502-L517 PolarHBondContact O-N 2.75Å; V504-L517 HydrophobicContact CB-CD1 4.24Å; V504-L517 HydrophobicContact CB-CD2 4.37Å; V504-L517 HydrophobicContact CB-CG 4.37Å; V504-L517 HydrophobicContact CG1-CD2 3.92Å; V504-L517 HydrophobicContact CG1-CG 4.25Å; L517-L520 HydrophobicContact CD2-CD2 3.54Å; L517-L520 HydrophobicContact CD2-CG 4.28Å
518	P	94.3	Very high	95.5	Very high	15 Å²	15	41.2 Å²	41.2	10%	0.097	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.7	-9.8	-2.4	35.2	-39.7	0	0	0	113.8	F415 L520	F415-P518 HydrophobicContact CB-CB 4.37Å; P518-L520 PolarHBondContact O-N 2.82Å
519	K	93.1	Very high	95.2	Very high	182 Å²	182	42.3 Å²	42.3	79%	0.791	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-15.2	-170.3	-66.1	-178	-178.3	176.1	0	114.4	S521	K519-S521 PolarHBondContact O-N 3.06Å
520	L	93.7	Very high	94.7	Very high	29 Å²	29	41.9 Å²	41.9	15%	0.152	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	36.2	-173.7	-64.9	170.8	0	0	0	113.3	W427 K459 I461 V504 F515 T516 L517 P518	W427-L520 HydrophobicContact CH2-CD2 4.25Å; K459-L520 HydrophobicContact CB-CD1 3.66Å; K459-L520 HydrophobicContact CD-CD1 3.78Å; K459-L520 HydrophobicContact CG-CD1 3.57Å; I461-L520 HydrophobicContact CD1-CD1 3.65Å; I461-L520 HydrophobicContact CD1-CD2 3.68Å; I461-L520 HydrophobicContact CD1-CG 4.23Å; I461-L520 HydrophobicContact CG1-CD1 3.76Å; V504-L520 HydrophobicContact CG1-CD2 3.63Å; F515-L520 HydrophobicContact CB-CD2 4.09Å; F515-L520 WeakPolarHBondContact CD1-O 3.4Å; T516-L520 VanDerWaalsContact O-CA 3.27Å; T516-L520 WeakPolarHBondContact O-CA 3.36Å; T516-L520 PolarHBondContact O-N 3.46Å; L517-L520 HydrophobicContact CD2-CD2 3.54Å; L517-L520 HydrophobicContact CD2-CG 4.28Å; P518-L520 PolarHBondContact O-N 2.82Å
521	S	94.3	Very high	94.2	Very high	60 Å²	60	45.7 Å²	45.7	42%	0.42	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.5	173.3	61.6	0	0	0	0	109.9	F515 T516 K519 K523	F515-S521 CarbonylContact C-O 3.58Å; F515-S521 VanDerWaalsContact CA-O 3.26Å; F515-S521 WeakPolarHBondContact CA-O 3.42Å; T516-S521 PolarHBondContact N-O 2.97Å; T516-S521 PolarHBondContact O-N 3.21Å; K519-S521 PolarHBondContact O-N 3.06Å; S521-K523 PolarHBondContact O-N 3.33Å
522	S	94.2	Very high	93.5	Very high	69 Å²	69	47.3 Å²	47.3	48%	0.483	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	118.6	-179.1	-177.8	0	0	0	0	110.2	K513	K513-S522 WeakPolarHBondContact CE-OG 3.38Å
523	K	94.3	Very high	93.1	Very high	108 Å²	108	48.3 Å²	48.3	47%	0.47	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-49.4	-179.7	-175.5	172.6	176.8	176.2	0	112.2	H503 V514 S521	H503-K523 PolarHBondContact CE1-NZ 2.78Å; H503-K523 VanDerWaalsContact CE1-NZ 3.31Å; H503-K523 PolarHBondContact NE2-NZ 2.81Å; V514-K523 HydrophobicContact CG1-CB 4.49Å; V514-K523 PolarHBondContact O-N 2.82Å; S521-K523 PolarHBondContact O-N 3.33Å
524	M	94.5	Very high	93	Very high	39 Å²	39	46.5 Å²	46.5	19%	0.192	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.7	-178.2	54.4	-177.2	96.3	0	0	111.4	V514 P572 H573 I574	V514-M524 HydrophobicContact CB-CG 3.46Å; V514-M524 VanDerWaalsContact CB-CG 3.46Å; V514-M524 HydrophobicContact CB-SD 4.33Å; V514-M524 HydrophobicContact CG1-CG 4.28Å; V514-M524 HydrophobicContact CG2-CG 3.52Å; V514-M524 HydrophobicContact CG2-SD 3.94Å; V514-M524 PolarHBondContact N-O 3.49Å; V514-M524 PolarHBondContact O-N 3.08Å; M524-P572 WeakPolarHBondContact CE-O 3.33Å; M524-H573 VanDerWaalsContact SD-C 3.59Å; M524-I574 HydrophobicContact CB-CD1 4.12Å; M524-I574 HydrophobicContact CB-CG1 4.49Å; M524-I574 HydrophobicContact CG-CD1 3.77Å; M524-I574 HydrophobicContact CG-CG1 4.01Å; M524-I574 HydrophobicContact SD-CD1 4.1Å; M524-I574 HydrophobicContact SD-CG1 3.64Å
525	K	94.9	Very high	92.9	Very high	128 Å²	128	51 Å²	51	56%	0.557	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.3	141.3	176.4	69.3	-171.5	177	-165.9	0	111.4	F512 K513	F512-K525 CarbonylContact O-C 3.58Å; F512-K525 WeakPolarHBondContact O-CA 3.43Å; K513-K525 HydrophobicContact CG-CB 4.34Å
526	L	94.6	Very high	92.9	Very high	35 Å²	35	50.6 Å²	50.6	18%	0.183	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.7	169.9	175.7	66.7	0	0	0	108.5	Q511 F512 L569 I574 M576	Q511-L526 CarbonylContact C-O 3.43Å; Q511-L526 VanDerWaalsContact CA-O 3.24Å; Q511-L526 WeakPolarHBondContact CA-O 3.39Å; F512-L526 HydrophobicContact CB-CB 4.24Å; F512-L526 HydrophobicContact CD2-CB 4.23Å; F512-L526 HydrophobicContact CD2-CD2 3.95Å; F512-L526 HydrophobicContact CD2-CG 4.25Å; F512-L526 HydrophobicContact CE2-CD2 4.36Å; F512-L526 PolarHBondContact N-O 2.92Å; F512-L526 PolarHBondContact O-N 3.4Å; L526-L569 HydrophobicContact CD2-CD1 4.32Å; L526-L569 HydrophobicContact CD2-CD2 3.63Å; L526-I574 HydrophobicContact CB-CD1 4Å; L526-M576 HydrophobicContact CD2-CG 4.04Å; L526-M576 HydrophobicContact CD2-SD 3.83Å
527	K	94.6	Very high	92.9	Very high	71 Å²	71	54.1 Å²	54.1	31%	0.309	27%	0.27	S	S	.	.			trans	-99.3	79.7	-178.1	-67	-178.5	177.2	178.8	0	110.8	I393 Q511 T529 A530 V531	I393-K527 HydrophobicContact CD1-CB 3.81Å; I393-K527 HydrophobicContact CD1-CD 4.27Å; I393-K527 HydrophobicContact CD1-CG 4.15Å; Q511-K527 HydrophobicContact CG-CB 4.5Å; Q511-K527 HydrophobicContact CG-CG 4.19Å; K527-T529 PolarHBondContact O-N 3.29Å; K527-A530 HydrophobicContact CB-CB 3.67Å; K527-A530 HydrophobicContact CD-CB 4.32Å; K527-A530 WeakPolarHBondContact O-CB 3.35Å; K527-A530 PolarHBondContact O-N 2.86Å; K527-A530 VanDerWaalsContact O-N 3.1Å; K527-V531 WeakPolarHBondContact O-CG2 3.16Å; K527-V531 PolarHBondContact O-N 3.45Å
528	L	92.9	Very high	92.8	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-52.4	-54.9	-175.1	-176.6	69.2	0	0	0	112.4	E510 F512 A530 V531 D532 V536 F559 T561	E510-L528 PolarHBondContact O-N 2.86Å; F512-L528 HydrophobicContact CE2-CB 4.13Å; F512-L528 HydrophobicContact CE2-CD2 4.29Å; L528-A530 PolarHBondContact O-N 2.93Å; L528-A530 VanDerWaalsContact O-N 3.12Å; L528-V531 WeakPolarHBondContact O-CB 3.08Å; L528-V531 PolarHBondContact O-N 3.11Å; L528-D532 PolarHBondContact O-N 3.49Å; L528-V536 HydrophobicContact CD2-CG2 3.59Å; L528-F559 HydrophobicContact CD1-CE2 4.2Å; L528-F559 HydrophobicContact CD1-CZ 4.14Å; L528-F559 HydrophobicContact CD2-CE2 3.7Å; L528-F559 HydrophobicContact CD2-CZ 4.34Å; L528-T561 HydrophobicContact CD2-CG2 4.35Å
529	T	91.3	Very high	93	Very high	22 Å²	22	60 Å²	60	14%	0.135	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-26.5	-177.6	-46.6	0	0	0	0	113	E510 K527 V531 G533 S534	E510-T529 VanDerWaalsContact CA-OG1 3.22Å; E510-T529 WeakPolarHBondContact CA-OG1 3.49Å; E510-T529 WeakPolarHBondContact CB-OG1 3.3Å; E510-T529 WeakPolarHBondContact CG-OG1 3.45Å; E510-T529 PolarHBondContact O-N 3.13Å; K527-T529 PolarHBondContact O-N 3.29Å; T529-V531 VanDerWaalsContact C-N 3.34Å; T529-G533 VanDerWaalsContact O-CA 3.23Å; T529-G533 WeakPolarHBondContact O-CA 3.41Å; T529-G533 PolarHBondContact O-N 3.48Å; T529-G533 VanDerWaalsContact O-N 3.08Å; T529-S534 WeakPolarHBondContact CA-O 3.35Å; T529-S534 PolarHBondContact N-O 3.47Å; T529-S534 PolarHBondContact OG1-O 3.17Å; T529-S534 VanDerWaalsContact OG1-O 3.09Å
530	A	88.1	Confident	93.1	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-71.8	-32.2	175.8	0	0	0	0	0	112.1	Q390 R391 I393 K527 L528	Q390-A530 WeakPolarHBondContact CA-O 3.44Å; Q390-A530 HydrophobicContact CB-CB 4.44Å; R391-A530 PolarHBondContact N-O 3.06Å; R391-A530 WeakPolarHBondContact O-CB 3.12Å; I393-A530 HydrophobicContact CD1-CB 3.88Å; I393-A530 HydrophobicContact CG1-CB 3.99Å; K527-A530 HydrophobicContact CB-CB 3.67Å; K527-A530 HydrophobicContact CD-CB 4.32Å; K527-A530 WeakPolarHBondContact O-CB 3.35Å; K527-A530 PolarHBondContact O-N 2.86Å; K527-A530 VanDerWaalsContact O-N 3.1Å; L528-A530 PolarHBondContact O-N 2.93Å; L528-A530 VanDerWaalsContact O-N 3.12Å
531	V	83.6	Confident	93.3	Very high	90 Å²	90	53.1 Å²	53.1	55%	0.545	27%	0.272	S	S	.	.	H	α-helix	trans	-78	-53	-175	175.3	0	0	0	0	110.9	K527 L528 T529	K527-V531 WeakPolarHBondContact O-CG2 3.16Å; K527-V531 PolarHBondContact O-N 3.45Å; L528-V531 WeakPolarHBondContact O-CB 3.08Å; L528-V531 PolarHBondContact O-N 3.11Å; T529-V531 VanDerWaalsContact C-N 3.34Å
532	D	82.8	Confident	93.4	Very high	54 Å²	54	50.3 Å²	50.3	29%	0.289	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-0.8	-174	70.7	-9.1	0	0	0	114.4	L528 S534 R579	L528-D532 PolarHBondContact O-N 3.49Å; D532-S534 VanDerWaalsContact C-N 3.28Å; D532-S534 WeakPolarHBondContact OD1-CB 3.39Å; D532-S534 PolarHBondContact OD1-N 3.36Å; D532-S534 PolarHBondContact OD1-OG 3.19Å; D532-S534 VanDerWaalsContact OD1-OG 3.08Å; D532-S534 PolarHBondContact OD2-OG 3.44Å; D532-R579 IonicContact OD2-NH1 2.74Å
533	G	88.9	Confident	93.4	Very high	21 Å²	21	51.3 Å²	51.3	22%	0.216	25%	0.246	C	C	.	.	S	Bend	trans	80	3.7	-177.1	0	0	0	0	0	114.8	T529	T529-G533 VanDerWaalsContact O-CA 3.23Å; T529-G533 WeakPolarHBondContact O-CA 3.41Å; T529-G533 PolarHBondContact O-N 3.48Å; T529-G533 VanDerWaalsContact O-N 3.08Å
534	S	93.9	Very high	93.4	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.021	23%	0.232	C	C	.	.			trans	-74.6	148.7	176.2	-59.7	0	0	0	0	111.4	T529 D532	T529-S534 WeakPolarHBondContact CA-O 3.35Å; T529-S534 PolarHBondContact N-O 3.47Å; T529-S534 PolarHBondContact OG1-O 3.17Å; T529-S534 VanDerWaalsContact OG1-O 3.09Å; D532-S534 VanDerWaalsContact C-N 3.28Å; D532-S534 WeakPolarHBondContact OD1-CB 3.39Å; D532-S534 PolarHBondContact OD1-N 3.36Å; D532-S534 PolarHBondContact OD1-OG 3.19Å; D532-S534 VanDerWaalsContact OD1-OG 3.08Å; D532-S534 PolarHBondContact OD2-OG 3.44Å
535	R	96.3	Very high	93.3	Very high	94 Å²	94	46.4 Å²	46.4	36%	0.355	23%	0.225	S	C	.	.			trans	-122.6	138.4	176.4	-63	-176.2	-175.9	-165	-1.6	111.1	E509 T561 N562	E509-R535 HydrophobicContact CB-CB 4.47Å; E509-R535 CarbonylContact O-C 3.51Å; E509-R535 WeakPolarHBondContact O-CA 3.21Å; E509-R535 WeakPolarHBondContact O-CB 3.5Å; R535-T561 CarbonylContact O-C 3.47Å; R535-T561 WeakPolarHBondContact O-CA 3.34Å; R535-N562 HydrophobicContact CB-CB 4.36Å; R535-N562 PolarHBondContact N-OD1 3.18Å; R535-N562 PolarHBondContact O-N 3.01Å; R535-N562 PolarHBondContact O-OD1 3.42Å
536	V	97.8	Very high	93.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	134	178.6	-171.6	0	0	0	0	110.4	V470 I507 E509 F512 L528 F559	V470-V536 HydrophobicContact CG2-CB 4.17Å; V470-V536 HydrophobicContact CG2-CG1 3.79Å; I507-V536 HydrophobicContact CG2-CG1 4.44Å; E509-V536 PolarHBondContact O-N 2.82Å; F512-V536 HydrophobicContact CE1-CG2 4.42Å; F512-V536 HydrophobicContact CE2-CG2 3.96Å; F512-V536 HydrophobicContact CZ-CG2 3.59Å; L528-V536 HydrophobicContact CD2-CG2 3.59Å; V536-F559 HydrophobicContact CG1-CB 4.08Å; V536-F559 HydrophobicContact CG1-CD2 4.23Å; V536-F559 HydrophobicContact CG1-CG 4.5Å; V536-F559 HydrophobicContact CG2-CD2 4.07Å; V536-F559 HydrophobicContact CG2-CE2 4.38Å
537	R	96.6	Very high	93	Very high	104 Å²	104	44.2 Å²	44.2	39%	0.392	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-46.3	177.7	-72.1	-59.1	-165.6	-165.3	3.8	113.3	E509 L560 N562 I591	E509-R537 IonicContact OE1-NH1 3.79Å; E509-R537 PolarHBondContact OE1-NH1 3.31Å; E509-R537 VanDerWaalsContact OE1-NH1 3.09Å; R537-L560 PolarHBondContact N-O 2.84Å; R537-N562 HydrophobicContact CG-CB 3.92Å; R537-I591 HydrophobicContact CB-CG2 4.08Å; R537-I591 HydrophobicContact CG-CG2 3.92Å
538	R	95.1	Very high	92.9	Very high	106 Å²	106	51.9 Å²	51.9	40%	0.4	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.8	177.9	-63.8	-65.7	-171.6	159.3	1.9	108.7	F559 L560 A592 F596	R538-F559 CarbonylContact O-C 3.52Å; R538-F559 VanDerWaalsContact O-CA 3.23Å; R538-F559 WeakPolarHBondContact O-CA 3.16Å; R538-F559 WeakPolarHBondContact O-CB 3.49Å; R538-L560 HydrophobicContact CB-CB 4.18Å; R538-L560 PolarHBondContact N-O 2.78Å; R538-L560 PolarHBondContact O-N 2.75Å; R538-A592 PolarHBondContact NE-O 3.23Å; R538-A592 PolarHBondContact NH2-O 2.86Å; R538-F596 HydrophobicContact CB-CE2 4.06Å
539	V	97.2	Very high	92.8	Very high	38 Å²	38	55.4 Å²	55.4	23%	0.23	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.1	177.9	67.2	0	0	0	0	109.7	I507 L557 V558 F559	I507-V539 HydrophobicContact CD1-CG1 4.33Å; I507-V539 HydrophobicContact CD1-CG2 3.92Å; V539-L557 HydrophobicContact CG2-CD1 3.56Å; V539-L557 HydrophobicContact CG2-CD2 3.95Å; V539-L557 HydrophobicContact CG2-CG 3.67Å; V539-V558 CarbonylContact C-O 3.55Å; V539-V558 WeakPolarHBondContact CA-O 3.35Å; V539-V558 WeakPolarHBondContact CG2-O 3.43Å; V539-F559 HydrophobicContact CB-CB 4.29Å; V539-F559 HydrophobicContact CG2-CB 4.11Å
540	G	96.5	Very high	92.4	Very high	18 Å²	18	62.2 Å²	62.2	19%	0.186	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	158.5	174.7	0	0	0	0	0	110.1	V558	G540-V558 PolarHBondContact N-O 3.4Å; G540-V558 PolarHBondContact O-N 3.16Å
541	V	96.4	Very high	92.2	Very high	48 Å²	48	69.8 Å²	69.8	29%	0.291	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	132.3	168.4	174.4	0	0	0	0	107	V473 P481 L557	V473-V541 HydrophobicContact CG1-CG2 4.17Å; V473-V541 HydrophobicContact CG2-CG2 3.94Å; P481-V541 HydrophobicContact CB-CG1 4.14Å; P481-V541 HydrophobicContact CG-CG1 3.65Å; V541-L557 HydrophobicContact CG2-CD1 4.1Å
542	A	96.3	Very high	92.5	Very high	2 Å²	2	71.2 Å²	71.2	2%	0.017	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.9	177.4	0	0	0	0	0	110.6	F544 S555 G556 V558 K598	A542-F544 HydrophobicContact CB-CD2 4.39Å; A542-F544 HydrophobicContact CB-CE2 3.74Å; A542-F544 HydrophobicContact CB-CZ 3.96Å; A542-S555 WeakPolarHBondContact O-CA 3.26Å; A542-G556 PolarHBondContact N-O 3.35Å; A542-G556 PolarHBondContact O-N 2.96Å; A542-V558 HydrophobicContact CB-CG2 3.67Å; A542-K598 CarbonylContact C-O 3.55Å; A542-K598 WeakPolarHBondContact CA-O 3.31Å
543	W	94.2	Very high	92.9	Very high	90 Å²	90	69.7 Å²	69.7	34%	0.341	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.7	169.8	-173.7	86.7	0	0	0	109.2	G545 K598	W543-G545 VanDerWaalsContact CH2-CA 3.49Å; W543-K598 PolarHBondContact N-O 3.28Å
544	F	95.1	Very high	93.1	Very high	41 Å²	41	73.6 Å²	73.6	18%	0.18	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	99.7	-178.7	-68.6	-84	0	0	0	109.8	A542 G553 E554 V558 V568 L616	A542-F544 HydrophobicContact CB-CD2 4.39Å; A542-F544 HydrophobicContact CB-CE2 3.74Å; A542-F544 HydrophobicContact CB-CZ 3.96Å; F544-G553 CarbonylContact O-C 3.52Å; F544-G553 WeakPolarHBondContact O-CA 3.23Å; F544-E554 PolarHBondContact N-O 3Å; F544-E554 PolarHBondContact O-N 2.75Å; F544-V558 HydrophobicContact CE2-CG2 3.95Å; F544-V558 HydrophobicContact CZ-CG2 3.65Å; F544-V568 HydrophobicContact CE2-CG1 3.78Å; F544-V568 HydrophobicContact CZ-CG1 3.98Å; F544-V568 HydrophobicContact CZ-CG2 3.89Å; F544-L616 HydrophobicContact CE1-CB 4.1Å
545	G	93	Very high	93.1	Very high	3 Å²	3	75.3 Å²	75.3	3%	0.031	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	140.7	172.7	0	0	0	0	0	112.4	W543	W543-G545 VanDerWaalsContact CH2-CA 3.49Å
546	S	93.2	Very high	93.1	Very high	31 Å²	31	71 Å²	71	22%	0.217	35%	0.351	C	S	.	.			trans	-72.9	136.7	177.7	174.5	0	0	0	0	111.5	R548 T549 Y552 R619	S546-R548 VanDerWaalsContact C-N 3.27Å; S546-R548 PolarHBondContact OG-N 2.95Å; S546-R548 VanDerWaalsContact OG-N 3.07Å; S546-T549 PolarHBondContact OG-N 2.81Å; S546-Y552 WeakPolarHBondContact CB-O 3.17Å; S546-Y552 PolarHBondContact N-O 2.88Å; S546-R619 PolarHBondContact O-NE 2.87Å; S546-R619 PolarHBondContact O-NH2 3.01Å
547	S	90.3	Very high	93.1	Very high	86 Å²	86	71 Å²	71	60%	0.601	35%	0.351	S	S	*	.	S	Bend	trans	-79.2	-10	169.3	53.5	0	0	0	0	113.4
548	R	92.3	Very high	93.2	Very high	232 Å²	232	66.1 Å²	66.1	88%	0.875	33%	0.333	S	S	*	.	S	Bend	trans	-99.3	-23.3	-178.5	-61.4	-177.6	-179.9	-173	-0.6	113.3	S546	S546-R548 VanDerWaalsContact C-N 3.27Å; S546-R548 PolarHBondContact OG-N 2.95Å; S546-R548 VanDerWaalsContact OG-N 3.07Å
549	T	91	Very high	93.3	Very high	79 Å²	79	61.1 Å²	61.1	49%	0.485	31%	0.313	S	S	.	.			trans	-136.8	118.7	-176.5	-50.5	0	0	0	0	108.1	S546 D551 Y552 R619	S546-T549 PolarHBondContact OG-N 2.81Å; T549-D551 PolarHBondContact O-N 2.8Å; T549-Y552 PolarHBondContact O-N 2.85Å; T549-R619 PolarHBondContact O-NH2 2.86Å
550	E	81.4	Confident	93.3	Very high	166 Å²	166	59.3 Å²	59.3	78%	0.776	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-36.4	-167.3	-159.3	165.7	-170.5	0	0	113.1	R619	E550-R619 VanDerWaalsContact C-NH2 3.33Å; E550-R619 VanDerWaalsContact O-CZ 3.32Å; E550-R619 PolarHBondContact O-NH1 3.26Å; E550-R619 PolarHBondContact O-NH2 3.09Å
551	D	84.4	Confident	93.4	Very high	160 Å²	160	58.4 Å²	58.4	86%	0.856	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	18.6	-176.9	-60.9	-39.6	0	0	0	114.3	T549	T549-D551 PolarHBondContact O-N 2.8Å
552	Y	90.9	Very high	93.4	Very high	119 Å²	119	57.9 Å²	57.9	47%	0.467	29%	0.289	S	S	.	.			trans	-113.6	134.7	178.8	-173.1	-99.9	0	0	0	111.7	S546 T549 E554 R619	S546-Y552 WeakPolarHBondContact CB-O 3.17Å; S546-Y552 PolarHBondContact N-O 2.88Å; T549-Y552 PolarHBondContact O-N 2.85Å; Y552-E554 HydrophobicContact CE1-CG 3.88Å; Y552-E554 WeakPolarHBondContact CE1-OE1 3.34Å; Y552-E554 VanDerWaalsContact CZ-OE1 3.3Å; Y552-E554 WeakPolarHBondContact OH-CG 3.4Å; Y552-E554 PolarHBondContact OH-OE1 3.24Å; Y552-R619 PolarHBondContact O-NH2 2.76Å
553	G	91	Very high	93.4	Very high	22 Å²	22	61 Å²	61	23%	0.227	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	160	167.4	0	0	0	0	0	111.9	F544	F544-G553 CarbonylContact O-C 3.52Å; F544-G553 WeakPolarHBondContact O-CA 3.23Å
554	E	92.7	Very high	93.5	Very high	104 Å²	104	56.7 Å²	56.7	49%	0.486	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.3	-176.3	-67.1	177.1	-154.3	0	0	110.7	F544 Y552	F544-E554 PolarHBondContact N-O 3Å; F544-E554 PolarHBondContact O-N 2.75Å; Y552-E554 HydrophobicContact CE1-CG 3.88Å; Y552-E554 WeakPolarHBondContact CE1-OE1 3.34Å; Y552-E554 VanDerWaalsContact CZ-OE1 3.3Å; Y552-E554 WeakPolarHBondContact OH-CG 3.4Å; Y552-E554 PolarHBondContact OH-OE1 3.24Å
555	S	94.1	Very high	93.7	Very high	38 Å²	38	55.4 Å²	55.4	27%	0.266	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	128.4	171.3	-61.8	0	0	0	0	110.3	A542	A542-S555 WeakPolarHBondContact O-CA 3.26Å
556	G	96	Very high	93.9	Very high	4 Å²	4	55.3 Å²	55.3	4%	0.041	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	156.6	174.5	0	0	0	0	0	111.5	A542 L569	A542-G556 PolarHBondContact N-O 3.35Å; A542-G556 PolarHBondContact O-N 2.96Å; G556-L569 WeakPolarHBondContact CA-O 3.4Å
557	L	97.4	Very high	94.1	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	121.5	171	-171.8	85.2	0	0	0	108.9	L505 I507 F512 V539 V541 V568 L569 L571	L505-L557 HydrophobicContact CD2-CD1 4.42Å; L505-L557 HydrophobicContact CD2-CD2 4.15Å; I507-L557 HydrophobicContact CD1-CD1 3.82Å; I507-L557 HydrophobicContact CD1-CD2 3.91Å; I507-L557 HydrophobicContact CD1-CG 4.48Å; I507-L557 HydrophobicContact CG1-CD2 4.45Å; F512-L557 HydrophobicContact CD1-CD2 3.76Å; F512-L557 HydrophobicContact CE1-CD2 3.56Å; V539-L557 HydrophobicContact CG2-CD1 3.56Å; V539-L557 HydrophobicContact CG2-CD2 3.95Å; V539-L557 HydrophobicContact CG2-CG 3.67Å; V541-L557 HydrophobicContact CG2-CD1 4.1Å; L557-V568 CarbonylContact O-C 3.58Å; L557-V568 WeakPolarHBondContact O-CA 3.45Å; L557-L569 HydrophobicContact CB-CB 4.05Å; L557-L569 HydrophobicContact CD2-CD1 3.98Å; L557-L569 PolarHBondContact N-O 2.84Å; L557-L569 PolarHBondContact O-N 2.86Å; L557-L571 HydrophobicContact CB-CD1 4.43Å; L557-L571 HydrophobicContact CB-CD2 4.27Å; L557-L571 HydrophobicContact CB-CG 4.38Å
558	V	97.9	Very high	94.4	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.8	177	-170.2	0	0	0	0	108.8	V539 G540 A542 F544 V566 H567 V568 F596 L616	V539-V558 CarbonylContact C-O 3.55Å; V539-V558 WeakPolarHBondContact CA-O 3.35Å; V539-V558 WeakPolarHBondContact CG2-O 3.43Å; G540-V558 PolarHBondContact N-O 3.4Å; G540-V558 PolarHBondContact O-N 3.16Å; A542-V558 HydrophobicContact CB-CG2 3.67Å; F544-V558 HydrophobicContact CE2-CG2 3.95Å; F544-V558 HydrophobicContact CZ-CG2 3.65Å; V558-V566 HydrophobicContact CG1-CG1 3.88Å; V558-H567 WeakPolarHBondContact CA-O 3.26Å; V558-V568 HydrophobicContact CG2-CG2 4.25Å; V558-F596 HydrophobicContact CB-CD1 4.4Å; V558-F596 HydrophobicContact CB-CE1 4.45Å; V558-F596 HydrophobicContact CB-CG 4.5Å; V558-F596 HydrophobicContact CG1-CD1 3.72Å; V558-F596 HydrophobicContact CG1-CE1 3.44Å; V558-F596 VanDerWaalsContact CG1-CE1 3.44Å; V558-F596 HydrophobicContact CG1-CE2 4.3Å; V558-F596 HydrophobicContact CG1-CG 4.26Å; V558-F596 HydrophobicContact CG1-CZ 3.76Å; V558-L616 HydrophobicContact CG1-CD1 3.41Å; V558-L616 VanDerWaalsContact CG1-CD1 3.41Å; V558-L616 HydrophobicContact CG2-CD1 4.37Å
559	F	97.9	Very high	94.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	146.8	176.5	71.2	-84.9	0	0	0	113.2	F512 L528 V536 R538 V539 T561 V566 H567 L569 M576	F512-F559 HydrophobicContact CE1-CD1 4.2Å; F512-F559 HydrophobicContact CE1-CE1 4.46Å; F512-F559 HydrophobicContact CE1-CG 4.44Å; F512-F559 HydrophobicContact CE2-CE1 4.37Å; F512-F559 HydrophobicContact CE2-CE2 4.47Å; F512-F559 HydrophobicContact CE2-CZ 4.18Å; F512-F559 AromaticContact CZ-CD1 3.78Å; F512-F559 HydrophobicContact CZ-CD1 3.78Å; F512-F559 HydrophobicContact CZ-CD2 4.05Å; F512-F559 AromaticContact CZ-CE1 3.75Å; F512-F559 HydrophobicContact CZ-CE1 3.75Å; F512-F559 HydrophobicContact CZ-CE2 4.02Å; F512-F559 AromaticContact CZ-CG 3.92Å; F512-F559 HydrophobicContact CZ-CG 3.92Å; F512-F559 AromaticContact CZ-CZ 3.85Å; F512-F559 HydrophobicContact CZ-CZ 3.85Å; L528-F559 HydrophobicContact CD1-CE2 4.2Å; L528-F559 HydrophobicContact CD1-CZ 4.14Å; L528-F559 HydrophobicContact CD2-CE2 3.7Å; L528-F559 HydrophobicContact CD2-CZ 4.34Å; V536-F559 HydrophobicContact CG1-CB 4.08Å; V536-F559 HydrophobicContact CG1-CD2 4.23Å; V536-F559 HydrophobicContact CG1-CG 4.5Å; V536-F559 HydrophobicContact CG2-CD2 4.07Å; V536-F559 HydrophobicContact CG2-CE2 4.38Å; R538-F559 CarbonylContact O-C 3.52Å; R538-F559 VanDerWaalsContact O-CA 3.23Å; R538-F559 WeakPolarHBondContact O-CA 3.16Å; R538-F559 WeakPolarHBondContact O-CB 3.49Å; V539-F559 HydrophobicContact CB-CB 4.29Å; V539-F559 HydrophobicContact CG2-CB 4.11Å; F559-T561 HydrophobicContact CD2-CG2 4.09Å; F559-T561 HydrophobicContact CE2-CG2 3.75Å; F559-V566 WeakPolarHBondContact O-CA 3.42Å; F559-H567 HydrophobicContact CD1-CB 3.85Å; F559-H567 HydrophobicContact CD2-CB 4.32Å; F559-H567 HydrophobicContact CE1-CB 3.3Å; F559-H567 HydrophobicContact CE2-CB 3.86Å; F559-H567 AromaticContact CE2-CD2 3.72Å; F559-H567 AromaticContact CE2-CG 3.91Å; F559-H567 HydrophobicContact CG-CB 4.33Å; F559-H567 HydrophobicContact CZ-CB 3.34Å; F559-H567 AromaticContact CZ-CD2 3.92Å; F559-H567 AromaticContact CZ-CG 3.62Å; F559-H567 PolarHBondContact N-O 2.8Å; F559-H567 PolarHBondContact O-N 2.8Å; F559-L569 HydrophobicContact CD1-CD1 3.8Å; F559-L569 HydrophobicContact CD1-CG 4.31Å; F559-L569 HydrophobicContact CE1-CD1 3.38Å; F559-L569 HydrophobicContact CE1-CG 3.71Å; F559-L569 HydrophobicContact CZ-CD1 4.3Å; F559-M576 HydrophobicContact CE1-CE 4.2Å; F559-M576 HydrophobicContact CE1-SD 4.12Å; F559-M576 HydrophobicContact CZ-CE 3.89Å; F559-M576 HydrophobicContact CZ-SD 4.03Å
560	L	98.4	Very high	94.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.5	174.3	178.3	69.8	0	0	0	109.2	R537 R538 V566 I583 I591 C594 F596	R537-L560 PolarHBondContact N-O 2.84Å; R538-L560 HydrophobicContact CB-CB 4.18Å; R538-L560 PolarHBondContact N-O 2.78Å; R538-L560 PolarHBondContact O-N 2.75Å; L560-V566 HydrophobicContact CD1-CG2 3.65Å; L560-I583 HydrophobicContact CD1-CD1 4.15Å; L560-I583 HydrophobicContact CD2-CD1 4.02Å; L560-I591 HydrophobicContact CD2-CB 4.28Å; L560-I591 HydrophobicContact CD2-CG2 3.87Å; L560-I591 WeakPolarHBondContact CD2-O 3.28Å; L560-I591 HydrophobicContact CG-CG2 4.5Å; L560-C594 HydrophobicContact CD2-CB 3.51Å; L560-F596 HydrophobicContact CB-CE2 4.26Å; L560-F596 HydrophobicContact CB-CZ 3.87Å
561	T	98.1	Very high	95.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	167.3	176.6	67.9	0	0	0	0	112.8	L528 R535 F559 Q563 G564 D565	L528-T561 HydrophobicContact CD2-CG2 4.35Å; R535-T561 CarbonylContact O-C 3.47Å; R535-T561 WeakPolarHBondContact O-CA 3.34Å; F559-T561 HydrophobicContact CD2-CG2 4.09Å; F559-T561 HydrophobicContact CE2-CG2 3.75Å; T561-Q563 PolarHBondContact O-N 3.36Å; T561-Q563 PolarHBondContact OG1-N 2.76Å; T561-G564 PolarHBondContact O-N 2.91Å; T561-D565 PolarHBondContact N-O 3.05Å; T561-D565 PolarHBondContact OG1-N 2.84Å; T561-D565 PolarHBondContact OG1-O 2.89Å
562	N	96.3	Very high	95.9	Very high	36 Å²	36	23.1 Å²	23.1	19%	0.193	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-9	172.1	76.7	-65.7	0	0	0	113.8	R535 R537	R535-N562 HydrophobicContact CB-CB 4.36Å; R535-N562 PolarHBondContact N-OD1 3.18Å; R535-N562 PolarHBondContact O-N 3.01Å; R535-N562 PolarHBondContact O-OD1 3.42Å; R537-N562 HydrophobicContact CG-CB 3.92Å
563	Q	95.9	Very high	95.9	Very high	67 Å²	67	22.9 Å²	22.9	31%	0.313	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-4.3	172.6	-56.3	-61.3	-20.5	0	0	112	T561 D565 R585	T561-Q563 PolarHBondContact O-N 3.36Å; T561-Q563 PolarHBondContact OG1-N 2.76Å; Q563-D565 VanDerWaalsContact C-N 3.33Å; Q563-R585 WeakPolarHBondContact O-CA 3.35Å; Q563-R585 WeakPolarHBondContact O-CB 3.43Å; Q563-R585 PolarHBondContact O-N 2.81Å
564	G	96.8	Very high	96.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	83.4	6.7	-177.9	0	0	0	0	0	114.7	T561 C582 I583	T561-G564 PolarHBondContact O-N 2.91Å; G564-C582 PolarHBondContact O-N 2.81Å; G564-I583 CarbonylContact C-O 3.49Å; G564-I583 VanDerWaalsContact CA-O 3.25Å; G564-I583 WeakPolarHBondContact CA-O 3.26Å; G564-I583 PolarHBondContact O-N 2.84Å
565	D	97.8	Very high	96.2	Very high	15 Å²	15	23.6 Å²	23.6	8%	0.08	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	137.8	172.4	-62.8	-17.8	0	0	0	111	T561 Q563 R579 Y580 P581	T561-D565 PolarHBondContact N-O 3.05Å; T561-D565 PolarHBondContact OG1-N 2.84Å; T561-D565 PolarHBondContact OG1-O 2.89Å; Q563-D565 VanDerWaalsContact C-N 3.33Å; D565-R579 HydrophobicContact CB-CG 4.43Å; D565-R579 IonicContact OD2-CZ 3.88Å; D565-R579 IonicContact OD2-NE 2.71Å; D565-R579 PolarHBondContact OD2-NE 2.84Å; D565-R579 IonicContact OD2-NH2 3.82Å; D565-R579 PolarHBondContact OD2-NH2 2.85Å; D565-Y580 CarbonylContact C-O 3.51Å; D565-Y580 WeakPolarHBondContact CA-O 3.35Å; D565-P581 WeakPolarHBondContact OD1-CA 3.5Å
566	V	98	Very high	96.2	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.4	173.9	-180	0	0	0	0	109.4	V558 F559 L560 Y580 C582 F596 F614 L616	V558-V566 HydrophobicContact CG1-CG1 3.88Å; F559-V566 WeakPolarHBondContact O-CA 3.42Å; L560-V566 HydrophobicContact CD1-CG2 3.65Å; V566-Y580 PolarHBondContact N-O 2.82Å; V566-Y580 PolarHBondContact O-N 3.29Å; V566-C582 HydrophobicContact CB-CB 4.36Å; V566-C582 HydrophobicContact CG2-CB 3.64Å; V566-F596 HydrophobicContact CG1-CE1 3.93Å; V566-F596 HydrophobicContact CG1-CZ 4.23Å; V566-F614 HydrophobicContact CG1-CE2 4.37Å; V566-F614 HydrophobicContact CG2-CE2 4.43Å; V566-F614 HydrophobicContact CG2-CZ 4.41Å; V566-L616 HydrophobicContact CG1-CD1 3.57Å; V566-L616 HydrophobicContact CG1-CD2 4.02Å; V566-L616 HydrophobicContact CG1-CG 4.36Å
567	H	97.3	Very high	96.2	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.019	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	155.5	-176.1	-64.8	-104	0	0	0	111.6	V558 F559 M576 I578 R579	V558-H567 WeakPolarHBondContact CA-O 3.26Å; F559-H567 HydrophobicContact CD1-CB 3.85Å; F559-H567 HydrophobicContact CD2-CB 4.32Å; F559-H567 HydrophobicContact CE1-CB 3.3Å; F559-H567 HydrophobicContact CE2-CB 3.86Å; F559-H567 AromaticContact CE2-CD2 3.72Å; F559-H567 AromaticContact CE2-CG 3.91Å; F559-H567 HydrophobicContact CG-CB 4.33Å; F559-H567 HydrophobicContact CZ-CB 3.34Å; F559-H567 AromaticContact CZ-CD2 3.92Å; F559-H567 AromaticContact CZ-CG 3.62Å; F559-H567 PolarHBondContact N-O 2.8Å; F559-H567 PolarHBondContact O-N 2.8Å; H567-M576 HydrophobicContact CB-CE 3.77Å; H567-M576 WeakPolarHBondContact ND1-CE 3.32Å; H567-I578 VanDerWaalsContact CA-O 3.29Å; H567-I578 WeakPolarHBondContact CA-O 3.27Å; H567-R579 VanDerWaalsContact CE1-CD 3.49Å; H567-R579 WeakPolarHBondContact CE1-CD 3.22Å; H567-R579 WeakPolarHBondContact CE1-CG 3.31Å; H567-R579 WeakPolarHBondContact ND1-CB 3.38Å
568	V	97.3	Very high	96	Very high	9 Å²	9	33.1 Å²	33.1	6%	0.055	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132.2	169.5	-176.2	0	0	0	0	110.1	F544 L557 V558 Q577 I578 L616	F544-V568 HydrophobicContact CE2-CG1 3.78Å; F544-V568 HydrophobicContact CZ-CG1 3.98Å; F544-V568 HydrophobicContact CZ-CG2 3.89Å; L557-V568 CarbonylContact O-C 3.58Å; L557-V568 WeakPolarHBondContact O-CA 3.45Å; V558-V568 HydrophobicContact CG2-CG2 4.25Å; V568-Q577 WeakPolarHBondContact O-CB 3.29Å; V568-Q577 PolarHBondContact O-N 2.85Å; V568-I578 HydrophobicContact CB-CD1 4Å; V568-I578 HydrophobicContact CB-CG1 3.55Å; V568-I578 HydrophobicContact CG2-CD1 3.5Å; V568-I578 VanDerWaalsContact CG2-CD1 3.5Å; V568-I578 HydrophobicContact CG2-CG1 3.62Å; V568-I578 PolarHBondContact N-O 3Å; V568-L616 HydrophobicContact CG2-CD1 4.01Å
569	L	96.1	Very high	95.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.8	175.5	-84.5	164.6	0	0	0	109.5	F512 L526 G556 L557 F559 I574 M576	F512-L569 HydrophobicContact CD1-CD1 3.69Å; F512-L569 HydrophobicContact CD2-CD1 4.11Å; F512-L569 HydrophobicContact CE1-CD1 3.44Å; F512-L569 VanDerWaalsContact CE1-CD1 3.44Å; F512-L569 HydrophobicContact CE2-CD1 3.87Å; F512-L569 HydrophobicContact CG-CD1 4.04Å; F512-L569 HydrophobicContact CZ-CD1 3.54Å; L526-L569 HydrophobicContact CD2-CD1 4.32Å; L526-L569 HydrophobicContact CD2-CD2 3.63Å; G556-L569 WeakPolarHBondContact CA-O 3.4Å; L557-L569 HydrophobicContact CB-CB 4.05Å; L557-L569 HydrophobicContact CD2-CD1 3.98Å; L557-L569 PolarHBondContact N-O 2.84Å; L557-L569 PolarHBondContact O-N 2.86Å; F559-L569 HydrophobicContact CD1-CD1 3.8Å; F559-L569 HydrophobicContact CD1-CG 4.31Å; F559-L569 HydrophobicContact CE1-CD1 3.38Å; F559-L569 HydrophobicContact CE1-CG 3.71Å; F559-L569 HydrophobicContact CZ-CD1 4.3Å; L569-I574 VanDerWaalsContact CD2-C 3.49Å; L569-I574 HydrophobicContact CD2-CB 4.47Å; L569-I574 WeakPolarHBondContact CD2-O 3.21Å; L569-M576 HydrophobicContact CD1-SD 4.35Å; L569-M576 HydrophobicContact CD2-CG 4.07Å; L569-M576 HydrophobicContact CD2-SD 3.4Å; L569-M576 WeakPolarHBondContact CD2-SD 2.98Å; L569-M576 HydrophobicContact CG-SD 3.77Å
570	S	95.9	Very high	95.8	Very high	21 Å²	21	45.4 Å²	45.4	15%	0.147	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	145	172.4	62.5	0	0	0	0	111.5	I574 K575 Q577	S570-I574 WeakPolarHBondContact O-CA 3.46Å; S570-I574 PolarHBondContact O-N 3.02Å; S570-K575 PolarHBondContact N-O 2.91Å; S570-K575 WeakPolarHBondContact OG-CB 3.16Å; S570-K575 PolarHBondContact OG-N 3.08Å; S570-K575 PolarHBondContact OG-O 2.83Å; S570-Q577 PolarHBondContact OG-NE2 3.02Å
571	L	95.3	Very high	95.7	Very high	19 Å²	19	50.5 Å²	50.5	10%	0.099	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	148.2	170.6	-64	174.1	0	0	0	109.8	L475 P481 L505 L557 H573	L475-L571 HydrophobicContact CD1-CD2 4.36Å; L475-L571 HydrophobicContact CD2-CD1 4.23Å; P481-L571 HydrophobicContact CG-CD1 3.86Å; L505-L571 HydrophobicContact CD2-CD2 3.79Å; L557-L571 HydrophobicContact CB-CD1 4.43Å; L557-L571 HydrophobicContact CB-CD2 4.27Å; L557-L571 HydrophobicContact CB-CG 4.38Å; L571-H573 VanDerWaalsContact C-N 3.31Å
572	P	92	Very high	95.7	Very high	25 Å²	25	52.4 Å²	52.4	16%	0.162	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	cis	-80.6	-1.5	-6.2	33.6	-37.3	0	0	0	113.9	L475 M524 I574	L475-P572 HydrophobicContact CD1-CB 3.75Å; M524-P572 WeakPolarHBondContact CE-O 3.33Å; P572-I574 PolarHBondContact O-N 2.89Å
573	H	92.9	Very high	95.7	Very high	113 Å²	113	51 Å²	51	52%	0.523	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.1	-164.7	-60.4	93.7	0	0	0	116.2	M524 L571 K575	M524-H573 VanDerWaalsContact SD-C 3.59Å; L571-H573 VanDerWaalsContact C-N 3.31Å; H573-K575 VanDerWaalsContact C-N 3.25Å; H573-K575 HydrophobicContact CB-CD 4.35Å; H573-K575 HydrophobicContact CB-CG 4.09Å; H573-K575 PolarHBondContact O-N 3Å
574	I	94.8	Very high	95.8	Very high	10 Å²	10	56.3 Å²	56.3	5%	0.051	27%	0.265	C	S	.	.			trans	47.2	42.4	-176.2	65.5	172.5	0	0	0	113.8	L505 F512 V514 M524 L526 L569 S570 P572	L505-I574 HydrophobicContact CD1-CG2 4.09Å; L505-I574 HydrophobicContact CD2-CG2 4.49Å; F512-I574 HydrophobicContact CB-CD1 4.39Å; V514-I574 HydrophobicContact CG2-CD1 4.29Å; V514-I574 HydrophobicContact CG2-CG2 3.91Å; M524-I574 HydrophobicContact CB-CD1 4.12Å; M524-I574 HydrophobicContact CB-CG1 4.49Å; M524-I574 HydrophobicContact CG-CD1 3.77Å; M524-I574 HydrophobicContact CG-CG1 4.01Å; M524-I574 HydrophobicContact SD-CD1 4.1Å; M524-I574 HydrophobicContact SD-CG1 3.64Å; L526-I574 HydrophobicContact CB-CD1 4Å; L569-I574 VanDerWaalsContact CD2-C 3.49Å; L569-I574 HydrophobicContact CD2-CB 4.47Å; L569-I574 WeakPolarHBondContact CD2-O 3.21Å; S570-I574 WeakPolarHBondContact O-CA 3.46Å; S570-I574 PolarHBondContact O-N 3.02Å; P572-I574 PolarHBondContact O-N 2.89Å
575	K	94.2	Very high	95.7	Very high	132 Å²	132	63.8 Å²	63.8	57%	0.574	29%	0.293	S	S	*	.			trans	-92.9	129.1	175.7	-62.1	179.5	178.7	176.7	0	110.4	S570 H573 Q577	S570-K575 PolarHBondContact N-O 2.91Å; S570-K575 WeakPolarHBondContact OG-CB 3.16Å; S570-K575 PolarHBondContact OG-N 3.08Å; S570-K575 PolarHBondContact OG-O 2.83Å; H573-K575 VanDerWaalsContact C-N 3.25Å; H573-K575 HydrophobicContact CB-CD 4.35Å; H573-K575 HydrophobicContact CB-CG 4.09Å; H573-K575 PolarHBondContact O-N 3Å; K575-Q577 PolarHBondContact O-N 2.85Å; K575-Q577 PolarHBondContact O-NE2 3.44Å; K575-Q577 VanDerWaalsContact O-NE2 3.07Å
576	M	94.4	Very high	95.6	Very high	76 Å²	76	68.9 Å²	68.9	37%	0.374	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	122.6	175.8	-66.4	-61.5	-61.4	0	0	109.7	L526 F559 H567 L569	L526-M576 HydrophobicContact CD2-CG 4.04Å; L526-M576 HydrophobicContact CD2-SD 3.83Å; F559-M576 HydrophobicContact CE1-CE 4.2Å; F559-M576 HydrophobicContact CE1-SD 4.12Å; F559-M576 HydrophobicContact CZ-CE 3.89Å; F559-M576 HydrophobicContact CZ-SD 4.03Å; H567-M576 HydrophobicContact CB-CE 3.77Å; H567-M576 WeakPolarHBondContact ND1-CE 3.32Å; L569-M576 HydrophobicContact CD1-SD 4.35Å; L569-M576 HydrophobicContact CD2-CG 4.07Å; L569-M576 HydrophobicContact CD2-SD 3.4Å; L569-M576 WeakPolarHBondContact CD2-SD 2.98Å; L569-M576 HydrophobicContact CG-SD 3.77Å
577	Q	94.9	Very high	95.5	Very high	113 Å²	113	70.2 Å²	70.2	53%	0.528	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-57.1	178.4	-59.9	-57	-55.7	0	0	110.6	V568 S570 K575	V568-Q577 WeakPolarHBondContact O-CB 3.29Å; V568-Q577 PolarHBondContact O-N 2.85Å; S570-Q577 PolarHBondContact OG-NE2 3.02Å; K575-Q577 PolarHBondContact O-N 2.85Å; K575-Q577 PolarHBondContact O-NE2 3.44Å; K575-Q577 VanDerWaalsContact O-NE2 3.07Å
578	I	93.1	Very high	95.3	Very high	53 Å²	53	73.7 Å²	73.7	27%	0.272	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	155.7	-174.4	51.9	162.9	0	0	0	111.5	H567 V568 Y580	H567-I578 VanDerWaalsContact CA-O 3.29Å; H567-I578 WeakPolarHBondContact CA-O 3.27Å; V568-I578 HydrophobicContact CB-CD1 4Å; V568-I578 HydrophobicContact CB-CG1 3.55Å; V568-I578 HydrophobicContact CG2-CD1 3.5Å; V568-I578 VanDerWaalsContact CG2-CD1 3.5Å; V568-I578 HydrophobicContact CG2-CG1 3.62Å; V568-I578 PolarHBondContact N-O 3Å; I578-Y580 HydrophobicContact CB-CE2 4.07Å; I578-Y580 HydrophobicContact CD1-CD2 3.91Å; I578-Y580 HydrophobicContact CD1-CE2 3.37Å; I578-Y580 HydrophobicContact CG1-CE2 4.25Å
579	R	95.1	Very high	95	Very high	134 Å²	134	76.7 Å²	76.7	51%	0.506	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	123.1	173.3	172.9	-178.3	-176.2	-177.5	-1.4	107.7	D532 D565 H567	D532-R579 IonicContact OD2-NH1 2.74Å; D565-R579 HydrophobicContact CB-CG 4.43Å; D565-R579 IonicContact OD2-CZ 3.88Å; D565-R579 IonicContact OD2-NE 2.71Å; D565-R579 PolarHBondContact OD2-NE 2.84Å; D565-R579 IonicContact OD2-NH2 3.82Å; D565-R579 PolarHBondContact OD2-NH2 2.85Å; H567-R579 VanDerWaalsContact CE1-CD 3.49Å; H567-R579 WeakPolarHBondContact CE1-CD 3.22Å; H567-R579 WeakPolarHBondContact CE1-CG 3.31Å; H567-R579 WeakPolarHBondContact ND1-CB 3.38Å
580	Y	96.9	Very high	95	Very high	125 Å²	125	76.7 Å²	76.7	49%	0.49	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.2	173.5	-64.3	-58.4	0	0	0	110.5	D565 V566 I578 C582 L616	D565-Y580 CarbonylContact C-O 3.51Å; D565-Y580 WeakPolarHBondContact CA-O 3.35Å; V566-Y580 PolarHBondContact N-O 2.82Å; V566-Y580 PolarHBondContact O-N 3.29Å; I578-Y580 HydrophobicContact CB-CE2 4.07Å; I578-Y580 HydrophobicContact CD1-CD2 3.91Å; I578-Y580 HydrophobicContact CD1-CE2 3.37Å; I578-Y580 HydrophobicContact CG1-CE2 4.25Å; Y580-C582 PolarHBondContact O-N 2.8Å; Y580-L616 HydrophobicContact CD2-CD2 3.84Å; Y580-L616 HydrophobicContact CE2-CD2 4.44Å
581	P	97.1	Very high	95	Very high	108 Å²	108	76.2 Å²	76.2	70%	0.701	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	127.4	165.3	29	-31.8	0	0	0	108.5	D565	D565-P581 WeakPolarHBondContact OD1-CA 3.5Å
582	C	97.1	Very high	95	Very high	39 Å²	39	77.9 Å²	77.9	26%	0.264	38%	0.378	S	S	.	.			trans	-125.6	-61.2	-175.3	-176.7	0	0	0	0	110.4	G564 V566 Y580	G564-C582 PolarHBondContact O-N 2.81Å; V566-C582 HydrophobicContact CB-CB 4.36Å; V566-C582 HydrophobicContact CG2-CB 3.64Å; Y580-C582 PolarHBondContact O-N 2.8Å
583	I	97.9	Very high	95.2	Very high	8 Å²	8	77.6 Å²	77.6	4%	0.041	38%	0.377	C	S	.	.	S	Bend	trans	-105.1	144.9	-177.3	-50.5	175.9	0	0	0	108.6	L560 G564 R585 D587 I591 C594 Y604	L560-I583 HydrophobicContact CD1-CD1 4.15Å; L560-I583 HydrophobicContact CD2-CD1 4.02Å; G564-I583 CarbonylContact C-O 3.49Å; G564-I583 VanDerWaalsContact CA-O 3.25Å; G564-I583 WeakPolarHBondContact CA-O 3.26Å; G564-I583 PolarHBondContact O-N 2.84Å; I583-R585 PolarHBondContact O-N 2.81Å; I583-D587 HydrophobicContact CG2-CB 4.02Å; I583-I591 HydrophobicContact CB-CG1 4.16Å; I583-I591 HydrophobicContact CD1-CG1 4.43Å; I583-I591 HydrophobicContact CG2-CG1 3.83Å; I583-C594 HydrophobicContact CD1-CB 4.22Å; I583-Y604 HydrophobicContact CD1-CD1 4.14Å; I583-Y604 HydrophobicContact CD1-CD2 3.81Å; I583-Y604 HydrophobicContact CD1-CE2 4.39Å; I583-Y604 HydrophobicContact CD1-CG 3.64Å; I583-Y604 HydrophobicContact CG1-CD1 4.09Å; I583-Y604 HydrophobicContact CG1-CD2 3.91Å; I583-Y604 HydrophobicContact CG1-CE1 4.18Å; I583-Y604 HydrophobicContact CG1-CE2 3.99Å; I583-Y604 HydrophobicContact CG1-CG 3.95Å; I583-Y604 HydrophobicContact CG2-CD2 4.33Å; I583-Y604 HydrophobicContact CG2-CE2 4.19Å
584	R	96.6	Very high	95.4	Very high	178 Å²	178	72.4 Å²	72.4	67%	0.672	35%	0.353	S	S	*	.			trans	-65.9	135.1	173.4	-64.7	177.9	-64.4	-173.6	-1.6	109.7	E586 D587	R584-E586 PolarHBondContact O-N 3.46Å; R584-E586 VanDerWaalsContact O-N 3.08Å; R584-D587 HydrophobicContact CB-CB 4.27Å; R584-D587 WeakPolarHBondContact O-CB 3.49Å; R584-D587 PolarHBondContact O-N 3.07Å
585	R	95.7	Very high	95.6	Very high	157 Å²	157	72.9 Å²	72.9	59%	0.592	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.9	178.3	69.6	179.6	-176.8	-178	-2.4	113.9	Q563 I583 D587	Q563-R585 WeakPolarHBondContact O-CA 3.35Å; Q563-R585 WeakPolarHBondContact O-CB 3.43Å; Q563-R585 PolarHBondContact O-N 2.81Å; I583-R585 PolarHBondContact O-N 2.81Å; R585-D587 VanDerWaalsContact C-N 3.31Å
586	E	95.2	Very high	95.8	Very high	121 Å²	121	67.9 Å²	67.9	57%	0.565	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-20.6	177.3	-60.6	77.7	-164.4	0	0	112.6	R584 V588	R584-E586 PolarHBondContact O-N 3.46Å; R584-E586 VanDerWaalsContact O-N 3.08Å; E586-V588 VanDerWaalsContact C-N 3.32Å; E586-V588 PolarHBondContact O-N 3.5Å
587	D	95	Very high	95.9	Very high	29 Å²	29	64.4 Å²	64.4	16%	0.155	32%	0.318	C	S	.	.			trans	-84.8	75.2	-179.5	-169.4	-3.3	0	0	0	111.2	I583 R584 R585 S589 G590 I591	I583-D587 HydrophobicContact CG2-CB 4.02Å; R584-D587 HydrophobicContact CB-CB 4.27Å; R584-D587 WeakPolarHBondContact O-CB 3.49Å; R584-D587 PolarHBondContact O-N 3.07Å; R585-D587 VanDerWaalsContact C-N 3.31Å; D587-S589 PolarHBondContact O-N 2.92Å; D587-S589 PolarHBondContact OD1-N 2.96Å; D587-G590 PolarHBondContact O-N 3.34Å; D587-G590 PolarHBondContact OD1-N 3.27Å; D587-I591 WeakPolarHBondContact O-CG1 3.49Å; D587-I591 PolarHBondContact O-N 3.43Å
588	V	93.9	Very high	95.9	Very high	78 Å²	78	61.9 Å²	61.9	47%	0.473	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-30.7	179.8	-177.8	0	0	0	0	111.6	I341 E586 A592	I341-V588 HydrophobicContact CD1-CB 3.91Å; I341-V588 HydrophobicContact CD1-CG1 3.85Å; E586-V588 VanDerWaalsContact C-N 3.32Å; E586-V588 PolarHBondContact O-N 3.5Å; V588-A592 VanDerWaalsContact O-CB 3.25Å; V588-A592 WeakPolarHBondContact O-CB 3.33Å; V588-A592 PolarHBondContact O-N 2.99Å
589	S	91.6	Very high	95.9	Very high	72 Å²	72	60.8 Å²	60.8	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-71.9	-45.6	179	-61.9	0	0	0	0	111.4	D587 I591 A592 S593	D587-S589 PolarHBondContact O-N 2.92Å; D587-S589 PolarHBondContact OD1-N 2.96Å; S589-I591 PolarHBondContact O-N 2.78Å; S589-A592 PolarHBondContact O-N 2.8Å; S589-S593 WeakPolarHBondContact O-CB 3.15Å; S589-S593 PolarHBondContact O-N 3.45Å; S589-S593 PolarHBondContact O-OG 2.87Å
590	G	94.8	Very high	95.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-46.8	172.1	0	0	0	0	0	111.7	D587 A592 S593 C594 L605	D587-G590 PolarHBondContact O-N 3.34Å; D587-G590 PolarHBondContact OD1-N 3.27Å; G590-A592 VanDerWaalsContact C-N 3.32Å; G590-A592 PolarHBondContact O-N 3.14Å; G590-S593 PolarHBondContact O-N 3.06Å; G590-S593 PolarHBondContact O-OG 3.32Å; G590-C594 PolarHBondContact O-N 3.19Å; G590-C594 VanDerWaalsContact O-N 3.17Å; G590-L605 WeakPolarHBondContact CA-O 3.44Å
591	I	97.1	Very high	95.9	Very high	11 Å²	11	48.6 Å²	48.6	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-40.7	177.7	-68	170.2	0	0	0	111.9	R537 L560 I583 D587 S589	R537-I591 HydrophobicContact CB-CG2 4.08Å; R537-I591 HydrophobicContact CG-CG2 3.92Å; L560-I591 HydrophobicContact CD2-CB 4.28Å; L560-I591 HydrophobicContact CD2-CG2 3.87Å; L560-I591 WeakPolarHBondContact CD2-O 3.28Å; L560-I591 HydrophobicContact CG-CG2 4.5Å; I583-I591 HydrophobicContact CB-CG1 4.16Å; I583-I591 HydrophobicContact CD1-CG1 4.43Å; I583-I591 HydrophobicContact CG2-CG1 3.83Å; D587-I591 WeakPolarHBondContact O-CG1 3.49Å; D587-I591 PolarHBondContact O-N 3.43Å; S589-I591 PolarHBondContact O-N 2.78Å
592	A	94.3	Very high	95.9	Very high	53 Å²	53	43.5 Å²	43.5	44%	0.438	22%	0.219	S	C	.	.	H	α-helix	trans	-71.8	-35.1	-178.9	0	0	0	0	0	112.8	R538 V588 S589 G590	R538-A592 PolarHBondContact NE-O 3.23Å; R538-A592 PolarHBondContact NH2-O 2.86Å; V588-A592 VanDerWaalsContact O-CB 3.25Å; V588-A592 WeakPolarHBondContact O-CB 3.33Å; V588-A592 PolarHBondContact O-N 2.99Å; S589-A592 PolarHBondContact O-N 2.8Å; G590-A592 VanDerWaalsContact C-N 3.32Å; G590-A592 PolarHBondContact O-N 3.14Å
593	S	96.8	Very high	96	Very high	20 Å²	20	42 Å²	42	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-81.6	-12.3	-178.4	61.4	0	0	0	0	114.3	S85 S589 G590 V595 L605	S85-S593 PolarHBondContact OG-O 2.92Å; S589-S593 WeakPolarHBondContact O-CB 3.15Å; S589-S593 PolarHBondContact O-N 3.45Å; S589-S593 PolarHBondContact O-OG 2.87Å; G590-S593 PolarHBondContact O-N 3.06Å; G590-S593 PolarHBondContact O-OG 3.32Å; S593-V595 PolarHBondContact O-N 3.39Å; S593-L605 WeakPolarHBondContact OG-CB 3.42Å; S593-L605 PolarHBondContact OG-N 3.24Å
594	C	98.2	Very high	96	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.02	21%	0.209	C	C	.	.			trans	-57.2	130.8	-177.9	-174.5	0	0	0	0	112.7	L560 I583 G590 F603	L560-C594 HydrophobicContact CD2-CB 3.51Å; I583-C594 HydrophobicContact CD1-CB 4.22Å; G590-C594 PolarHBondContact O-N 3.19Å; G590-C594 VanDerWaalsContact O-N 3.17Å; C594-F603 CarbonylContact C-O 3.59Å; C594-F603 VanDerWaalsContact CA-O 3.24Å; C594-F603 WeakPolarHBondContact CA-O 3.36Å
595	V	98.1	Very high	96	Very high	21 Å²	21	35 Å²	35	13%	0.127	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.8	174.8	62.3	0	0	0	0	109.7	H87 L133 S593 G602 F603	H87-V595 HydrophobicContact CB-CG2 4.02Å; L133-V595 HydrophobicContact CD1-CG1 4.25Å; S593-V595 PolarHBondContact O-N 3.39Å; V595-G602 CarbonylContact O-C 3.58Å; V595-G602 WeakPolarHBondContact O-CA 3.46Å; V595-F603 HydrophobicContact CG1-CB 3.96Å; V595-F603 HydrophobicContact CG1-CD2 4.26Å; V595-F603 PolarHBondContact N-O 3.29Å; V595-F603 PolarHBondContact O-N 2.95Å
596	F	98.1	Very high	95.9	Very high	26 Å²	26	31.8 Å²	31.8	11%	0.114	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	150.3	177.5	-65.3	-63.7	0	0	0	110.8	R538 V558 L560 V566 F614	R538-F596 HydrophobicContact CB-CE2 4.06Å; V558-F596 HydrophobicContact CB-CD1 4.4Å; V558-F596 HydrophobicContact CB-CE1 4.45Å; V558-F596 HydrophobicContact CB-CG 4.5Å; V558-F596 HydrophobicContact CG1-CD1 3.72Å; V558-F596 HydrophobicContact CG1-CE1 3.44Å; V558-F596 VanDerWaalsContact CG1-CE1 3.44Å; V558-F596 HydrophobicContact CG1-CE2 4.3Å; V558-F596 HydrophobicContact CG1-CG 4.26Å; V558-F596 HydrophobicContact CG1-CZ 3.76Å; L560-F596 HydrophobicContact CB-CE2 4.26Å; L560-F596 HydrophobicContact CB-CZ 3.87Å; V566-F596 HydrophobicContact CG1-CE1 3.93Å; V566-F596 HydrophobicContact CG1-CZ 4.23Å; F596-F614 HydrophobicContact CD1-CE2 4.18Å; F596-F614 AromaticContact CD1-CZ 3.91Å; F596-F614 HydrophobicContact CD1-CZ 3.91Å; F596-F614 AromaticContact CE1-CE2 3.92Å; F596-F614 HydrophobicContact CE1-CE2 3.92Å; F596-F614 AromaticContact CE1-CZ 3.62Å; F596-F614 HydrophobicContact CE1-CZ 3.62Å
597	T	97.2	Very high	95.9	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.025	16%	0.159	C	C	.	.			trans	-97	162.3	172	80.8	0	0	0	0	110.9	Q599 Q601 F603	T597-Q599 PolarHBondContact O-N 3.22Å; T597-Q599 PolarHBondContact OG1-N 3.26Å; T597-Q601 HydrophobicContact CG2-CB 3.87Å; T597-Q601 PolarHBondContact N-O 2.97Å; T597-Q601 WeakPolarHBondContact OG1-CB 3.17Å; T597-Q601 PolarHBondContact OG1-N 2.67Å; T597-Q601 PolarHBondContact OG1-O 2.77Å; T597-F603 HydrophobicContact CG2-CD2 4.24Å; T597-F603 HydrophobicContact CG2-CE2 3.7Å
598	K	94.3	Very high	95.8	Very high	59 Å²	59	30.8 Å²	30.8	26%	0.257	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.3	173.8	-84.2	-171.5	149.9	-173.5	0	113.6	E484 E487 A542 W543	E484-K598 VanDerWaalsContact CG-NZ 3.32Å; E484-K598 WeakPolarHBondContact OE1-CE 3.28Å; E484-K598 IonicContact OE1-NZ 3.09Å; E484-K598 PolarHBondContact OE1-NZ 3.4Å; E484-K598 IonicContact OE2-NZ 2.86Å; E484-K598 PolarHBondContact OE2-NZ 2.8Å; E487-K598 IonicContact OE1-NZ 3.99Å; E487-K598 PolarHBondContact OE1-NZ 3.2Å; E487-K598 IonicContact OE2-NZ 2.67Å; A542-K598 CarbonylContact C-O 3.55Å; A542-K598 WeakPolarHBondContact CA-O 3.31Å; W543-K598 PolarHBondContact N-O 3.28Å
599	Q	92.9	Very high	95.8	Very high	30 Å²	30	29.1 Å²	29.1	14%	0.14	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	18.5	-173.4	-60.8	-60.3	-5.8	0	0	113.7	T597 S617 Y620	T597-Q599 PolarHBondContact O-N 3.22Å; T597-Q599 PolarHBondContact OG1-N 3.26Å; Q599-S617 WeakPolarHBondContact O-CB 3.27Å; Q599-Y620 HydrophobicContact CB-CD1 4.48Å; Q599-Y620 HydrophobicContact CB-CD2 3.9Å; Q599-Y620 HydrophobicContact CB-CE1 4.2Å; Q599-Y620 HydrophobicContact CB-CE2 3.59Å; Q599-Y620 HydrophobicContact CB-CG 4.34Å; Q599-Y620 HydrophobicContact CG-CE1 4.24Å; Q599-Y620 HydrophobicContact CG-CE2 3.98Å
600	G	94.6	Very high	96	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	77.7	23.5	175.6	0	0	0	0	0	113.9	L616 S617	G600-L616 WeakPolarHBondContact O-CA 3.35Å; G600-L616 WeakPolarHBondContact O-CB 3.41Å; G600-L616 PolarHBondContact O-N 3Å; G600-S617 PolarHBondContact O-N 2.88Å
601	Q	97.1	Very high	96.1	Very high	3 Å²	3	32.1 Å²	32.1	1%	0.014	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	174.7	167.4	-59.4	172	-80.3	0	0	110.1	T597 F614	T597-Q601 HydrophobicContact CG2-CB 3.87Å; T597-Q601 PolarHBondContact N-O 2.97Å; T597-Q601 WeakPolarHBondContact OG1-CB 3.17Å; T597-Q601 PolarHBondContact OG1-N 2.67Å; T597-Q601 PolarHBondContact OG1-O 2.77Å; Q601-F614 CarbonylContact C-O 3.55Å; Q601-F614 VanDerWaalsContact CA-O 3.31Å; Q601-F614 WeakPolarHBondContact CA-O 3.27Å; Q601-F614 WeakPolarHBondContact CB-O 3.46Å
602	G	97.8	Very high	96.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	170.1	167.6	0	0	0	0	0	112.7	V595 R613 F614	V595-G602 CarbonylContact O-C 3.58Å; V595-G602 WeakPolarHBondContact O-CA 3.46Å; G602-R613 CarbonylContact O-C 3.45Å; G602-R613 WeakPolarHBondContact O-CA 3.09Å; G602-F614 VanDerWaalsContact C-CE1 3.4Å; G602-F614 VanDerWaalsContact CA-CZ 3.47Å; G602-F614 PolarHBondContact N-O 2.96Å; G602-F614 WeakPolarHBondContact O-CD1 2.94Å; G602-F614 PolarHBondContact O-N 2.9Å
603	F	98.4	Very high	96.3	Very high	7 Å²	7	35.7 Å²	35.7	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.8	179.4	-55.8	-102.5	0	0	0	109	H87 A147 C594 V595 T597 F611 E612 R613	H87-F603 AromaticContact CD2-CE2 3.49Å; H87-F603 VanDerWaalsContact CD2-CE2 3.49Å; H87-F603 WeakPolarHBondContact CD2-CE2 3.27Å; H87-F603 AromaticContact NE2-CE2 3.8Å; A147-F603 HydrophobicContact CB-CZ 4.16Å; C594-F603 CarbonylContact C-O 3.59Å; C594-F603 VanDerWaalsContact CA-O 3.24Å; C594-F603 WeakPolarHBondContact CA-O 3.36Å; V595-F603 HydrophobicContact CG1-CB 3.96Å; V595-F603 HydrophobicContact CG1-CD2 4.26Å; V595-F603 PolarHBondContact N-O 3.29Å; V595-F603 PolarHBondContact O-N 2.95Å; T597-F603 HydrophobicContact CG2-CD2 4.24Å; T597-F603 HydrophobicContact CG2-CE2 3.7Å; F603-F611 HydrophobicContact CB-CB 4.5Å; F603-F611 HydrophobicContact CB-CD1 3.79Å; F603-F611 HydrophobicContact CB-CE1 4.4Å; F603-F611 HydrophobicContact CB-CG 4.37Å; F603-F611 HydrophobicContact CD1-CB 4.44Å; F603-E612 VanDerWaalsContact CA-O 3.31Å; F603-E612 WeakPolarHBondContact CA-O 3.46Å; F603-R613 HydrophobicContact CD1-CB 3.98Å; F603-R613 HydrophobicContact CD1-CG 4.37Å; F603-R613 HydrophobicContact CE1-CB 3.97Å; F603-R613 HydrophobicContact CE1-CG 4.06Å; F603-R613 VanDerWaalsContact CE1-NH2 3.28Å; F603-R613 HydrophobicContact CZ-CG 4.37Å
604	Y	98.3	Very high	96.4	Very high	16 Å²	16	36 Å²	36	6%	0.063	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.6	167.4	76.4	-81.4	0	0	0	110.1	I583 M606 F611 E612 F614	I583-Y604 HydrophobicContact CD1-CD1 4.14Å; I583-Y604 HydrophobicContact CD1-CD2 3.81Å; I583-Y604 HydrophobicContact CD1-CE2 4.39Å; I583-Y604 HydrophobicContact CD1-CG 3.64Å; I583-Y604 HydrophobicContact CG1-CD1 4.09Å; I583-Y604 HydrophobicContact CG1-CD2 3.91Å; I583-Y604 HydrophobicContact CG1-CE1 4.18Å; I583-Y604 HydrophobicContact CG1-CE2 3.99Å; I583-Y604 HydrophobicContact CG1-CG 3.95Å; I583-Y604 HydrophobicContact CG2-CD2 4.33Å; I583-Y604 HydrophobicContact CG2-CE2 4.19Å; Y604-M606 HydrophobicContact CE2-CB 4.47Å; Y604-M606 PolarHBondContact O-N 3.4Å; Y604-F611 VanDerWaalsContact C-CD1 3.44Å; Y604-F611 CarbonylContact O-C 3.58Å; Y604-F611 WeakPolarHBondContact O-CA 3.18Å; Y604-F611 WeakPolarHBondContact O-CD1 3.12Å; Y604-E612 HydrophobicContact CD1-CB 4.21Å; Y604-E612 HydrophobicContact CE1-CB 3.69Å; Y604-E612 HydrophobicContact CE1-CG 4.12Å; Y604-E612 WeakPolarHBondContact CE1-OE2 3.43Å; Y604-E612 PolarHBondContact N-O 2.83Å; Y604-E612 VanDerWaalsContact N-O 3.08Å; Y604-E612 PolarHBondContact O-N 3.34Å; Y604-E612 PolarHBondContact OH-OE2 3.09Å; Y604-F614 HydrophobicContact CD1-CD1 4.08Å; Y604-F614 HydrophobicContact CD1-CE1 4.3Å
605	L	97.1	Very high	96.3	Very high	24 Å²	24	38 Å²	38	13%	0.126	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	114.4	177	-72.2	173.1	0	0	0	109.1	I82 G590 S593 S607 E610 F611	I82-L605 HydrophobicContact CB-CD1 4.37Å; I82-L605 HydrophobicContact CD1-CD1 4.29Å; I82-L605 HydrophobicContact CD1-CD2 3.96Å; I82-L605 HydrophobicContact CG2-CD1 4.37Å; G590-L605 WeakPolarHBondContact CA-O 3.44Å; S593-L605 WeakPolarHBondContact OG-CB 3.42Å; S593-L605 PolarHBondContact OG-N 3.24Å; L605-S607 WeakPolarHBondContact CB-O 3.43Å; L605-E610 WeakPolarHBondContact CA-O 3.45Å; L605-E610 WeakPolarHBondContact CD2-O 3.4Å; L605-F611 HydrophobicContact CD2-CD1 3.82Å; L605-F611 HydrophobicContact CD2-CD2 3.83Å; L605-F611 HydrophobicContact CD2-CE1 3.61Å; L605-F611 HydrophobicContact CD2-CE2 3.61Å; L605-F611 HydrophobicContact CD2-CG 3.92Å; L605-F611 HydrophobicContact CD2-CZ 3.49Å; L605-F611 VanDerWaalsContact CD2-CZ 3.49Å; L605-F611 HydrophobicContact CG-CD1 4.06Å; L605-F611 HydrophobicContact CG-CE1 3.61Å; L605-F611 HydrophobicContact CG-CE2 4.42Å; L605-F611 HydrophobicContact CG-CZ 3.81Å
606	M	94.3	Very high	96.2	Very high	90 Å²	90	38.3 Å²	38.3	44%	0.443	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-32.4	172	-165.5	-167.3	-64.6	0	0	110.4	Y604 E610 E612	Y604-M606 HydrophobicContact CE2-CB 4.47Å; Y604-M606 PolarHBondContact O-N 3.4Å; M606-E610 HydrophobicContact CB-CG 4.39Å; M606-E610 PolarHBondContact N-O 3.34Å; M606-E610 VanDerWaalsContact N-O 3.11Å; M606-E612 HydrophobicContact CB-CB 4.4Å; M606-E612 HydrophobicContact CE-CB 3.69Å; M606-E612 HydrophobicContact CE-CG 3.83Å; M606-E612 WeakPolarHBondContact CE-OE1 3.26Å; M606-E612 WeakPolarHBondContact CE-OE2 3.39Å
607	S	94.6	Very high	96	Very high	30 Å²	30	37.6 Å²	37.6	21%	0.21	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	171.8	171.5	76.3	0	0	0	0	109	L605 S609 E610	L605-S607 WeakPolarHBondContact CB-O 3.43Å; S607-S609 PolarHBondContact O-N 2.96Å; S607-S609 VanDerWaalsContact O-N 3.12Å; S607-S609 PolarHBondContact OG-N 2.87Å; S607-S609 PolarHBondContact OG-OG 2.96Å; S607-E610 WeakPolarHBondContact CB-OE1 3.27Å; S607-E610 VanDerWaalsContact OG-CG 3.31Å; S607-E610 WeakPolarHBondContact OG-CG 3.43Å; S607-E610 PolarHBondContact OG-N 3.16Å; S607-E610 PolarHBondContact OG-OE1 3.02Å
608	P	91.9	Very high	95.8	Very high	98 Å²	98	42.3 Å²	42.3	64%	0.636	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.8	177.1	-25.8	36	0	0	0	113.9	H78	H78-P608 WeakPolarHBondContact CB-O 3.34Å
609	S	94.3	Very high	95.6	Very high	43 Å²	43	43.7 Å²	43.7	30%	0.301	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-7.8	-169.1	58.3	0	0	0	0	114.7	L77 H78 S607	L77-S609 WeakPolarHBondContact CB-O 3.34Å; L77-S609 WeakPolarHBondContact CD1-O 3.13Å; L77-S609 WeakPolarHBondContact CG-O 3.26Å; H78-S609 WeakPolarHBondContact CE1-CB 3.41Å; H78-S609 WeakPolarHBondContact ND1-CB 3.32Å; S607-S609 PolarHBondContact O-N 2.96Å; S607-S609 VanDerWaalsContact O-N 3.12Å; S607-S609 PolarHBondContact OG-N 2.87Å; S607-S609 PolarHBondContact OG-OG 2.96Å
610	E	95.8	Very high	95.5	Very high	102 Å²	102	44 Å²	44	48%	0.477	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	146.1	-175	83	-154.7	128.6	0	0	113.9	L605 M606 S607	L605-E610 WeakPolarHBondContact CA-O 3.45Å; L605-E610 WeakPolarHBondContact CD2-O 3.4Å; M606-E610 HydrophobicContact CB-CG 4.39Å; M606-E610 PolarHBondContact N-O 3.34Å; M606-E610 VanDerWaalsContact N-O 3.11Å; S607-E610 WeakPolarHBondContact CB-OE1 3.27Å; S607-E610 VanDerWaalsContact OG-CG 3.31Å; S607-E610 WeakPolarHBondContact OG-CG 3.43Å; S607-E610 PolarHBondContact OG-N 3.16Å; S607-E610 PolarHBondContact OG-OE1 3.02Å
611	F	97.8	Very high	95.4	Very high	33 Å²	33	49.6 Å²	49.6	15%	0.145	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	143.6	171.6	-77.6	-81.9	0	0	0	111.1	L77 I82 L133 T135 F603 Y604 L605	L77-F611 HydrophobicContact CD1-CD2 3.55Å; L77-F611 HydrophobicContact CD1-CE2 4.01Å; I82-F611 HydrophobicContact CD1-CE2 4.24Å; L133-F611 HydrophobicContact CD2-CD2 4.07Å; L133-F611 HydrophobicContact CD2-CE2 4.02Å; L133-F611 HydrophobicContact CD2-CZ 4.46Å; T135-F611 HydrophobicContact CG2-CE2 4.07Å; T135-F611 HydrophobicContact CG2-CZ 4.37Å; F603-F611 HydrophobicContact CB-CB 4.5Å; F603-F611 HydrophobicContact CB-CD1 3.79Å; F603-F611 HydrophobicContact CB-CE1 4.4Å; F603-F611 HydrophobicContact CB-CG 4.37Å; F603-F611 HydrophobicContact CD1-CB 4.44Å; Y604-F611 VanDerWaalsContact C-CD1 3.44Å; Y604-F611 CarbonylContact O-C 3.58Å; Y604-F611 WeakPolarHBondContact O-CA 3.18Å; Y604-F611 WeakPolarHBondContact O-CD1 3.12Å; L605-F611 HydrophobicContact CD2-CD1 3.82Å; L605-F611 HydrophobicContact CD2-CD2 3.83Å; L605-F611 HydrophobicContact CD2-CE1 3.61Å; L605-F611 HydrophobicContact CD2-CE2 3.61Å; L605-F611 HydrophobicContact CD2-CG 3.92Å; L605-F611 HydrophobicContact CD2-CZ 3.49Å; L605-F611 VanDerWaalsContact CD2-CZ 3.49Å; L605-F611 HydrophobicContact CG-CD1 4.06Å; L605-F611 HydrophobicContact CG-CE1 3.61Å; L605-F611 HydrophobicContact CG-CE2 4.42Å; L605-F611 HydrophobicContact CG-CZ 3.81Å
612	E	97.8	Very high	95.2	Very high	80 Å²	80	51.7 Å²	51.7	37%	0.374	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.1	158.7	-170.9	171.2	-137.5	0	0	109.7	F603 Y604 M606	F603-E612 VanDerWaalsContact CA-O 3.31Å; F603-E612 WeakPolarHBondContact CA-O 3.46Å; Y604-E612 HydrophobicContact CD1-CB 4.21Å; Y604-E612 HydrophobicContact CE1-CB 3.69Å; Y604-E612 HydrophobicContact CE1-CG 4.12Å; Y604-E612 WeakPolarHBondContact CE1-OE2 3.43Å; Y604-E612 PolarHBondContact N-O 2.83Å; Y604-E612 VanDerWaalsContact N-O 3.08Å; Y604-E612 PolarHBondContact O-N 3.34Å; Y604-E612 PolarHBondContact OH-OE2 3.09Å; M606-E612 HydrophobicContact CB-CB 4.4Å; M606-E612 HydrophobicContact CE-CB 3.69Å; M606-E612 HydrophobicContact CE-CG 3.83Å; M606-E612 WeakPolarHBondContact CE-OE1 3.26Å; M606-E612 WeakPolarHBondContact CE-OE2 3.39Å
613	R	97.9	Very high	95	Very high	60 Å²	60	55.2 Å²	55.2	23%	0.226	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.8	172.7	177	-178.3	-74.7	173.1	4.4	109.5	A147 G149 G602 F603 V622	A147-R613 PolarHBondContact O-NH2 2.83Å; G149-R613 PolarHBondContact O-NH1 2.86Å; G602-R613 CarbonylContact O-C 3.45Å; G602-R613 WeakPolarHBondContact O-CA 3.09Å; F603-R613 HydrophobicContact CD1-CB 3.98Å; F603-R613 HydrophobicContact CD1-CG 4.37Å; F603-R613 HydrophobicContact CE1-CB 3.97Å; F603-R613 HydrophobicContact CE1-CG 4.06Å; F603-R613 VanDerWaalsContact CE1-NH2 3.28Å; F603-R613 HydrophobicContact CZ-CG 4.37Å; R613-V622 VanDerWaalsContact NH1-CB 3.32Å
614	F	97.5	Very high	94.8	Very high	27 Å²	27	59.4 Å²	59.4	12%	0.118	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	157.5	169.9	63.9	-91.7	0	0	0	111.1	V566 F596 Q601 G602 Y604 L616	V566-F614 HydrophobicContact CG1-CE2 4.37Å; V566-F614 HydrophobicContact CG2-CE2 4.43Å; V566-F614 HydrophobicContact CG2-CZ 4.41Å; F596-F614 HydrophobicContact CD1-CE2 4.18Å; F596-F614 AromaticContact CD1-CZ 3.91Å; F596-F614 HydrophobicContact CD1-CZ 3.91Å; F596-F614 AromaticContact CE1-CE2 3.92Å; F596-F614 HydrophobicContact CE1-CE2 3.92Å; F596-F614 AromaticContact CE1-CZ 3.62Å; F596-F614 HydrophobicContact CE1-CZ 3.62Å; Q601-F614 CarbonylContact C-O 3.55Å; Q601-F614 VanDerWaalsContact CA-O 3.31Å; Q601-F614 WeakPolarHBondContact CA-O 3.27Å; Q601-F614 WeakPolarHBondContact CB-O 3.46Å; G602-F614 VanDerWaalsContact C-CE1 3.4Å; G602-F614 VanDerWaalsContact CA-CZ 3.47Å; G602-F614 PolarHBondContact N-O 2.96Å; G602-F614 WeakPolarHBondContact O-CD1 2.94Å; G602-F614 PolarHBondContact O-N 2.9Å; Y604-F614 HydrophobicContact CD1-CD1 4.08Å; Y604-F614 HydrophobicContact CD1-CE1 4.3Å; F614-L616 HydrophobicContact CD2-CG 4.34Å; F614-L616 HydrophobicContact CE2-CD1 4.42Å; F614-L616 HydrophobicContact CE2-CG 4.37Å
615	S	96.9	Very high	94.7	Very high	45 Å²	45	65.1 Å²	65.1	32%	0.315	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136.5	174.6	-171.6	0	0	0	0	111.7	S617 Y620	S615-S617 PolarHBondContact OG-N 2.9Å; S615-S617 PolarHBondContact OG-O 3.25Å; S615-Y620 WeakPolarHBondContact CB-O 2.96Å; S615-Y620 PolarHBondContact OG-O 3.11Å
616	L	96.1	Very high	94.6	Very high	27 Å²	27	68.2 Å²	68.2	14%	0.141	36%	0.36	C	S	.	.			trans	-107.7	-9.1	171.3	-51.5	169	0	0	0	111.2	F544 V558 V566 V568 Y580 G600 F614	F544-L616 HydrophobicContact CE1-CB 4.1Å; V558-L616 HydrophobicContact CG1-CD1 3.41Å; V558-L616 VanDerWaalsContact CG1-CD1 3.41Å; V558-L616 HydrophobicContact CG2-CD1 4.37Å; V566-L616 HydrophobicContact CG1-CD1 3.57Å; V566-L616 HydrophobicContact CG1-CD2 4.02Å; V566-L616 HydrophobicContact CG1-CG 4.36Å; V568-L616 HydrophobicContact CG2-CD1 4.01Å; Y580-L616 HydrophobicContact CD2-CD2 3.84Å; Y580-L616 HydrophobicContact CE2-CD2 4.44Å; G600-L616 WeakPolarHBondContact O-CA 3.35Å; G600-L616 WeakPolarHBondContact O-CB 3.41Å; G600-L616 PolarHBondContact O-N 3Å; F614-L616 HydrophobicContact CD2-CG 4.34Å; F614-L616 HydrophobicContact CE2-CD1 4.42Å; F614-L616 HydrophobicContact CE2-CG 4.37Å
617	S	94.1	Very high	94.6	Very high	10 Å²	10	67.2 Å²	67.2	7%	0.07	36%	0.356	C	S	.	.			trans	-97.5	135.7	-176.3	-179.6	0	0	0	0	110.5	Q599 G600 S615 R619	Q599-S617 WeakPolarHBondContact O-CB 3.27Å; G600-S617 PolarHBondContact O-N 2.88Å; S615-S617 PolarHBondContact OG-N 2.9Å; S615-S617 PolarHBondContact OG-O 3.25Å; S617-R619 PolarHBondContact O-N 3.27Å; S617-R619 PolarHBondContact OG-N 3.06Å
618	T	92.4	Very high	94.6	Very high	104 Å²	104	71.1 Å²	71.1	64%	0.638	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-12.8	177.3	53	0	0	0	0	113.5
619	R	89.9	Confident	94.4	Very high	88 Å²	88	73.8 Å²	73.8	33%	0.332	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-20.8	179.1	-72.7	-165.9	-179.4	-168.5	5	113.9	S546 T549 E550 Y552 S617	S546-R619 PolarHBondContact O-NE 2.87Å; S546-R619 PolarHBondContact O-NH2 3.01Å; T549-R619 PolarHBondContact O-NH2 2.86Å; E550-R619 VanDerWaalsContact C-NH2 3.33Å; E550-R619 VanDerWaalsContact O-CZ 3.32Å; E550-R619 PolarHBondContact O-NH1 3.26Å; E550-R619 PolarHBondContact O-NH2 3.09Å; Y552-R619 PolarHBondContact O-NH2 2.76Å; S617-R619 PolarHBondContact O-N 3.27Å; S617-R619 PolarHBondContact OG-N 3.06Å
620	Y	89.9	Confident	93.8	Very high	35 Å²	35	75.8 Å²	75.8	14%	0.137	40%	0.401	C	S	.	.			trans	-119.4	104.8	-171.6	-67.3	-90.9	0	0	0	109.6	P128 Q129 Q599 S615	P128-Y620 HydrophobicContact CG-CE1 4.42Å; Q129-Y620 PolarHBondContact OE1-OH 3.16Å; Q599-Y620 HydrophobicContact CB-CD1 4.48Å; Q599-Y620 HydrophobicContact CB-CD2 3.9Å; Q599-Y620 HydrophobicContact CB-CE1 4.2Å; Q599-Y620 HydrophobicContact CB-CE2 3.59Å; Q599-Y620 HydrophobicContact CB-CG 4.34Å; Q599-Y620 HydrophobicContact CG-CE1 4.24Å; Q599-Y620 HydrophobicContact CG-CE2 3.98Å; S615-Y620 WeakPolarHBondContact CB-O 2.96Å; S615-Y620 PolarHBondContact OG-O 3.11Å
621	L	92.6	Very high	92.7	Very high	120 Å²	120	76.9 Å²	76.9	63%	0.628	42%	0.417	S	S	*	.			trans	-132.1	102.8	171.7	-179	65.2	0	0	0	108.1	E623	L621-E623 HydrophobicContact CG-CG 4.32Å
622	V	94.3	Very high	91.1	Very high	46 Å²	46	82.9 Å²	82.9	28%	0.279	45%	0.45	S	S	.	.			trans	-104.6	105.2	179	-175.1	0	0	0	0	108.2	G149 V150 R613	G149-V622 VanDerWaalsContact C-CG1 3.4Å; G149-V622 WeakPolarHBondContact O-CG1 3.38Å; V150-V622 HydrophobicContact CG2-CG1 3.89Å; R613-V622 VanDerWaalsContact NH1-CB 3.32Å
623	E	93.8	Very high	89.2	Confident	75 Å²	75	84 Å²	84	35%	0.35	46%	0.464	S	S	.	.			trans	-138.9	148.6	-177.1	64.3	-178.8	-179.2	0	0	110.1	V150 L621 R625	V150-E623 WeakPolarHBondContact CG2-O 3.38Å; L621-E623 HydrophobicContact CG-CG 4.32Å; E623-R625 HydrophobicContact CG-CG 4.33Å; E623-R625 PolarHBondContact O-N 3.4Å; E623-R625 IonicContact OE1-CZ 3.26Å; E623-R625 VanDerWaalsContact OE1-CZ 3.3Å; E623-R625 IonicContact OE1-NE 3.4Å; E623-R625 PolarHBondContact OE1-NE 2.98Å; E623-R625 IonicContact OE1-NH2 2.66Å; E623-R625 PolarHBondContact OE1-NH2 2.94Å
624	P	94.4	Very high	87.2	Confident	95 Å²	95	85.8 Å²	85.8	62%	0.617	48%	0.483	S	S	*	.			trans	-64.6	128.2	173.7	25.5	-31.7	0	0	0	110.5	V150	V150-P624 HydrophobicContact CG1-CB 3.99Å; V150-P624 HydrophobicContact CG1-CG 4.48Å
625	R	95.2	Very high	84.7	Confident	136 Å²	136	90.9 Å²	90.9	51%	0.513	52%	0.517	S	S	.	.			trans	-126.5	111.7	167.3	-66.1	-175.6	176.7	-170.2	-0.4	107.6	N122 L123 A124 E623	N122-R625 PolarHBondContact OD1-O 3.11Å; L123-R625 CarbonylContact C-O 3.53Å; L123-R625 WeakPolarHBondContact CA-O 3.37Å; L123-R625 HydrophobicContact CB-CB 4.36Å; L123-R625 PolarHBondContact N-O 2.88Å; A124-R625 HydrophobicContact CB-CB 4.3Å; A124-R625 PolarHBondContact N-O 2.95Å; E623-R625 HydrophobicContact CG-CG 4.33Å; E623-R625 PolarHBondContact O-N 3.4Å; E623-R625 IonicContact OE1-CZ 3.26Å; E623-R625 VanDerWaalsContact OE1-CZ 3.3Å; E623-R625 IonicContact OE1-NE 3.4Å; E623-R625 PolarHBondContact OE1-NE 2.98Å; E623-R625 IonicContact OE1-NH2 2.66Å; E623-R625 PolarHBondContact OE1-NH2 2.94Å
626	C	95.3	Very high	82.1	Confident	89 Å²	89	96.8 Å²	96.8	60%	0.601	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.4	158.6	-175.3	59.3	0	0	0	0	112.3	Q121	Q121-C626 CarbonylContact O-C 3.55Å; Q121-C626 WeakPolarHBondContact O-CA 3.34Å; Q121-C626 VanDerWaalsContact O-CB 3.29Å; Q121-C626 WeakPolarHBondContact O-CB 3.47Å
627	L	94.8	Very high	79.4	Confident	69 Å²	69	100.5 Å²	100.5	36%	0.361	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.6	134.1	174.1	176.5	66.8	0	0	0	109	G120 Q121 L123 E629	G120-L627 CarbonylContact C-O 3.56Å; G120-L627 VanDerWaalsContact CA-O 3.27Å; G120-L627 WeakPolarHBondContact CA-O 3.48Å; Q121-L627 PolarHBondContact N-O 3.43Å; Q121-L627 PolarHBondContact O-N 3.21Å; L123-L627 HydrophobicContact CD1-CB 3.91Å; L123-L627 HydrophobicContact CG-CB 4.32Å; L627-E629 HydrophobicContact CD1-CG 4.31Å; L627-E629 HydrophobicContact CD2-CG 4.13Å; L627-E629 HydrophobicContact CG-CG 4.08Å
628	V	94	Very high	76.6	Confident	112 Å²	112	107 Å²	107	68%	0.679	60%	0.599	S	S	*	*			trans	-128	109.6	172	-175.4	0	0	0	0	107.5
629	E	88.3	Confident	74.4	Confident	153 Å²	153	110.3 Å²	110.3	72%	0.715	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-91.5	136	174.9	-63.7	-171.7	163.4	0	0	110	L627	L627-E629 HydrophobicContact CD1-CG 4.31Å; L627-E629 HydrophobicContact CD2-CG 4.13Å; L627-E629 HydrophobicContact CG-CG 4.08Å
630	A	81.4	Confident	71.9	Confident	86 Å²	86	114.8 Å²	114.8	71%	0.711	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-67.9	140.5	171.7	0	0	0	0	0	109.3	L632	A630-L632 PolarHBondContact O-N 3.41Å
631	P	71.6	Confident	69.1	Low	124 Å²	124	122.3 Å²	122.3	81%	0.805	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-55	126.2	171.6	-19.7	29.6	0	0	0	109.4
632	L	65.9	Low	66.2	Low	160 Å²	160	122.2 Å²	122.2	84%	0.838	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-56.1	134.9	173.1	-74.2	165.8	0	0	0	108.5	A630	A630-L632 PolarHBondContact O-N 3.41Å
633	P	56.3	Low	63.3	Low	102 Å²	102	129.3 Å²	129.3	66%	0.662	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-53.9	140.6	174.8	-16.2	24.5	0	0	0	109	V635	P633-V635 PolarHBondContact O-N 2.82Å
634	P	56.3	Low	60.3	Low	98 Å²	98	134 Å²	134	64%	0.636	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-56.1	117.4	173.3	22.6	-30.5	0	0	0	107.6	F636	P634-F636 VanDerWaalsContact C-N 3.27Å; P634-F636 HydrophobicContact CG-CE2 4.26Å; P634-F636 PolarHBondContact O-N 3.43Å
635	V	45.1	Very low	57.3	Low	135 Å²	135	138.2 Å²	138.2	82%	0.818	74%	0.74	S	S	*	*			trans	-64.4	96.3	172.5	-179.7	0	0	0	0	105.7	P633 S637	P633-V635 PolarHBondContact O-N 2.82Å; V635-S637 VanDerWaalsContact C-N 3.32Å; V635-S637 PolarHBondContact O-N 3.12Å
636	F	41.9	Very low	54.1	Low	169 Å²	169	135.3 Å²	135.3	74%	0.741	75%	0.752	S	S	*	*			trans	-62.4	102.8	163.8	-78.3	-82.2	0	0	0	106.2	P634 N638	P634-F636 VanDerWaalsContact C-N 3.27Å; P634-F636 HydrophobicContact CG-CE2 4.26Å; P634-F636 PolarHBondContact O-N 3.43Å; F636-N638 PolarHBondContact O-N 3.3Å
637	S	39.9	Very low	50.9	Low	104 Å²	104	136.2 Å²	136.2	73%	0.727	77%	0.766	S	S	*	*			trans	-64.8	79.9	163.8	44.3	0	0	0	0	108	V635 Q639	V635-S637 VanDerWaalsContact C-N 3.32Å; V635-S637 PolarHBondContact O-N 3.12Å; S637-Q639 PolarHBondContact O-N 2.87Å
638	N	36	Very low	47.8	Very low	147 Å²	147	138.5 Å²	138.5	79%	0.786	79%	0.788	S	S	*	*			trans	-67.1	82	164.7	-90.8	-8.4	0	0	0	108	F636 H640	F636-N638 PolarHBondContact O-N 3.3Å; N638-H640 PolarHBondContact O-N 2.87Å
639	Q	44.8	Very low	44.6	Very low	174 Å²	174	139 Å²	139	81%	0.813	80%	0.796	S	S	*	*			trans	-68.1	81.1	153.2	-74	-170.8	-0.1	0	0	107.8	S637	S637-Q639 PolarHBondContact O-N 2.87Å
640	H	38.9	Very low	41.8	Very low	182 Å²	182	135.9 Å²	135.9	84%	0.843	80%	0.797	S	S	*	*			trans	-164.3	85.6	150.5	-88.8	-27.7	0	0	0	108.8	N638	N638-H640 PolarHBondContact O-N 2.87Å
641	Q	31	Very low	39.3	Very low	192 Å²	192	139.2 Å²	139.2	90%	0.897	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-97.5	120.6	157.8	-123.4	174	-2	0	0	107.4
642	P	32.1	Very low	37.2	Very low	119 Å²	119	144.2 Å²	144.2	77%	0.773	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71.7	135	168.1	28.8	-28.6	0	0	0	109
643	K	33.1	Very low	35.2	Very low	194 Å²	194	142.5 Å²	142.5	84%	0.843	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-53.9	134.5	174.8	-76.1	177.1	172	-177.8	0	111.3
644	L	30.7	Very low	33.8	Very low	174 Å²	174	144.1 Å²	144.1	91%	0.911	81%	0.813	S	S	*	*			trans	-137.1	111.3	152.6	-106.6	144.8	0	0	0	108.1
645	E	30.5	Very low	32.6	Very low	183 Å²	183	147.1 Å²	147.1	86%	0.855	82%	0.818	S	S	*	*			trans	-73.5	144.8	169.2	-70.9	176.1	155.8	0	0	110
646	G	28.2	Very low	31.7	Very low	75 Å²	75	148.9 Å²	148.9	77%	0.773	82%	0.823	S	S	*	*			trans	165.1	87.4	165.4	0	0	0	0	0	117.1
647	A	29.1	Very low	31.2	Very low	109 Å²	109	145.9 Å²	145.9	90%	0.901	82%	0.819	S	S	*	*			trans	76.1	128.5	144.3	0	0	0	0	0	121.5
648	S	28.3	Very low	30.9	Very low	116 Å²	116	149.8 Å²	149.8	81%	0.811	83%	0.826	S	S	*	*			trans	-64.2	147.3	175.8	54.4	0	0	0	0	115.8
649	S	27.8	Very low	31.1	Very low	122 Å²	122	149.9 Å²	149.9	85%	0.853	83%	0.826	S	S	*	*				-173.2	132.1	113.8	52.3	0	0	0	0	111.1
650	A	29.3	Very low	30.8	Very low	89 Å²	89	146 Å²	146	74%	0.736	82%	0.823	S	S	*	*			trans	-81	144.2	173.1	0	0	0	0	0	110.3
651	L	27.7	Very low	30.8	Very low	156 Å²	156	145.8 Å²	145.8	82%	0.817	82%	0.823	S	S	*	*			trans	-171.2	104.6	139.2	-99.6	145.5	0	0	0	112.6
652	R	28	Very low	31.4	Very low	229 Å²	229	139.7 Å²	139.7	86%	0.864	80%	0.802	S	S	*	*			trans	55.4	105.1	137.9	-67.8	-179.5	-173.4	178	0.1	120.4
653	C	23.8	Very low	31.9	Very low	123 Å²	123	137 Å²	137	83%	0.831	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.9	133.7	145.7	-176.7	0	0	0	0	110.3
654	T	28	Very low	32.3	Very low	136 Å²	136	131 Å²	131	83%	0.834	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-92.4	129.2	158.4	37	0	0	0	0	108.7
655	Q	30	Very low	32.9	Very low	161 Å²	161	132.7 Å²	132.7	75%	0.752	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-58.6	149.9	176.3	-68.4	161.6	-52.5	0	0	111.9
656	D	27.8	Very low	33.6	Very low	172 Å²	172	133 Å²	133	92%	0.92	76%	0.763	S	S	*	*				-141.9	138.7	120.1	-93.5	-30.2	0	0	0	110
657	T	30.6	Very low	34.4	Very low	106 Å²	106	134.8 Å²	134.8	65%	0.65	76%	0.759	S	S	*	*			trans	-107.2	133.5	-161.9	41.9	0	0	0	0	110.4
658	E	32.9	Very low	34.9	Very low	187 Å²	187	136.5 Å²	136.5	87%	0.874	75%	0.75	S	S	*	*			trans	-171.4	89	147.9	-108.7	174.7	-156.3	0	0	108.3
659	D	40.6	Very low	35.5	Very low	149 Å²	149	138.1 Å²	138.1	80%	0.797	74%	0.744	S	S	*	*			trans	-171.5	42.4	163.6	-100.4	-24.1	0	0	0	113
660	A	39.1	Very low	36.3	Very low	91 Å²	91	139.3 Å²	139.3	75%	0.752	74%	0.736	S	S	*	*	S	Bend	trans	-97.1	-10.8	-179.1	0	0	0	0	0	115
661	E	39.2	Very low	36.8	Very low	178 Å²	178	138.7 Å²	138.7	83%	0.832	73%	0.731	S	S	*	*	S	Bend	trans	-97.4	-17	-177.8	-95.1	-174.4	152.3	0	0	114.9
662	S	43.4	Very low	37.6	Very low	65 Å²	65	137.7 Å²	137.7	46%	0.455	73%	0.726	S	S	.	*	H	α-helix	trans	-83.3	-28.9	-179	-166.2	0	0	0	0	113.1
663	A	42.8	Very low	38.4	Very low	63 Å²	63	133.6 Å²	133.6	52%	0.521	72%	0.72	S	S	.	*	H	α-helix	trans	-75.8	-31.5	-179.3	0	0	0	0	0	113.3	R665 V667	A663-R665 PolarHBondContact O-N 2.81Å; A663-V667 WeakPolarHBondContact O-CG2 3.46Å; A663-V667 PolarHBondContact O-N 2.92Å
664	A	41.5	Very low	39.4	Very low	66 Å²	66	134.3 Å²	134.3	55%	0.545	72%	0.716	S	S	.	*	H	α-helix	trans	-72	-27.4	-178	0	0	0	0	0	113.5
665	R	41.9	Very low	40.6	Very low	211 Å²	211	132.2 Å²	132.2	80%	0.796	70%	0.7	S	S	*	*	H	α-helix	trans	-77.4	-35.3	175.8	-82.8	-178	173.9	160.8	0.4	113.2	A663 V667	A663-R665 PolarHBondContact O-N 2.81Å; R665-V667 PolarHBondContact O-N 2.7Å
666	R	45.5	Very low	41.6	Very low	190 Å²	190	132.2 Å²	132.2	72%	0.717	70%	0.7	S	S	*	*	H	α-helix	trans	-75	-22	-178.7	-69.2	-174.2	-169.5	179.6	4	114.2
667	V	45.3	Very low	42.6	Very low	111 Å²	111	131.8 Å²	131.8	67%	0.673	69%	0.69	S	S	*	*	H	α-helix	trans	-83.8	-25.7	177.9	177.8	0	0	0	0	112.1	A663 R665	A663-V667 WeakPolarHBondContact O-CG2 3.46Å; A663-V667 PolarHBondContact O-N 2.92Å; R665-V667 PolarHBondContact O-N 2.7Å
668	M	39.1	Very low	43.7	Very low	145 Å²	145	129.7 Å²	129.7	71%	0.714	68%	0.677	S	S	*	*	H	α-helix	trans	-81.2	-29	-177.6	-152.3	173.1	-78.6	0	0	112.9
669	E	42.3	Very low	44.6	Very low	150 Å²	150	126.2 Å²	126.2	70%	0.701	66%	0.663	S	S	*	*	H	α-helix	trans	-78.1	-27.7	179	-145.2	169.3	-161.8	0	0	112.4	A671	E669-A671 VanDerWaalsContact C-N 3.34Å; E669-A671 PolarHBondContact O-N 3.3Å
670	H	42.9	Very low	45.2	Very low	148 Å²	148	124.5 Å²	124.5	69%	0.685	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-7.9	-178.3	-135.7	-71.4	0	0	0	114.2
671	A	41.2	Very low	46	Very low	76 Å²	76	126.9 Å²	126.9	63%	0.628	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-12.3	179.7	0	0	0	0	0	113.9	E669	E669-A671 VanDerWaalsContact C-N 3.34Å; E669-A671 PolarHBondContact O-N 3.3Å
672	L	43.6	Very low	46.8	Very low	134 Å²	134	122.8 Å²	122.8	70%	0.702	63%	0.632	S	S	*	*	S	Bend	trans	-98.1	-5	-174.1	-79.4	165.6	0	0	0	115
673	L	45.9	Very low	47.2	Very low	143 Å²	143	125.2 Å²	125.2	75%	0.749	64%	0.636	S	S	*	*	S	Bend	trans	-112.7	2	-172.9	-74	168.8	0	0	0	115.6
674	N	44.9	Very low	47.5	Very low	138 Å²	138	130.2 Å²	130.2	74%	0.738	65%	0.646	S	S	*	*	S	Bend	trans	-124	11.3	-174.9	-80.8	-7.2	0	0	0	115.5
675	D	52.8	Low	47.9	Very low	92 Å²	92	131.4 Å²	131.4	49%	0.492	65%	0.65	S	S	.	*			trans	-107.1	101.2	177.8	-154	-22.9	0	0	0	111.1	K677 V678	D675-K677 PolarHBondContact O-N 3.4Å; D675-K677 PolarHBondContact OD1-N 2.79Å; D675-V678 HydrophobicContact CB-CG2 4.17Å; D675-V678 PolarHBondContact O-N 3.29Å
676	E	49.6	Very low	48.1	Very low	162 Å²	162	128 Å²	128	76%	0.757	65%	0.647	S	S	*	*	H	α-helix	trans	-56.4	-21.7	179.3	-74.5	-174.6	153.5	0	0	113	L680	E676-L680 PolarHBondContact O-N 3Å
677	K	50.2	Low	48.2	Very low	163 Å²	163	126.4 Å²	126.4	71%	0.709	65%	0.648	S	S	*	*	H	α-helix	trans	-68.2	-34.6	174.8	-89.8	-176.3	172.9	179.7	0	113.5	D675 E681	D675-K677 PolarHBondContact O-N 3.4Å; D675-K677 PolarHBondContact OD1-N 2.79Å; K677-E681 PolarHBondContact O-N 2.83Å
678	V	53.2	Low	48	Very low	62 Å²	62	123.8 Å²	123.8	38%	0.376	64%	0.643	S	S	.	*	H	α-helix	trans	-74	-36.6	-177.8	177.5	0	0	0	0	110.6	D675 E681 I682	D675-V678 HydrophobicContact CB-CG2 4.17Å; D675-V678 PolarHBondContact O-N 3.29Å; V678-E681 PolarHBondContact O-N 2.87Å; V678-I682 HydrophobicContact CG1-CD1 3.96Å; V678-I682 VanDerWaalsContact O-CG1 3.29Å; V678-I682 WeakPolarHBondContact O-CG1 3.37Å; V678-I682 PolarHBondContact O-N 3.32Å
679	L	52.2	Low	48	Very low	113 Å²	113	124.4 Å²	124.4	59%	0.592	65%	0.65	S	S	*	*	H	α-helix	trans	-65.2	-39.1	174.9	-80.6	162.5	0	0	0	112.3	Q683	L679-Q683 WeakPolarHBondContact O-CB 3.46Å; L679-Q683 PolarHBondContact O-N 3.19Å; L679-Q683 VanDerWaalsContact O-N 3.08Å
680	L	52	Low	47.8	Very low	114 Å²	114	125.4 Å²	125.4	60%	0.597	65%	0.654	S	S	*	*	H	α-helix	trans	-67.9	-32.8	175.1	-84.5	160.4	0	0	0	113	E676 K684	E676-L680 PolarHBondContact O-N 3Å; L680-K684 WeakPolarHBondContact O-CB 3.38Å; L680-K684 PolarHBondContact O-N 3.39Å; L680-K684 VanDerWaalsContact O-N 3.17Å
681	E	57	Low	47.3	Very low	141 Å²	141	124.8 Å²	124.8	66%	0.659	66%	0.661	S	S	*	*	H	α-helix	trans	-74.7	-37.1	178.4	-156.6	163	-153.3	0	0	111.7	K677 V678 K684 S685	K677-E681 PolarHBondContact O-N 2.83Å; V678-E681 PolarHBondContact O-N 2.87Å; E681-K684 PolarHBondContact O-N 2.83Å; E681-S685 PolarHBondContact O-N 3.43Å; E681-S685 PolarHBondContact O-OG 2.77Å
682	I	55.8	Low	46.8	Very low	91 Å²	91	124.7 Å²	124.7	47%	0.467	66%	0.66	S	S	.	*	H	α-helix	trans	-65.3	-41.4	173.1	-68.2	166.7	0	0	0	111.3	V678 K684 S685 L686	V678-I682 HydrophobicContact CG1-CD1 3.96Å; V678-I682 VanDerWaalsContact O-CG1 3.29Å; V678-I682 WeakPolarHBondContact O-CG1 3.37Å; V678-I682 PolarHBondContact O-N 3.32Å; I682-K684 VanDerWaalsContact C-N 3.3Å; I682-K684 PolarHBondContact O-N 2.79Å; I682-S685 PolarHBondContact O-N 3.06Å; I682-L686 HydrophobicContact CG2-CD1 4.05Å; I682-L686 PolarHBondContact O-N 2.93Å; I682-L686 VanDerWaalsContact O-N 3.15Å
683	Q	50.6	Low	46.1	Very low	117 Å²	117	127.7 Å²	127.7	55%	0.547	67%	0.668	S	S	.	*	H	α-helix	trans	-66.7	-34	178.6	-153.4	169	1.1	0	0	111.6	L679 L686 E687	L679-Q683 WeakPolarHBondContact O-CB 3.46Å; L679-Q683 PolarHBondContact O-N 3.19Å; L679-Q683 VanDerWaalsContact O-N 3.08Å; Q683-L686 PolarHBondContact O-N 2.89Å; Q683-E687 PolarHBondContact O-N 2.73Å
684	K	49.3	Very low	45.9	Very low	168 Å²	168	126.5 Å²	126.5	73%	0.73	67%	0.669	S	S	*	*	H	α-helix	trans	-72.6	-30	175.1	-139.5	176.5	-172.8	179.9	0	113.5	L680 E681 I682	L680-K684 WeakPolarHBondContact O-CB 3.38Å; L680-K684 PolarHBondContact O-N 3.39Å; L680-K684 VanDerWaalsContact O-N 3.17Å; E681-K684 PolarHBondContact O-N 2.83Å; I682-K684 VanDerWaalsContact C-N 3.3Å; I682-K684 PolarHBondContact O-N 2.79Å
685	S	50.4	Low	45.1	Very low	90 Å²	90	123.2 Å²	123.2	63%	0.629	67%	0.668	S	S	*	*	H	α-helix	trans	-74.4	-27	173.3	-71.3	0	0	0	0	113.2	E681 I682	E681-S685 PolarHBondContact O-N 3.43Å; E681-S685 PolarHBondContact O-OG 2.77Å; I682-S685 PolarHBondContact O-N 3.06Å
686	L	45.7	Very low	43.9	Very low	139 Å²	139	126.4 Å²	126.4	73%	0.728	69%	0.685	S	S	*	*	H	α-helix	trans	-79.6	-23.5	177.8	-80	158.4	0	0	0	113.5	I682 Q683	I682-L686 HydrophobicContact CG2-CD1 4.05Å; I682-L686 PolarHBondContact O-N 2.93Å; I682-L686 VanDerWaalsContact O-N 3.15Å; Q683-L686 PolarHBondContact O-N 2.89Å
687	E	48.2	Very low	43	Very low	157 Å²	157	125.4 Å²	125.4	73%	0.734	69%	0.685	S	S	*	*	S	Bend	trans	-91	-6	176.9	-68.6	-179.9	172.6	0	0	113.6	Q683	Q683-E687 PolarHBondContact O-N 2.73Å
688	G	40.7	Very low	42.1	Very low	56 Å²	56	123.6 Å²	123.6	58%	0.577	69%	0.687	S	S	*	*	S	Bend	trans	-83.4	-12.5	-175.6	0	0	0	0	0	116.6	Q690	G688-Q690 PolarHBondContact O-N 3.09Å
689	D	38.7	Very low	41.1	Very low	159 Å²	159	129 Å²	129	85%	0.85	71%	0.705	S	S	*	*			trans	-101.9	39.3	-173.7	-90.2	-7.8	0	0	0	113.7
690	Q	40	Very low	40.1	Very low	170 Å²	170	130.7 Å²	130.7	79%	0.794	72%	0.715	S	S	*	*			trans	-123.1	92.8	157.1	-74.8	-171.9	13.2	0	0	109.5	G688	G688-Q690 PolarHBondContact O-N 3.09Å
691	T	31.2	Very low	39.2	Very low	135 Å²	135	129.5 Å²	129.5	83%	0.828	72%	0.722	S	S	*	*				160.4	138.8	114.6	43.5	0	0	0	0	113.8
692	A	30.1	Very low	38.3	Very low	74 Å²	74	129.4 Å²	129.4	61%	0.612	73%	0.73	S	S	*	*			trans	89.6	134.2	147.2	0	0	0	0	0	117.3
693	F	30.1	Very low	37.5	Very low	198 Å²	198	135 Å²	135	87%	0.868	77%	0.768	S	S	*	*			cis	-170.8	-174.5	39.1	-94.3	-74.7	0	0	0	108.9
694	P	40.4	Very low	36.8	Very low	117 Å²	117	135.9 Å²	135.9	76%	0.76	78%	0.78	S	S	*	*			cis	-129.3	171.5	-15.3	24.1	-0.5	0	0	0	114
695	G	28.3	Very low	36.2	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	78%	0.782	S	S	*	*			trans	-76.5	158.8	174.3	0	0	0	0	0	115
696	N	28.8	Very low	35.4	Very low	159 Å²	159	136.7 Å²	136.7	85%	0.85	79%	0.791	S	S	*	*			trans	-156.2	146.2	139.7	-123.6	-14.4	0	0	0	112.2
697	N	30.2	Very low	34.8	Very low	141 Å²	141	136.5 Å²	136.5	75%	0.754	79%	0.794	S	S	*	*			trans	-53	157	-176.5	-69.9	-56.5	0	0	0	115.9
698	V	31.4	Very low	33.9	Very low	124 Å²	124	135.3 Å²	135.3	75%	0.752	80%	0.798	S	S	*	*				164.9	118.4	106	164.4	0	0	0	0	112.3
699	K	31.9	Very low	33.5	Very low	175 Å²	175	140.5 Å²	140.5	76%	0.761	81%	0.813	S	S	*	*			trans	45.5	132.4	138.2	-61.6	178.5	175.9	175.8	0	123.8
700	N	31.8	Very low	33.1	Very low	150 Å²	150	139.2 Å²	139.2	80%	0.802	81%	0.81	S	S	*	*			trans	54.1	123	130.1	-63.7	-1.7	0	0	0	120.9
701	A	32.3	Very low	32.6	Very low	89 Å²	89	136.8 Å²	136.8	74%	0.736	81%	0.811	S	S	*	*				146.9	125.1	101.2	0	0	0	0	0	112.6
702	V	37.3	Very low	32.7	Very low	138 Å²	138	137 Å²	137	84%	0.836	81%	0.81	S	S	*	*				34.6	113	129	-166.5	0	0	0	0	117.1
703	V	39.5	Very low	32.9	Very low	209 Å²	209	142.7 Å²	142.7	100%	1.267	83%	0.828	S	S	*	*				-163.8	0	88.1	164.3	0	0	0	0	107.3

Retrieved 703 of 703 residues in 1077.5 ms (Link to these results)

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