A0A087XEB7_POEFO Loading...

Bardet-Biedl syndrome 2 protein homolog

AlphaFold DB , UniProt , Accession A0A087XEB7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 710 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	72.2	Confident	88.6	Confident	67 Å²	67	60.5 Å²	60.5	33%	0.33	32%	0.322	S	S	.	.				0	148.1	0	-75.8	177.8	-91.1	0	0	109	L251 F280 A319 L327	M1-L251 HydrophobicContact CE-CD1 4.44Å; M1-L251 HydrophobicContact CE-CD2 3.55Å; M1-L251 HydrophobicContact CE-CG 3.57Å; M1-L251 HydrophobicContact SD-CD1 4.09Å; M1-L251 HydrophobicContact SD-CD2 4.25Å; M1-L251 HydrophobicContact SD-CG 3.81Å; M1-F280 HydrophobicContact CB-CD2 4.11Å; M1-F280 HydrophobicContact CB-CE2 3.74Å; M1-F280 HydrophobicContact CB-CZ 4.46Å; M1-F280 HydrophobicContact CE-CB 3.92Å; M1-F280 HydrophobicContact CE-CD2 3.79Å; M1-F280 HydrophobicContact CE-CG 3.95Å; M1-A319 HydrophobicContact CG-CB 4.41Å; M1-A319 HydrophobicContact SD-CB 3.93Å; M1-L327 HydrophobicContact CG-CD1 4.19Å
2	V	83.4	Confident	89	Confident	118 Å²	118	62.3 Å²	62.3	72%	0.715	33%	0.325	S	S	*	.			trans	-121.2	143.6	-179.3	179.8	0	0	0	0	107.7	I4	V2-I4 PolarHBondContact O-N 3.48Å
3	P	87.8	Confident	89.6	Confident	40 Å²	40	57.6 Å²	57.6	26%	0.26	30%	0.301	S	S	.	.			trans	-58.4	129.4	174.9	24.7	-35.6	0	0	0	110.8	F5 R314 G315 Y316	P3-F5 VanDerWaalsContact C-N 3.33Å; P3-R314 HydrophobicContact CB-CB 4.07Å; P3-R314 HydrophobicContact CB-CG 4.42Å; P3-G315 CarbonylContact C-O 3.6Å; P3-G315 WeakPolarHBondContact CA-O 3.46Å; P3-Y316 HydrophobicContact CB-CD1 4.4Å; P3-Y316 HydrophobicContact CB-CE1 3.95Å
4	I	92.1	Very high	90	Very high	55 Å²	55	56.4 Å²	56.4	28%	0.282	30%	0.295	S	S	.	.	S	Bend	trans	-77.3	-22.6	179.1	51.8	146.7	0	0	0	112.6	V2 Q303 G315 L317	V2-I4 PolarHBondContact O-N 3.48Å; I4-Q303 HydrophobicContact CD1-CB 4.42Å; I4-Q303 HydrophobicContact CD1-CG 3.72Å; I4-G315 VanDerWaalsContact CG1-C 3.45Å; I4-G315 WeakPolarHBondContact CG1-O 3.38Å; I4-G315 PolarHBondContact N-O 2.81Å; I4-L317 HydrophobicContact CD1-CG 3.95Å; I4-L317 HydrophobicContact CG2-CB 4.26Å; I4-L317 HydrophobicContact CG2-CD1 4.21Å; I4-L317 HydrophobicContact CG2-CG 4.18Å
5	F	91.3	Very high	90.2	Very high	35 Å²	35	55.3 Å²	55.3	15%	0.154	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151	167	67.3	-97.2	0	0	0	109	P3 L7 Y296 R297 Q303 I305 V313 R314 G315	P3-F5 VanDerWaalsContact C-N 3.33Å; F5-L7 HydrophobicContact CD2-CD2 4.16Å; F5-L7 HydrophobicContact CE2-CD2 4.09Å; F5-Y296 AromaticContact CE1-CD1 3.96Å; F5-Y296 HydrophobicContact CE1-CD1 3.96Å; F5-Y296 AromaticContact CE2-CD1 3.91Å; F5-Y296 HydrophobicContact CE2-CD1 3.91Å; F5-Y296 HydrophobicContact CE2-CE1 4.12Å; F5-Y296 AromaticContact CZ-CD1 3.5Å; F5-Y296 HydrophobicContact CZ-CD1 3.5Å; F5-Y296 VanDerWaalsContact CZ-CD1 3.5Å; F5-Y296 HydrophobicContact CZ-CE1 4.14Å; F5-Y296 HydrophobicContact CZ-CG 4.16Å; F5-R297 HydrophobicContact CD1-CG 4.26Å; F5-Q303 VanDerWaalsContact CE1-OE1 3.29Å; F5-I305 HydrophobicContact CZ-CG1 4.31Å; F5-V313 HydrophobicContact CE2-CG1 4.19Å; F5-R314 WeakPolarHBondContact O-CA 3.19Å; F5-G315 VanDerWaalsContact CE1-CA 3.46Å; F5-G315 VanDerWaalsContact CZ-CA 3.5Å; F5-G315 PolarHBondContact O-N 3.01Å
6	T	93.1	Very high	90.4	Very high	80 Å²	80	57.7 Å²	57.7	49%	0.491	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	129.7	171.2	-58.2	0	0	0	0	107.5	V313 R314	T6-V313 CarbonylContact C-O 3.58Å; T6-V313 WeakPolarHBondContact CA-O 3.16Å; T6-R314 HydrophobicContact CG2-CG 4.03Å
7	L	92.6	Very high	90.6	Very high	37 Å²	37	55.9 Å²	55.9	19%	0.194	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.1	175.8	64.3	86.1	0	0	0	109.9	F5 L9 Y296 V313	F5-L7 HydrophobicContact CD2-CD2 4.16Å; F5-L7 HydrophobicContact CE2-CD2 4.09Å; L7-L9 HydrophobicContact CD1-CD1 4.25Å; L7-L9 HydrophobicContact CD1-CD2 3.46Å; L7-L9 VanDerWaalsContact CD1-CD2 3.46Å; L7-L9 HydrophobicContact CD1-CG 3.55Å; L7-Y296 HydrophobicContact CD2-CE1 3.93Å; L7-V313 HydrophobicContact CD1-CB 3.52Å; L7-V313 HydrophobicContact CD1-CG1 4.31Å; L7-V313 HydrophobicContact CD1-CG2 3.65Å; L7-V313 HydrophobicContact CG-CB 3.76Å; L7-V313 HydrophobicContact CG-CG1 4.29Å; L7-V313 HydrophobicContact CG-CG2 4.44Å; L7-V313 PolarHBondContact N-O 3.28Å; L7-V313 PolarHBondContact O-N 3.38Å
8	K	92.6	Very high	91	Very high	109 Å²	109	53.7 Å²	53.7	47%	0.474	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.2	178.1	-177.9	62.3	169.1	-177.1	0	108.4	E310 E312	K8-E310 WeakPolarHBondContact CE-O 3.42Å; K8-E310 PolarHBondContact NZ-O 3.05Å; K8-E312 HydrophobicContact CD-CB 4.29Å
9	L	90.6	Very high	91.3	Very high	5 Å²	5	51.3 Å²	51.3	3%	0.026	27%	0.265	C	S	.	.			trans	-84.4	135.2	172.7	-54	176	0	0	0	108.4	L7 H11 I13 L30 F40 H42 I65 G311 V313	L7-L9 HydrophobicContact CD1-CD1 4.25Å; L7-L9 HydrophobicContact CD1-CD2 3.46Å; L7-L9 VanDerWaalsContact CD1-CD2 3.46Å; L7-L9 HydrophobicContact CD1-CG 3.55Å; L9-H11 PolarHBondContact O-N 3.18Å; L9-I13 HydrophobicContact CD1-CD1 4.47Å; L9-L30 HydrophobicContact CD1-CD2 4.26Å; L9-F40 HydrophobicContact CD1-CE2 3.52Å; L9-F40 HydrophobicContact CD1-CZ 3.62Å; L9-H42 HydrophobicContact CD2-CB 4.42Å; L9-H42 WeakPolarHBondContact CD2-CD2 3.16Å; L9-I65 HydrophobicContact CB-CD1 4.48Å; L9-I65 HydrophobicContact CD2-CD1 3.8Å; L9-G311 PolarHBondContact N-O 3.07Å; L9-V313 HydrophobicContact CD1-CG2 3.79Å; L9-V313 HydrophobicContact CG-CG2 4.14Å
10	N	88.2	Confident	91.5	Very high	92 Å²	92	50.2 Å²	50.2	49%	0.492	26%	0.261	S	S	.	.	S	Bend	trans	-79.5	24.2	179	-67.1	-51.8	0	0	0	113.3	Q61 D62	N10-Q61 HydrophobicContact CB-CB 4.43Å; N10-Q61 PolarHBondContact O-OE1 2.99Å; N10-D62 PolarHBondContact N-OD2 3.14Å; N10-D62 PolarHBondContact ND2-OD1 2.9Å; N10-D62 PolarHBondContact ND2-OD2 2.95Å
11	H	90.8	Very high	91.6	Very high	28 Å²	28	47.9 Å²	47.9	13%	0.13	25%	0.249	C	C	.	.	S	Bend	trans	-125.2	135.8	-178.2	-64.4	-64.4	0	0	0	110.7	L9 F40 S59 G311	L9-H11 PolarHBondContact O-N 3.18Å; H11-F40 HydrophobicContact CB-CD1 4.08Å; H11-F40 HydrophobicContact CB-CE1 4.21Å; H11-S59 PolarHBondContact NE2-OG 3.38Å; H11-G311 WeakPolarHBondContact O-CA 3.22Å
12	K	93.9	Very high	92.6	Very high	82 Å²	82	49.3 Å²	49.3	36%	0.357	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-73.2	136.8	170.8	-66	-173.2	178.5	-121.8	0	109.8	T34 Q35 I309 E310	K12-T34 WeakPolarHBondContact O-CA 3.45Å; K12-T34 VanDerWaalsContact O-CB 3.27Å; K12-T34 WeakPolarHBondContact O-CB 3.44Å; K12-T34 PolarHBondContact O-OG1 3.32Å; K12-Q35 HydrophobicContact CB-CG 4.31Å; K12-I309 CarbonylContact C-O 3.52Å; K12-I309 VanDerWaalsContact CA-O 3.24Å; K12-I309 WeakPolarHBondContact CA-O 3.2Å; K12-E310 WeakPolarHBondContact CE-OE2 3.29Å; K12-E310 IonicContact NZ-OE1 2.72Å; K12-E310 PolarHBondContact NZ-OE1 2.73Å; K12-E310 IonicContact NZ-OE2 2.73Å; K12-E310 PolarHBondContact NZ-OE2 2.69Å
13	I	95.9	Very high	93	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.7	-176	-55.3	-174.4	0	0	0	109.3	L9 V18 A32 F40 A289 I309	L9-I13 HydrophobicContact CD1-CD1 4.47Å; I13-V18 HydrophobicContact CG2-CG2 3.6Å; I13-A32 HydrophobicContact CG2-CB 3.72Å; I13-F40 HydrophobicContact CD1-CE1 4.41Å; I13-F40 HydrophobicContact CD1-CZ 3.93Å; I13-F40 HydrophobicContact CG1-CE1 3.93Å; I13-F40 HydrophobicContact CG1-CZ 3.97Å; I13-A289 HydrophobicContact CB-CB 3.92Å; I13-A289 HydrophobicContact CG2-CB 3.63Å; I13-I309 PolarHBondContact N-O 3.39Å
14	N	95.1	Very high	93	Very high	41 Å²	41	44.2 Å²	44.2	22%	0.219	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	132	171.7	-68.8	-5.4	0	0	0	109.7	M17 A33	N14-M17 HydrophobicContact CB-CB 4.27Å; N14-M17 HydrophobicContact CB-CE 4.28Å; N14-M17 HydrophobicContact CB-CG 4.31Å; N14-M17 HydrophobicContact CB-SD 3.51Å; N14-M17 VanDerWaalsContact CB-SD 3.51Å; N14-M17 PolarHBondContact O-N 2.93Å; N14-A33 HydrophobicContact CB-CB 4.23Å; N14-A33 PolarHBondContact N-O 3.06Å
15	P	93.6	Very high	92.7	Very high	40 Å²	40	43.1 Å²	43.1	26%	0.26	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	143.7	177.3	-23.5	32.8	0	0	0	112.1	M17 M244 A289 I309	P15-M17 PolarHBondContact O-N 3.3Å; P15-M17 VanDerWaalsContact O-N 3.12Å; P15-M244 HydrophobicContact CB-CE 3.47Å; P15-M244 VanDerWaalsContact CB-CE 3.47Å; P15-M244 HydrophobicContact CG-CE 3.75Å; P15-A289 WeakPolarHBondContact CA-O 3.18Å; P15-I309 HydrophobicContact CG-CD1 3.73Å; P15-I309 HydrophobicContact CG-CG1 4.15Å
16	R	92.4	Very high	92.6	Very high	93 Å²	93	45.7 Å²	45.7	35%	0.351	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	65.6	4.7	176	-55.9	159.3	177.2	-135	-12.6	115.8	T206 S207 A243 M244 A289	R16-T206 VanDerWaalsContact NH1-CB 3.27Å; R16-T206 PolarHBondContact NH1-O 3.48Å; R16-T206 PolarHBondContact NH2-OG1 3Å; R16-S207 PolarHBondContact NH2-OG 3.38Å; R16-A243 PolarHBondContact NH2-O 2.93Å; R16-M244 WeakPolarHBondContact CG-O 3.3Å; R16-M244 PolarHBondContact NE-O 3.22Å; R16-A289 PolarHBondContact N-O 2.95Å
17	M	95.3	Very high	92.4	Very high	28 Å²	28	44.8 Å²	44.8	14%	0.138	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	53.9	179.7	-58.4	171.9	-159.5	0	0	109.4	N14 P15 A32 A33 V74 T75 L77	N14-M17 HydrophobicContact CB-CB 4.27Å; N14-M17 HydrophobicContact CB-CE 4.28Å; N14-M17 HydrophobicContact CB-CG 4.31Å; N14-M17 HydrophobicContact CB-SD 3.51Å; N14-M17 VanDerWaalsContact CB-SD 3.51Å; N14-M17 PolarHBondContact O-N 2.93Å; P15-M17 PolarHBondContact O-N 3.3Å; P15-M17 VanDerWaalsContact O-N 3.12Å; M17-A32 CarbonylContact O-C 3.58Å; M17-A32 WeakPolarHBondContact O-CA 3.49Å; M17-A32 WeakPolarHBondContact O-CB 3.4Å; M17-A33 HydrophobicContact CB-CB 3.6Å; M17-A33 HydrophobicContact CG-CB 4.27Å; M17-A33 PolarHBondContact O-N 3.06Å; M17-A33 HydrophobicContact SD-CB 3.72Å; M17-V74 WeakPolarHBondContact CE-O 3.46Å; M17-V74 HydrophobicContact SD-CB 4.19Å; M17-V74 HydrophobicContact SD-CG1 4.02Å; M17-T75 WeakPolarHBondContact CE-O 3.27Å; M17-L77 HydrophobicContact CB-CB 4.16Å
18	V	96.9	Very high	92.4	Very high	15 Å²	15	43 Å²	43	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129	-177.5	-175.8	0	0	0	0	108	I13 L30 T31 A32 V292 T307	I13-V18 HydrophobicContact CG2-CG2 3.6Å; V18-L30 HydrophobicContact CG1-CD1 3.78Å; V18-T31 WeakPolarHBondContact CA-O 3.33Å; V18-A32 HydrophobicContact CB-CB 4.44Å; V18-A32 HydrophobicContact CG1-CB 4.5Å; V18-A32 HydrophobicContact CG2-CB 3.97Å; V18-V292 HydrophobicContact CG1-CG1 4.15Å; V18-V292 HydrophobicContact CG1-CG2 4.32Å; V18-T307 HydrophobicContact CG1-CG2 4.11Å
19	A	96.8	Very high	92.5	Very high	8 Å²	8	38 Å²	38	7%	0.066	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	160.5	175.5	0	0	0	0	0	110.6	T31 L77 A79	A19-T31 PolarHBondContact N-O 3.47Å; A19-T31 PolarHBondContact O-N 2.96Å; A19-T31 VanDerWaalsContact O-O 3.11Å; A19-L77 HydrophobicContact CB-CD2 3.54Å; A19-A79 HydrophobicContact CB-CB 4.16Å
20	V	95.9	Very high	92.7	Very high	30 Å²	30	37.8 Å²	37.8	18%	0.182	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.8	169	175.6	0	0	0	0	107.3	P28 C29 L30 V292 I305	V20-P28 HydrophobicContact CG1-CB 3.97Å; V20-C29 WeakPolarHBondContact CA-O 3.45Å; V20-L30 HydrophobicContact CG2-CD1 4Å; V20-V292 HydrophobicContact CG2-CB 4.17Å; V20-V292 HydrophobicContact CG2-CG2 3.52Å; V20-I305 HydrophobicContact CG2-CD1 4.07Å
21	G	93.2	Very high	93.1	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148.5	178.7	0	0	0	0	0	111.4	F23 C29 D89	G21-F23 PolarHBondContact O-N 3.01Å; G21-C29 PolarHBondContact N-O 3.49Å; G21-C29 VanDerWaalsContact N-O 3.16Å; G21-C29 PolarHBondContact O-N 2.8Å; G21-D89 WeakPolarHBondContact CA-OD2 3.41Å
22	K	93.4	Very high	93.4	Very high	96 Å²	96	32.1 Å²	32.1	42%	0.417	17%	0.17	S	C	.	.			trans	-95.4	79.3	172.6	-66.7	179.8	-178.6	-179.9	0	109	D24 G25 P28 G88 D89	K22-D24 VanDerWaalsContact C-N 3.35Å; K22-D24 PolarHBondContact O-N 2.95Å; K22-G25 PolarHBondContact O-N 2.83Å; K22-G25 VanDerWaalsContact O-N 3.09Å; K22-P28 HydrophobicContact CG-CB 4.2Å; K22-G88 VanDerWaalsContact O-CA 3.26Å; K22-G88 WeakPolarHBondContact O-CA 3.31Å; K22-D89 PolarHBondContact N-OD2 3.18Å; K22-D89 PolarHBondContact O-N 2.95Å
23	F	91.5	Very high	93.5	Very high	5 Å²	5	28.2 Å²	28.2	2%	0.022	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-34.3	-173	-62.6	-57.7	0	0	0	113.9	G21 G25 C29 T31 I41 A79 D89 L91 V104 H105	G21-F23 PolarHBondContact O-N 3.01Å; F23-G25 VanDerWaalsContact C-N 3.27Å; F23-C29 HydrophobicContact CD2-CB 3.75Å; F23-C29 HydrophobicContact CE2-CB 3.83Å; F23-T31 WeakPolarHBondContact CE2-OG1 2.91Å; F23-T31 WeakPolarHBondContact CZ-OG1 3.48Å; F23-I41 HydrophobicContact CD2-CG2 4.05Å; F23-I41 HydrophobicContact CE2-CG2 3.89Å; F23-A79 HydrophobicContact CE1-CB 4.2Å; F23-A79 HydrophobicContact CZ-CB 4.32Å; F23-D89 HydrophobicContact CD1-CB 4.49Å; F23-D89 WeakPolarHBondContact CD1-O 3.47Å; F23-L91 HydrophobicContact CE1-CB 3.78Å; F23-L91 HydrophobicContact CE1-CD1 4.48Å; F23-L91 HydrophobicContact CZ-CB 4.31Å; F23-L91 HydrophobicContact CZ-CD1 4.28Å; F23-V104 HydrophobicContact CB-CB 3.79Å; F23-V104 HydrophobicContact CB-CG1 3.96Å; F23-V104 HydrophobicContact CD1-CB 3.87Å; F23-V104 HydrophobicContact CD1-CG2 3.71Å; F23-V104 HydrophobicContact CD2-CB 4.28Å; F23-V104 HydrophobicContact CD2-CG1 4.09Å; F23-V104 HydrophobicContact CD2-CG2 4.32Å; F23-V104 HydrophobicContact CE1-CG2 3.98Å; F23-V104 HydrophobicContact CG-CB 3.7Å; F23-V104 HydrophobicContact CG-CG1 3.94Å; F23-V104 HydrophobicContact CG-CG2 3.92Å; F23-V104 HydrophobicContact CZ-CG2 4.38Å; F23-H105 WeakPolarHBondContact O-CB 3.09Å
24	D	87.8	Confident	93.4	Very high	46 Å²	46	28.6 Å²	28.6	25%	0.246	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	12.2	174.7	65.3	-0.7	0	0	0	112.9	K22 V26 H27	K22-D24 VanDerWaalsContact C-N 3.35Å; K22-D24 PolarHBondContact O-N 2.95Å; D24-V26 PolarHBondContact O-N 2.96Å; D24-V26 PolarHBondContact OD1-N 3.21Å; D24-H27 PolarHBondContact OD1-N 3.39Å; D24-H27 IonicContact OD1-ND1 3.03Å; D24-H27 IonicContact OD2-CE1 2.96Å; D24-H27 IonicContact OD2-CG 3.28Å; D24-H27 IonicContact OD2-ND1 3.67Å; D24-H27 PolarHBondContact OD2-ND1 3.17Å
25	G	86.4	Confident	93	Very high	33 Å²	33	32.3 Å²	32.3	34%	0.34	17%	0.171	S	C	.	.	S	Bend	trans	79.9	-13.3	-177.5	0	0	0	0	0	115.2	K22 F23 T87	K22-G25 PolarHBondContact O-N 2.83Å; K22-G25 VanDerWaalsContact O-N 3.09Å; F23-G25 VanDerWaalsContact C-N 3.27Å; G25-T87 VanDerWaalsContact CA-O 3.23Å; G25-T87 WeakPolarHBondContact CA-O 3.14Å
26	V	87.9	Confident	92.6	Very high	88 Å²	88	34.7 Å²	34.7	53%	0.533	19%	0.194	S	C	.	.	S	Bend	trans	-126	-53.5	-171.1	-177.8	0	0	0	0	112.3	D24	D24-V26 PolarHBondContact O-N 2.96Å; D24-V26 PolarHBondContact OD1-N 3.21Å
27	H	89.9	Confident	92.3	Very high	61 Å²	61	30.7 Å²	30.7	28%	0.282	18%	0.182	S	C	.	.	S	Bend	trans	-93	118.9	-170.6	-54.8	96	0	0	0	110.8	D24 C29 H45	D24-H27 PolarHBondContact OD1-N 3.39Å; D24-H27 IonicContact OD1-ND1 3.03Å; D24-H27 IonicContact OD2-CE1 2.96Å; D24-H27 IonicContact OD2-CG 3.28Å; D24-H27 IonicContact OD2-ND1 3.67Å; D24-H27 PolarHBondContact OD2-ND1 3.17Å; H27-C29 PolarHBondContact O-N 3.19Å; H27-C29 PolarHBondContact O-SG 2.98Å; H27-H45 HydrophobicContact CB-CB 4.35Å; H27-H45 VanDerWaalsContact CD2-CB 3.48Å; H27-H45 WeakPolarHBondContact CD2-CB 2.94Å; H27-H45 AromaticContact CD2-CG 3.88Å
28	P	92.4	Very high	92.2	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	19%	0.19	C	C	.	.			trans	-72.8	129.1	177.1	24	-25.5	0	0	0	110.6	V20 K22 D295 L298	V20-P28 HydrophobicContact CG1-CB 3.97Å; K22-P28 HydrophobicContact CG-CB 4.2Å; P28-D295 WeakPolarHBondContact CG-O 3.43Å; P28-L298 HydrophobicContact CG-CD2 4.24Å
29	C	94.3	Very high	92.1	Very high	4 Å²	4	32 Å²	32	3%	0.027	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.2	-179.4	-59.6	0	0	0	0	109.4	V20 G21 F23 H27 I41 H42 N43	V20-C29 WeakPolarHBondContact CA-O 3.45Å; G21-C29 PolarHBondContact N-O 3.49Å; G21-C29 VanDerWaalsContact N-O 3.16Å; G21-C29 PolarHBondContact O-N 2.8Å; F23-C29 HydrophobicContact CD2-CB 3.75Å; F23-C29 HydrophobicContact CE2-CB 3.83Å; H27-C29 PolarHBondContact O-N 3.19Å; H27-C29 PolarHBondContact O-SG 2.98Å; C29-I41 HydrophobicContact CB-CG2 3.8Å; C29-H42 WeakPolarHBondContact CA-O 3.37Å; C29-N43 VanDerWaalsContact SG-CB 3.59Å
30	L	95.8	Very high	92	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	122.8	173.5	177.6	67.3	0	0	0	108.5	L9 V18 V20 H42 V292 Y296 T307 V313	L9-L30 HydrophobicContact CD1-CD2 4.26Å; V18-L30 HydrophobicContact CG1-CD1 3.78Å; V20-L30 HydrophobicContact CG2-CD1 4Å; L30-H42 HydrophobicContact CB-CB 4.49Å; L30-H42 PolarHBondContact N-O 3.33Å; L30-H42 PolarHBondContact O-N 3.04Å; L30-V292 HydrophobicContact CD1-CG2 4.3Å; L30-Y296 HydrophobicContact CB-CE2 3.86Å; L30-T307 HydrophobicContact CD1-CG2 4.24Å; L30-T307 HydrophobicContact CD2-CG2 3.98Å; L30-V313 HydrophobicContact CD2-CG1 4.04Å; L30-V313 HydrophobicContact CD2-CG2 3.92Å
31	T	95.9	Very high	91.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.8	-178.7	-56.4	0	0	0	0	110.1	V18 A19 F23 V39 F40 I41 L77 L91	V18-T31 WeakPolarHBondContact CA-O 3.33Å; A19-T31 PolarHBondContact N-O 3.47Å; A19-T31 PolarHBondContact O-N 2.96Å; A19-T31 VanDerWaalsContact O-O 3.11Å; F23-T31 WeakPolarHBondContact CE2-OG1 2.91Å; F23-T31 WeakPolarHBondContact CZ-OG1 3.48Å; T31-V39 HydrophobicContact CG2-CG1 3.33Å; T31-F40 VanDerWaalsContact CA-O 3.29Å; T31-F40 WeakPolarHBondContact CA-O 3.49Å; T31-F40 WeakPolarHBondContact CG2-O 3.31Å; T31-I41 HydrophobicContact CG2-CG1 3.84Å; T31-L77 HydrophobicContact CG2-CD1 4.23Å; T31-L77 HydrophobicContact CG2-CD2 4.28Å; T31-L91 HydrophobicContact CG2-CD1 3.82Å; T31-L91 HydrophobicContact CG2-CD2 4.16Å
32	A	96.6	Very high	91.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	152.4	172.1	0	0	0	0	0	113.9	I13 M17 V18 V39 F40	I13-A32 HydrophobicContact CG2-CB 3.72Å; M17-A32 CarbonylContact O-C 3.58Å; M17-A32 WeakPolarHBondContact O-CA 3.49Å; M17-A32 WeakPolarHBondContact O-CB 3.4Å; V18-A32 HydrophobicContact CB-CB 4.44Å; V18-A32 HydrophobicContact CG1-CB 4.5Å; V18-A32 HydrophobicContact CG2-CB 3.97Å; A32-V39 WeakPolarHBondContact O-CA 3.31Å; A32-F40 HydrophobicContact CB-CD1 4.48Å; A32-F40 HydrophobicContact CB-CE1 3.7Å; A32-F40 HydrophobicContact CB-CE2 4.26Å; A32-F40 HydrophobicContact CB-CZ 3.56Å; A32-F40 PolarHBondContact N-O 3.07Å; A32-F40 WeakPolarHBondContact O-CD1 3.39Å; A32-F40 PolarHBondContact O-N 2.92Å
33	A	96.1	Very high	91.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	140.6	171.8	0	0	0	0	0	110.6	N14 M17 V39 V74 L77	N14-A33 HydrophobicContact CB-CB 4.23Å; N14-A33 PolarHBondContact N-O 3.06Å; M17-A33 HydrophobicContact CB-CB 3.6Å; M17-A33 HydrophobicContact CG-CB 4.27Å; M17-A33 PolarHBondContact O-N 3.06Å; M17-A33 HydrophobicContact SD-CB 3.72Å; A33-V39 HydrophobicContact CB-CG2 4.41Å; A33-V74 HydrophobicContact CB-CB 3.89Å; A33-V74 HydrophobicContact CB-CG1 3.87Å; A33-V74 HydrophobicContact CB-CG2 4.29Å; A33-L77 HydrophobicContact CB-CD1 4.44Å
34	T	93.8	Very high	91.2	Very high	10 Å²	10	29.8 Å²	29.8	6%	0.061	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	177.9	177.5	-169.5	0	0	0	0	110.5	K12 K38 F40	K12-T34 WeakPolarHBondContact O-CA 3.45Å; K12-T34 VanDerWaalsContact O-CB 3.27Å; K12-T34 WeakPolarHBondContact O-CB 3.44Å; K12-T34 PolarHBondContact O-OG1 3.32Å; T34-K38 HydrophobicContact CG2-CB 3.68Å; T34-K38 WeakPolarHBondContact CG2-O 3.26Å; T34-K38 PolarHBondContact N-O 3.08Å; T34-F40 HydrophobicContact CG2-CD1 4.46Å
35	Q	86.4	Confident	91	Very high	119 Å²	119	30.4 Å²	30.4	56%	0.556	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	158.5	178	-62.4	-175.6	-14.1	0	0	111.4	K12 G37	K12-Q35 HydrophobicContact CB-CG 4.31Å; Q35-G37 VanDerWaalsContact C-N 3.3Å; Q35-G37 PolarHBondContact O-N 3.45Å
36	A	85.6	Confident	90.2	Very high	90 Å²	90	32 Å²	32	74%	0.744	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	27.9	179.9	0	0	0	0	0	115.4
37	G	86.8	Confident	88.5	Confident	9 Å²	9	39.4 Å²	39.4	9%	0.093	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	41.5	170.5	0	0	0	0	0	113.4	Q35 I70 N71 Q72	Q35-G37 VanDerWaalsContact C-N 3.3Å; Q35-G37 PolarHBondContact O-N 3.45Å; G37-I70 WeakPolarHBondContact O-CA 3.49Å; G37-I70 WeakPolarHBondContact O-CB 3.5Å; G37-I70 PolarHBondContact O-N 3.24Å; G37-I70 VanDerWaalsContact O-N 3.11Å; G37-N71 PolarHBondContact O-N 3.36Å; G37-Q72 WeakPolarHBondContact CA-O 3.4Å
38	K	93.3	Very high	86.5	Confident	69 Å²	69	40.1 Å²	40.1	30%	0.3	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.4	174.5	-55.8	-175	-179	-166.8	0	109.9	T34 L68 N69	T34-K38 HydrophobicContact CG2-CB 3.68Å; T34-K38 WeakPolarHBondContact CG2-O 3.26Å; T34-K38 PolarHBondContact N-O 3.08Å; K38-L68 WeakPolarHBondContact CA-O 3.19Å; K38-N69 WeakPolarHBondContact CD-OD1 3.04Å; K38-N69 WeakPolarHBondContact CE-OD1 3.26Å
39	V	95.1	Very high	84.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.7	170.3	173.4	0	0	0	0	107.1	T31 A32 A33 L68 I70 V74 L77 L91 V93	T31-V39 HydrophobicContact CG2-CG1 3.33Å; A32-V39 WeakPolarHBondContact O-CA 3.31Å; A33-V39 HydrophobicContact CB-CG2 4.41Å; V39-L68 HydrophobicContact CB-CB 4.34Å; V39-L68 PolarHBondContact N-O 3.46Å; V39-L68 PolarHBondContact O-N 2.92Å; V39-I70 HydrophobicContact CG2-CD1 4.36Å; V39-I70 HydrophobicContact CG2-CG1 3.86Å; V39-V74 HydrophobicContact CG2-CG2 4.05Å; V39-L77 HydrophobicContact CB-CD1 4.45Å; V39-L77 HydrophobicContact CG1-CD1 3.72Å; V39-L77 HydrophobicContact CG2-CD1 3.83Å; V39-L91 HydrophobicContact CG1-CD2 4.24Å; V39-V93 HydrophobicContact CG2-CG1 4.29Å; V39-V93 HydrophobicContact CG2-CG2 4.32Å
40	F	94.3	Very high	82.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	146.9	173.3	75.6	-101.8	0	0	0	110.1	L9 H11 I13 T31 A32 T34 H42 I65 S66 L67	L9-F40 HydrophobicContact CD1-CE2 3.52Å; L9-F40 HydrophobicContact CD1-CZ 3.62Å; H11-F40 HydrophobicContact CB-CD1 4.08Å; H11-F40 HydrophobicContact CB-CE1 4.21Å; I13-F40 HydrophobicContact CD1-CE1 4.41Å; I13-F40 HydrophobicContact CD1-CZ 3.93Å; I13-F40 HydrophobicContact CG1-CE1 3.93Å; I13-F40 HydrophobicContact CG1-CZ 3.97Å; T31-F40 VanDerWaalsContact CA-O 3.29Å; T31-F40 WeakPolarHBondContact CA-O 3.49Å; T31-F40 WeakPolarHBondContact CG2-O 3.31Å; A32-F40 HydrophobicContact CB-CD1 4.48Å; A32-F40 HydrophobicContact CB-CE1 3.7Å; A32-F40 HydrophobicContact CB-CE2 4.26Å; A32-F40 HydrophobicContact CB-CZ 3.56Å; A32-F40 PolarHBondContact N-O 3.07Å; A32-F40 WeakPolarHBondContact O-CD1 3.39Å; A32-F40 PolarHBondContact O-N 2.92Å; T34-F40 HydrophobicContact CG2-CD1 4.46Å; F40-H42 HydrophobicContact CD2-CB 4.49Å; F40-I65 HydrophobicContact CB-CG2 3.68Å; F40-I65 HydrophobicContact CD2-CG2 4.31Å; F40-I65 HydrophobicContact CG-CG2 4.32Å; F40-S66 CarbonylContact C-O 3.57Å; F40-S66 VanDerWaalsContact CA-O 3.3Å; F40-S66 WeakPolarHBondContact CA-O 3.47Å; F40-L67 HydrophobicContact CB-CD2 3.62Å
41	I	94.3	Very high	79.9	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.036	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	111.5	177.3	-58.8	166.5	0	0	0	106.1	F23 C29 T31 L56 I65 S66 L91 V104	F23-I41 HydrophobicContact CD2-CG2 4.05Å; F23-I41 HydrophobicContact CE2-CG2 3.89Å; C29-I41 HydrophobicContact CB-CG2 3.8Å; T31-I41 HydrophobicContact CG2-CG1 3.84Å; I41-L56 HydrophobicContact CD1-CD2 4.28Å; I41-I65 WeakPolarHBondContact O-CA 3.27Å; I41-S66 PolarHBondContact N-O 2.86Å; I41-S66 PolarHBondContact O-N 3.03Å; I41-L91 HydrophobicContact CD1-CD2 4.33Å; I41-V104 HydrophobicContact CD1-CB 4.36Å; I41-V104 HydrophobicContact CD1-CG1 3.67Å; I41-V104 HydrophobicContact CD1-CG2 3.69Å
42	H	93.3	Very high	77.5	Confident	18 Å²	18	69 Å²	69	8%	0.083	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.5	176.5	177.7	-73.2	0	0	0	109.5	L9 C29 L30 F40 I65 Y296	L9-H42 HydrophobicContact CD2-CB 4.42Å; L9-H42 WeakPolarHBondContact CD2-CD2 3.16Å; C29-H42 WeakPolarHBondContact CA-O 3.37Å; L30-H42 HydrophobicContact CB-CB 4.49Å; L30-H42 PolarHBondContact N-O 3.33Å; L30-H42 PolarHBondContact O-N 3.04Å; F40-H42 HydrophobicContact CD2-CB 4.49Å; H42-I65 HydrophobicContact CB-CG1 4.23Å; H42-Y296 PolarHBondContact CE1-OH 2.79Å; H42-Y296 AromaticContact ND1-CZ 3.81Å; H42-Y296 PolarHBondContact ND1-OH 2.97Å
43	N	88.8	Confident	75.4	Confident	21 Å²	21	72.4 Å²	72.4	11%	0.112	39%	0.385	C	S	.	.			trans	-118.3	104.6	176.3	-175.2	-15.7	0	0	0	109.8	C29 H45 N46 D64	C29-N43 VanDerWaalsContact SG-CB 3.59Å; N43-H45 PolarHBondContact O-N 3.05Å; N43-H45 PolarHBondContact OD1-N 3.23Å; N43-N46 HydrophobicContact CB-CB 4.08Å; N43-N46 PolarHBondContact OD1-N 2.79Å; N43-D64 PolarHBondContact N-O 3.35Å
44	P	81.3	Confident	73.3	Confident	49 Å²	49	81.8 Å²	81.8	32%	0.318	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-14	-179.1	28.1	-31.9	0	0	0	113.6	Y296	P44-Y296 HydrophobicContact CB-CE1 4.48Å; P44-Y296 HydrophobicContact CG-CD1 4.38Å; P44-Y296 HydrophobicContact CG-CE1 3.92Å; P44-Y296 HydrophobicContact CG-CE2 4.1Å
45	H	82.4	Confident	71.6	Confident	60 Å²	60	86 Å²	86	28%	0.278	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-4.6	-173.5	-57.5	-62.1	0	0	0	113	H27 N43 R47 Y296	H27-H45 HydrophobicContact CB-CB 4.35Å; H27-H45 VanDerWaalsContact CD2-CB 3.48Å; H27-H45 WeakPolarHBondContact CD2-CB 2.94Å; H27-H45 AromaticContact CD2-CG 3.88Å; N43-H45 PolarHBondContact O-N 3.05Å; N43-H45 PolarHBondContact OD1-N 3.23Å; H45-R47 PolarHBondContact O-N 2.96Å; H45-Y296 PolarHBondContact NE2-O 3.24Å
46	N	70.6	Confident	70.7	Confident	67 Å²	67	81.1 Å²	81.1	36%	0.358	42%	0.42	S	S	.	.			trans	-78	97.4	-177.2	-161.9	-1.7	0	0	0	111.4	N43 G48	N43-N46 HydrophobicContact CB-CB 4.08Å; N43-N46 PolarHBondContact OD1-N 2.79Å; N46-G48 PolarHBondContact O-N 2.82Å; N46-G48 VanDerWaalsContact O-N 3.14Å
47	R	52	Low	69.9	Low	243 Å²	243	79 Å²	79	92%	0.917	40%	0.4	S	S	*	.			trans	-84.5	78.7	171.3	-68.9	-175.8	179.2	-179.4	1.4	110.4	H45 Q49	H45-R47 PolarHBondContact O-N 2.96Å; R47-Q49 PolarHBondContact O-N 2.81Å
48	G	48.3	Very low	68.9	Low	75 Å²	75	84.4 Å²	84.4	77%	0.773	42%	0.423	S	S	*	.	S	Bend	trans	70.3	34	154.9	0	0	0	0	0	117.7	N46	N46-G48 PolarHBondContact O-N 2.82Å; N46-G48 VanDerWaalsContact O-N 3.14Å
49	Q	46.1	Very low	67.5	Low	160 Å²	160	81.5 Å²	81.5	75%	0.748	41%	0.412	S	S	*	.			trans	-93.1	126.1	166.5	-72.6	-168.8	-15.1	0	0	111.2	R47 P51	R47-Q49 PolarHBondContact O-N 2.81Å; Q49-P51 VanDerWaalsContact O-CD 3.25Å; Q49-P51 WeakPolarHBondContact O-CD 3.36Å
50	R	51.3	Low	65.8	Low	228 Å²	228	88.4 Å²	88.4	86%	0.86	45%	0.454	S	S	*	.			trans	-92	114.5	-178.5	-67.4	176.2	177.4	177	-1.2	110.7
51	P	46.4	Very low	64.2	Low	89 Å²	89	94.2 Å²	94.2	58%	0.578	48%	0.481	S	S	*	.			trans	-111.1	96.6	149	30.3	-18.4	0	0	0	108.6	Q49 T53	Q49-P51 VanDerWaalsContact O-CD 3.25Å; Q49-P51 WeakPolarHBondContact O-CD 3.36Å; P51-T53 PolarHBondContact O-N 2.98Å
52	V	45.8	Very low	62.8	Low	134 Å²	134	95.6 Å²	95.6	81%	0.812	49%	0.489	S	S	*	.			trans	-84.6	103	165.3	179.1	0	0	0	0	106.8
53	T	50.5	Low	61.4	Low	73 Å²	73	98.7 Å²	98.7	45%	0.448	51%	0.512	S	S	.	.			trans	-146.7	173.8	174.1	48.1	0	0	0	0	111.1	P51 R55 N107	P51-T53 PolarHBondContact O-N 2.98Å; T53-R55 PolarHBondContact O-N 2.99Å; T53-R55 VanDerWaalsContact O-N 3.14Å; T53-N107 PolarHBondContact OG1-ND2 3.32Å
54	H	52.8	Low	61	Low	197 Å²	197	101 Å²	101	91%	0.912	53%	0.525	S	S	*	.	S	Bend	trans	-63.9	-23.7	-151	-124.3	-68.6	0	0	0	117.8
55	R	59.4	Low	61.2	Low	99 Å²	99	98.7 Å²	98.7	37%	0.374	51%	0.51	S	S	.	.	S	Bend	trans	-112.9	-32.1	-178.8	-71.5	-168	-176.5	171.3	7.9	114.9	T53 L68 N69 D109	T53-R55 PolarHBondContact O-N 2.99Å; T53-R55 VanDerWaalsContact O-N 3.14Å; R55-L68 HydrophobicContact CB-CD1 3.92Å; R55-L68 WeakPolarHBondContact O-CA 3.34Å; R55-N69 PolarHBondContact O-N 3.47Å; R55-N69 VanDerWaalsContact O-N 3.08Å; R55-N69 PolarHBondContact O-ND2 2.96Å; R55-D109 IonicContact CZ-OD1 3.35Å; R55-D109 IonicContact CZ-OD2 3.72Å; R55-D109 VanDerWaalsContact CZ-OD2 3.31Å; R55-D109 IonicContact NH1-OD1 3.2Å; R55-D109 PolarHBondContact NH1-OD1 2.94Å; R55-D109 IonicContact NH1-OD2 2.94Å; R55-D109 PolarHBondContact NH1-OD2 3.49Å; R55-D109 IonicContact NH2-OD2 3.47Å; R55-D109 PolarHBondContact NH2-OD2 2.8Å; R55-D109 VanDerWaalsContact NH2-OD2 3.13Å
56	L	66.9	Low	61.5	Low	15 Å²	15	97.7 Å²	97.7	8%	0.079	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.8	175.2	-90.9	155	0	0	0	110	I41 L67 L68 Y102 N107	I41-L56 HydrophobicContact CD1-CD2 4.28Å; L56-L67 WeakPolarHBondContact CA-O 3.45Å; L56-L68 HydrophobicContact CG-CD1 4.25Å; L56-Y102 HydrophobicContact CD1-CE1 3.99Å; L56-Y102 WeakPolarHBondContact CD1-OH 3.29Å; L56-N107 HydrophobicContact CD1-CB 4.28Å
57	S	67.3	Low	62.5	Low	47 Å²	47	95.3 Å²	95.3	33%	0.329	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.5	176.2	56.6	0	0	0	0	110.3	L67	S57-L67 PolarHBondContact N-O 3.49Å; S57-L67 WeakPolarHBondContact O-CA 3.46Å; S57-L67 WeakPolarHBondContact O-CB 3.21Å; S57-L67 PolarHBondContact O-N 2.93Å; S57-L67 PolarHBondContact OG-O 3.11Å
58	Q	67.3	Low	64.3	Low	121 Å²	121	83.8 Å²	83.8	57%	0.565	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	138.7	172.8	-164.5	171.7	15	0	0	110	T60 S63	Q58-T60 PolarHBondContact O-N 3.42Å; Q58-S63 PolarHBondContact NE2-O 2.83Å
59	S	63.1	Low	66.3	Low	9 Å²	9	82 Å²	82	6%	0.063	43%	0.426	C	S	.	.			trans	-61.9	136	173.2	174.9	0	0	0	0	109.7	H11 Q61 D62 I65	H11-S59 PolarHBondContact NE2-OG 3.38Å; S59-Q61 PolarHBondContact O-N 3.31Å; S59-Q61 PolarHBondContact OG-N 2.73Å; S59-D62 WeakPolarHBondContact CB-O 3.33Å; S59-D62 PolarHBondContact OG-N 3.43Å; S59-I65 WeakPolarHBondContact CB-O 3.22Å; S59-I65 PolarHBondContact N-O 3.28Å
60	T	58.9	Low	68.5	Low	145 Å²	145	75.6 Å²	75.6	89%	0.89	40%	0.396	S	S	*	.	S	Bend	trans	-75.1	-14.3	175	51.7	0	0	0	0	112.5	Q58	Q58-T60 PolarHBondContact O-N 3.42Å
61	Q	61.2	Low	70.2	Confident	121 Å²	121	70.9 Å²	70.9	57%	0.565	39%	0.388	S	S	*	.	S	Bend	trans	-98.5	-38.7	-177	-67.2	180	-12.4	0	0	112.2	N10 S59	N10-Q61 HydrophobicContact CB-CB 4.43Å; N10-Q61 PolarHBondContact O-OE1 2.99Å; S59-Q61 PolarHBondContact O-N 3.31Å; S59-Q61 PolarHBondContact OG-N 2.73Å
62	D	64.5	Low	72.1	Confident	37 Å²	37	69.8 Å²	69.8	20%	0.198	38%	0.375	C	S	.	.			trans	-131.8	117.2	-175.7	-66.1	-35.4	0	0	0	110.1	N10 S59 D64 I65	N10-D62 PolarHBondContact N-OD2 3.14Å; N10-D62 PolarHBondContact ND2-OD1 2.9Å; N10-D62 PolarHBondContact ND2-OD2 2.95Å; S59-D62 WeakPolarHBondContact CB-O 3.33Å; S59-D62 PolarHBondContact OG-N 3.43Å; D62-D64 PolarHBondContact O-N 3.45Å; D62-D64 VanDerWaalsContact O-N 3.13Å; D62-I65 HydrophobicContact CB-CB 4.21Å; D62-I65 HydrophobicContact CB-CD1 3.6Å; D62-I65 HydrophobicContact CB-CG1 3.77Å; D62-I65 PolarHBondContact O-N 2.95Å; D62-I65 WeakPolarHBondContact OD2-CD1 3.4Å
63	S	65.3	Low	74.3	Confident	83 Å²	83	67.1 Å²	67.1	58%	0.58	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.5	-176.8	52.3	0	0	0	0	114	Q58 I65	Q58-S63 PolarHBondContact NE2-O 2.83Å; S63-I65 VanDerWaalsContact C-N 3.3Å
64	D	79.1	Confident	76.4	Confident	70 Å²	70	64 Å²	64	37%	0.374	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	1.6	-171.2	-54.1	-8.8	0	0	0	111.5	N43 D62	N43-D64 PolarHBondContact N-O 3.35Å; D62-D64 PolarHBondContact O-N 3.45Å; D62-D64 VanDerWaalsContact O-N 3.13Å
65	I	85.8	Confident	78.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.7	-178.9	-58.8	-176.9	0	0	0	110.3	L9 F40 I41 H42 S59 D62 S63 L67	L9-I65 HydrophobicContact CB-CD1 4.48Å; L9-I65 HydrophobicContact CD2-CD1 3.8Å; F40-I65 HydrophobicContact CB-CG2 3.68Å; F40-I65 HydrophobicContact CD2-CG2 4.31Å; F40-I65 HydrophobicContact CG-CG2 4.32Å; I41-I65 WeakPolarHBondContact O-CA 3.27Å; H42-I65 HydrophobicContact CB-CG1 4.23Å; S59-I65 WeakPolarHBondContact CB-O 3.22Å; S59-I65 PolarHBondContact N-O 3.28Å; D62-I65 HydrophobicContact CB-CB 4.21Å; D62-I65 HydrophobicContact CB-CD1 3.6Å; D62-I65 HydrophobicContact CB-CG1 3.77Å; D62-I65 PolarHBondContact O-N 2.95Å; D62-I65 WeakPolarHBondContact OD2-CD1 3.4Å; S63-I65 VanDerWaalsContact C-N 3.3Å; I65-L67 HydrophobicContact CG2-CD2 4.37Å
66	S	89.4	Confident	80.1	Confident	38 Å²	38	52 Å²	52	27%	0.266	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136	166.6	-58.7	0	0	0	0	110	F40 I41	F40-S66 CarbonylContact C-O 3.57Å; F40-S66 VanDerWaalsContact CA-O 3.3Å; F40-S66 WeakPolarHBondContact CA-O 3.47Å; I41-S66 PolarHBondContact N-O 2.86Å; I41-S66 PolarHBondContact O-N 3.03Å
67	L	90.1	Very high	81.5	Confident	17 Å²	17	51.8 Å²	51.8	9%	0.089	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.5	179.2	-66	172.5	0	0	0	109.9	F40 L56 S57 I65	F40-L67 HydrophobicContact CB-CD2 3.62Å; L56-L67 WeakPolarHBondContact CA-O 3.45Å; S57-L67 PolarHBondContact N-O 3.49Å; S57-L67 WeakPolarHBondContact O-CA 3.46Å; S57-L67 WeakPolarHBondContact O-CB 3.21Å; S57-L67 PolarHBondContact O-N 2.93Å; S57-L67 PolarHBondContact OG-O 3.11Å; I65-L67 HydrophobicContact CG2-CD2 4.37Å
68	L	90.3	Very high	82.9	Confident	1 Å²	1	51 Å²	51	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.2	170.9	-178.6	65.5	0	0	0	109.5	K38 V39 R55 L56 I70 L91 Y102	K38-L68 WeakPolarHBondContact CA-O 3.19Å; V39-L68 HydrophobicContact CB-CB 4.34Å; V39-L68 PolarHBondContact N-O 3.46Å; V39-L68 PolarHBondContact O-N 2.92Å; R55-L68 HydrophobicContact CB-CD1 3.92Å; R55-L68 WeakPolarHBondContact O-CA 3.34Å; L56-L68 HydrophobicContact CG-CD1 4.25Å; L68-I70 HydrophobicContact CD2-CD1 3.67Å; L68-I70 HydrophobicContact CG-CD1 3.8Å; L68-I70 PolarHBondContact O-N 2.87Å; L68-L91 HydrophobicContact CD2-CD2 3.99Å; L68-Y102 HydrophobicContact CD1-CD1 4.4Å; L68-Y102 HydrophobicContact CD1-CE1 3.75Å; L68-Y102 HydrophobicContact CD1-CE2 4.38Å; L68-Y102 HydrophobicContact CD2-CD1 3.83Å; L68-Y102 HydrophobicContact CD2-CE1 3.93Å; L68-Y102 HydrophobicContact CD2-CG 4.4Å; L68-Y102 HydrophobicContact CG-CE1 4.48Å
69	N	91.1	Very high	84.3	Confident	38 Å²	38	46.1 Å²	46.1	20%	0.203	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	102.6	178.8	-61.6	-64.2	0	0	0	110.5	K38 R55	K38-N69 WeakPolarHBondContact CD-OD1 3.04Å; K38-N69 WeakPolarHBondContact CE-OD1 3.26Å; R55-N69 PolarHBondContact O-N 3.47Å; R55-N69 VanDerWaalsContact O-N 3.08Å; R55-N69 PolarHBondContact O-ND2 2.96Å
70	I	91.3	Very high	85.7	Confident	25 Å²	25	46.1 Å²	46.1	13%	0.128	27%	0.274	C	S	.	.			trans	-82.1	-31.3	175	-50.9	-61.5	0	0	0	110.5	G37 V39 L68 Q72 V74 V93 L100	G37-I70 WeakPolarHBondContact O-CA 3.49Å; G37-I70 WeakPolarHBondContact O-CB 3.5Å; G37-I70 PolarHBondContact O-N 3.24Å; G37-I70 VanDerWaalsContact O-N 3.11Å; V39-I70 HydrophobicContact CG2-CD1 4.36Å; V39-I70 HydrophobicContact CG2-CG1 3.86Å; L68-I70 HydrophobicContact CD2-CD1 3.67Å; L68-I70 HydrophobicContact CG-CD1 3.8Å; L68-I70 PolarHBondContact O-N 2.87Å; I70-Q72 HydrophobicContact CG2-CB 4.23Å; I70-Q72 PolarHBondContact O-N 3.09Å; I70-Q72 VanDerWaalsContact O-N 3.16Å; I70-V74 HydrophobicContact CB-CG2 4.44Å; I70-V74 HydrophobicContact CG1-CG2 4.21Å; I70-V74 HydrophobicContact CG2-CG2 4.39Å; I70-V93 HydrophobicContact CD1-CB 4.35Å; I70-V93 HydrophobicContact CD1-CG1 4.02Å; I70-V93 HydrophobicContact CD1-CG2 4.19Å; I70-V93 HydrophobicContact CG1-CG1 4.1Å; I70-V93 HydrophobicContact CG2-CG1 4.3Å; I70-L100 HydrophobicContact CD1-CD2 3.96Å
71	N	87.6	Confident	87.3	Confident	130 Å²	130	43.1 Å²	43.1	70%	0.695	26%	0.256	S	S	*	.			trans	59.5	19	-177.5	-53.2	-52	0	0	0	113.9	G37	G37-N71 PolarHBondContact O-N 3.36Å
72	Q	87.3	Confident	88.6	Confident	66 Å²	66	37.4 Å²	37.4	31%	0.308	23%	0.229	S	C	.	.	S	Bend	trans	-139.7	155.4	175.2	-62.4	179.6	1.8	0	0	109.3	G37 I70 V74 S95 N98	G37-Q72 WeakPolarHBondContact CA-O 3.4Å; I70-Q72 HydrophobicContact CG2-CB 4.23Å; I70-Q72 PolarHBondContact O-N 3.09Å; I70-Q72 VanDerWaalsContact O-N 3.16Å; Q72-V74 PolarHBondContact O-N 3.26Å; Q72-S95 PolarHBondContact OE1-OG 3.45Å; Q72-N98 VanDerWaalsContact CD-ND2 3.33Å; Q72-N98 PolarHBondContact NE2-ND2 2.87Å; Q72-N98 PolarHBondContact OE1-ND2 2.75Å
73	A	90.4	Very high	89.5	Confident	77 Å²	77	36 Å²	36	64%	0.636	22%	0.223	S	C	*	.			trans	-65.7	118.6	173.6	0	0	0	0	0	109.6	S95	A73-S95 WeakPolarHBondContact O-CB 3.26Å
74	V	94.8	Very high	89.8	Confident	8 Å²	8	37 Å²	37	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133	175.1	-177.8	0	0	0	0	108.3	M17 A33 V39 I70 Q72 V93	M17-V74 WeakPolarHBondContact CE-O 3.46Å; M17-V74 HydrophobicContact SD-CB 4.19Å; M17-V74 HydrophobicContact SD-CG1 4.02Å; A33-V74 HydrophobicContact CB-CB 3.89Å; A33-V74 HydrophobicContact CB-CG1 3.87Å; A33-V74 HydrophobicContact CB-CG2 4.29Å; V39-V74 HydrophobicContact CG2-CG2 4.05Å; I70-V74 HydrophobicContact CB-CG2 4.44Å; I70-V74 HydrophobicContact CG1-CG2 4.21Å; I70-V74 HydrophobicContact CG2-CG2 4.39Å; Q72-V74 PolarHBondContact O-N 3.26Å; V74-V93 HydrophobicContact CB-CG1 4.39Å; V74-V93 HydrophobicContact CG1-CG1 3.79Å; V74-V93 HydrophobicContact CG2-CG1 3.77Å
75	T	94.8	Very high	89.3	Confident	36 Å²	36	41 Å²	41	22%	0.221	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-28	-178	44	0	0	0	0	112.1	M17 G94 S95 A119	M17-T75 WeakPolarHBondContact CE-O 3.27Å; T75-G94 PolarHBondContact N-O 3.38Å; T75-G94 PolarHBondContact OG1-O 2.9Å; T75-S95 VanDerWaalsContact OG1-C 3.23Å; T75-S95 VanDerWaalsContact OG1-CA 3.3Å; T75-S95 WeakPolarHBondContact OG1-CA 3.43Å; T75-A119 WeakPolarHBondContact CB-O 3.49Å; T75-A119 PolarHBondContact OG1-O 3.05Å
76	C	95.5	Very high	88.8	Confident	7 Å²	7	42.9 Å²	42.9	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152	173.2	63.3	0	0	0	0	111.3	G94 A119 I122	C76-G94 PolarHBondContact N-O 2.84Å; C76-G94 PolarHBondContact O-N 2.92Å; C76-A119 PolarHBondContact SG-O 3.14Å; C76-A119 VanDerWaalsContact SG-O 3.41Å; C76-I122 HydrophobicContact CB-CB 4.28Å; C76-I122 HydrophobicContact CB-CG2 3.75Å
77	L	96.6	Very high	88.3	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.063	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	133.9	-176.1	-174.6	148.4	0	0	0	109.8	M17 A19 T31 A33 V39 L91 L92	M17-L77 HydrophobicContact CB-CB 4.16Å; A19-L77 HydrophobicContact CB-CD2 3.54Å; T31-L77 HydrophobicContact CG2-CD1 4.23Å; T31-L77 HydrophobicContact CG2-CD2 4.28Å; A33-L77 HydrophobicContact CB-CD1 4.44Å; V39-L77 HydrophobicContact CB-CD1 4.45Å; V39-L77 HydrophobicContact CG1-CD1 3.72Å; V39-L77 HydrophobicContact CG2-CD1 3.83Å; L77-L91 HydrophobicContact CD1-CD1 4.42Å; L77-L91 HydrophobicContact CD2-CD1 4.15Å; L77-L91 HydrophobicContact CG-CD1 4.15Å; L77-L92 WeakPolarHBondContact CA-O 3.3Å
78	T	96.7	Very high	88.1	Confident	30 Å²	30	44.5 Å²	44.5	18%	0.184	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	164.7	172.4	-166.3	0	0	0	0	110.8	L92 I122 L124	T78-L92 HydrophobicContact CG2-CB 3.85Å; T78-L92 HydrophobicContact CG2-CD1 3.68Å; T78-L92 HydrophobicContact CG2-CG 4.41Å; T78-L92 PolarHBondContact N-O 2.81Å; T78-L92 VanDerWaalsContact N-O 3.1Å; T78-L92 PolarHBondContact O-N 3.27Å; T78-I122 HydrophobicContact CG2-CB 4.48Å; T78-I122 HydrophobicContact CG2-CD1 4.16Å; T78-I122 HydrophobicContact CG2-CG1 4Å; T78-I122 HydrophobicContact CG2-CG2 3.74Å; T78-L124 HydrophobicContact CG2-CB 4.29Å
79	A	95.7	Very high	88.3	Confident	18 Å²	18	45.9 Å²	45.9	15%	0.149	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.1	175.9	0	0	0	0	0	109.9	A19 F23 T90	A19-A79 HydrophobicContact CB-CB 4.16Å; F23-A79 HydrophobicContact CE1-CB 4.2Å; F23-A79 HydrophobicContact CZ-CB 4.32Å; A79-T90 WeakPolarHBondContact CA-O 3.29Å
80	G	93.9	Very high	88.5	Confident	10 Å²	10	44.1 Å²	44.1	10%	0.103	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	-178.4	174.7	0	0	0	0	0	112.6	L82 T90	G80-L82 PolarHBondContact O-N 3.41Å; G80-T90 PolarHBondContact N-O 3.16Å; G80-T90 PolarHBondContact O-N 3.43Å
81	T	92.2	Very high	88.7	Confident	82 Å²	82	43 Å²	43	50%	0.503	26%	0.264	S	S	.	.			trans	-81.9	112.4	-175.6	-43.2	0	0	0	0	111.7	D89	T81-D89 PolarHBondContact N-OD1 3.49Å; T81-D89 PolarHBondContact OG1-OD1 3.41Å
82	L	89	Confident	89.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.231	C	C	.	.			trans	-102.1	-38.2	-179.3	-173.7	65.6	0	0	0	113.4	G80 T90 A101 F111 L124 P133 A135	G80-L82 PolarHBondContact O-N 3.41Å; L82-T90 HydrophobicContact CD2-CG2 4.41Å; L82-A101 HydrophobicContact CD2-CB 4.24Å; L82-F111 HydrophobicContact CD2-CE1 3.85Å; L82-L124 HydrophobicContact CB-CD1 4.08Å; L82-L124 HydrophobicContact CD1-CD1 4.25Å; L82-P133 WeakPolarHBondContact O-CG 3.2Å; L82-A135 HydrophobicContact CD1-CB 4.22Å
83	G	82.1	Confident	89.6	Confident	7 Å²	7	33.8 Å²	33.8	7%	0.072	22%	0.217	C	C	.	.	S	Bend	trans	-110.8	152.7	-176.5	0	0	0	0	0	112.7	N85 T86	G83-N85 PolarHBondContact O-N 3.21Å; G83-T86 PolarHBondContact O-OG1 3.32Å
84	P	71.9	Confident	89.9	Confident	106 Å²	106	30.1 Å²	30.1	69%	0.688	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.4	176.1	27.8	-33.7	0	0	0	114.1
85	N	69	Low	89.7	Confident	154 Å²	154	29.9 Å²	29.9	82%	0.824	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.7	16.6	-173.2	-66.1	-23.7	0	0	0	113.7	G83	G83-N85 PolarHBondContact O-N 3.21Å
86	T	74.3	Confident	89.3	Confident	39 Å²	39	31.4 Å²	31.4	24%	0.239	19%	0.19	C	C	.	.			trans	-82.2	139.4	177.1	57.9	0	0	0	0	110.4	G83 G88	G83-T86 PolarHBondContact O-OG1 3.32Å; T86-G88 VanDerWaalsContact C-N 3.27Å; T86-G88 WeakPolarHBondContact CB-O 3.48Å; T86-G88 PolarHBondContact O-N 2.82Å; T86-G88 PolarHBondContact OG1-O 2.87Å
87	T	79.4	Confident	88.9	Confident	79 Å²	79	33.2 Å²	33.2	49%	0.485	20%	0.201	S	C	.	.	S	Bend	trans	-66.4	-32	177.7	46.6	0	0	0	0	111.9	G25	G25-T87 VanDerWaalsContact CA-O 3.23Å; G25-T87 WeakPolarHBondContact CA-O 3.14Å
88	G	87.3	Confident	88.6	Confident	10 Å²	10	33.3 Å²	33.3	10%	0.103	20%	0.201	C	C	.	.	S	Bend	trans	-145	-157.3	174.6	0	0	0	0	0	113	K22 T86	K22-G88 VanDerWaalsContact O-CA 3.26Å; K22-G88 WeakPolarHBondContact O-CA 3.31Å; T86-G88 VanDerWaalsContact C-N 3.27Å; T86-G88 WeakPolarHBondContact CB-O 3.48Å; T86-G88 PolarHBondContact O-N 2.82Å; T86-G88 PolarHBondContact OG1-O 2.87Å
89	D	93.8	Very high	88.5	Confident	30 Å²	30	31.9 Å²	31.9	16%	0.16	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-72.1	144.4	177.5	-69.1	-34.3	0	0	0	111.7	G21 K22 F23 T81	G21-D89 WeakPolarHBondContact CA-OD2 3.41Å; K22-D89 PolarHBondContact N-OD2 3.18Å; K22-D89 PolarHBondContact O-N 2.95Å; F23-D89 HydrophobicContact CD1-CB 4.49Å; F23-D89 WeakPolarHBondContact CD1-O 3.47Å; T81-D89 PolarHBondContact N-OD1 3.49Å; T81-D89 PolarHBondContact OG1-OD1 3.41Å
90	T	94.9	Very high	88.5	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132.7	171.3	-52	0	0	0	0	109.4	A79 G80 L82 A101 V110	A79-T90 WeakPolarHBondContact CA-O 3.29Å; G80-T90 PolarHBondContact N-O 3.16Å; G80-T90 PolarHBondContact O-N 3.43Å; L82-T90 HydrophobicContact CD2-CG2 4.41Å; T90-A101 HydrophobicContact CG2-CB 4.03Å; T90-V110 HydrophobicContact CG2-CB 4.47Å; T90-V110 HydrophobicContact CG2-CG2 3.91Å
91	L	96.3	Very high	88.5	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	121.7	172	178.8	61.7	0	0	0	109.5	F23 T31 V39 I41 L68 L77 V93 Y102 V104	F23-L91 HydrophobicContact CE1-CB 3.78Å; F23-L91 HydrophobicContact CE1-CD1 4.48Å; F23-L91 HydrophobicContact CZ-CB 4.31Å; F23-L91 HydrophobicContact CZ-CD1 4.28Å; T31-L91 HydrophobicContact CG2-CD1 3.82Å; T31-L91 HydrophobicContact CG2-CD2 4.16Å; V39-L91 HydrophobicContact CG1-CD2 4.24Å; I41-L91 HydrophobicContact CD1-CD2 4.33Å; L68-L91 HydrophobicContact CD2-CD2 3.99Å; L77-L91 HydrophobicContact CD1-CD1 4.42Å; L77-L91 HydrophobicContact CD2-CD1 4.15Å; L77-L91 HydrophobicContact CG-CD1 4.15Å; L91-V93 HydrophobicContact CD1-CG2 4.48Å; L91-V93 HydrophobicContact CD2-CG2 4.14Å; L91-V93 HydrophobicContact CG-CG2 3.93Å; L91-Y102 PolarHBondContact N-O 2.68Å; L91-Y102 PolarHBondContact O-N 3.21Å; L91-V104 HydrophobicContact CB-CG2 3.95Å; L91-V104 HydrophobicContact CD2-CG2 4.07Å
92	L	96.8	Very high	88.6	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.8	174	-73	158.4	0	0	0	110	L77 T78 L99 L100 A101 F111 I122 L124 A135	L77-L92 WeakPolarHBondContact CA-O 3.3Å; T78-L92 HydrophobicContact CG2-CB 3.85Å; T78-L92 HydrophobicContact CG2-CD1 3.68Å; T78-L92 HydrophobicContact CG2-CG 4.41Å; T78-L92 PolarHBondContact N-O 2.81Å; T78-L92 VanDerWaalsContact N-O 3.1Å; T78-L92 PolarHBondContact O-N 3.27Å; L92-L99 HydrophobicContact CD2-CD1 4.23Å; L92-L100 WeakPolarHBondContact CA-O 3.35Å; L92-A101 HydrophobicContact CD2-CB 3.72Å; L92-F111 HydrophobicContact CD2-CZ 4.43Å; L92-I122 HydrophobicContact CB-CD1 3.68Å; L92-I122 HydrophobicContact CD1-CD1 4.03Å; L92-I122 HydrophobicContact CD2-CD1 4.29Å; L92-I122 HydrophobicContact CG-CD1 4.24Å; L92-L124 HydrophobicContact CD1-CB 4.02Å; L92-L124 HydrophobicContact CD1-CD1 3.52Å; L92-L124 HydrophobicContact CD1-CG 4.3Å; L92-A135 HydrophobicContact CD1-CB 3.82Å; L92-A135 HydrophobicContact CD2-CB 3.78Å; L92-A135 HydrophobicContact CG-CB 4.49Å
93	V	96.8	Very high	88.7	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	112.7	178.2	-172.3	0	0	0	0	108.9	V39 I70 V74 L91 L100	V39-V93 HydrophobicContact CG2-CG1 4.29Å; V39-V93 HydrophobicContact CG2-CG2 4.32Å; I70-V93 HydrophobicContact CD1-CB 4.35Å; I70-V93 HydrophobicContact CD1-CG1 4.02Å; I70-V93 HydrophobicContact CD1-CG2 4.19Å; I70-V93 HydrophobicContact CG1-CG1 4.1Å; I70-V93 HydrophobicContact CG2-CG1 4.3Å; V74-V93 HydrophobicContact CB-CG1 4.39Å; V74-V93 HydrophobicContact CG1-CG1 3.79Å; V74-V93 HydrophobicContact CG2-CG1 3.77Å; L91-V93 HydrophobicContact CD1-CG2 4.48Å; L91-V93 HydrophobicContact CD2-CG2 4.14Å; L91-V93 HydrophobicContact CG-CG2 3.93Å; V93-L100 HydrophobicContact CB-CB 4.45Å; V93-L100 PolarHBondContact N-O 2.91Å; V93-L100 PolarHBondContact O-N 2.92Å
94	G	95.6	Very high	89.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.4	172.3	0	0	0	0	0	111.4	T75 C76	T75-G94 PolarHBondContact N-O 3.38Å; T75-G94 PolarHBondContact OG1-O 2.9Å; C76-G94 PolarHBondContact N-O 2.84Å; C76-G94 PolarHBondContact O-N 2.92Å
95	S	91.9	Very high	89.9	Confident	4 Å²	4	28.3 Å²	28.3	3%	0.028	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	177.9	166.4	76	0	0	0	0	110	Q72 A73 T75 T97 N98 A119	Q72-S95 PolarHBondContact OE1-OG 3.45Å; A73-S95 WeakPolarHBondContact O-CB 3.26Å; T75-S95 VanDerWaalsContact OG1-C 3.23Å; T75-S95 VanDerWaalsContact OG1-CA 3.3Å; T75-S95 WeakPolarHBondContact OG1-CA 3.43Å; S95-T97 PolarHBondContact O-N 3.2Å; S95-T97 PolarHBondContact OG-N 2.87Å; S95-N98 PolarHBondContact N-O 3.05Å; S95-N98 WeakPolarHBondContact OG-CB 3.24Å; S95-N98 PolarHBondContact OG-N 2.83Å; S95-N98 VanDerWaalsContact OG-N 3.07Å; S95-N98 PolarHBondContact OG-O 2.88Å; S95-A119 WeakPolarHBondContact O-CB 3.25Å; S95-A119 PolarHBondContact O-N 3.27Å
96	Q	86.7	Confident	90.6	Very high	68 Å²	68	25.4 Å²	25.4	32%	0.318	14%	0.14	S	C	.	.	S	Bend	trans	-61.1	-16.5	179.3	-165.2	59.5	54.5	0	0	113.6	G118	Q96-G118 WeakPolarHBondContact O-CA 3.37Å
97	T	85.8	Confident	91.2	Very high	45 Å²	45	25.7 Å²	25.7	28%	0.276	14%	0.14	S	C	.	.	S	Bend	trans	-135.1	-9.2	-176.6	61.5	0	0	0	0	114.1	S95 V115	S95-T97 PolarHBondContact O-N 3.2Å; S95-T97 PolarHBondContact OG-N 2.87Å; T97-V115 CarbonylContact C-O 3.6Å; T97-V115 WeakPolarHBondContact CA-O 3.17Å; T97-V115 CarbonylContact O-C 3.47Å; T97-V115 PolarHBondContact O-N 2.85Å; T97-V115 VanDerWaalsContact O-O 3.14Å
98	N	90.8	Very high	91.7	Very high	14 Å²	14	25.3 Å²	25.3	8%	0.075	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	153.6	-171	-56.7	-53.1	0	0	0	111.5	Q72 S95 Y112 R113 D114	Q72-N98 VanDerWaalsContact CD-ND2 3.33Å; Q72-N98 PolarHBondContact NE2-ND2 2.87Å; Q72-N98 PolarHBondContact OE1-ND2 2.75Å; S95-N98 PolarHBondContact N-O 3.05Å; S95-N98 WeakPolarHBondContact OG-CB 3.24Å; S95-N98 PolarHBondContact OG-N 2.83Å; S95-N98 VanDerWaalsContact OG-N 3.07Å; S95-N98 PolarHBondContact OG-O 2.88Å; N98-Y112 HydrophobicContact CB-CE1 4.35Å; N98-Y112 HydrophobicContact CB-CE2 4.28Å; N98-Y112 PolarHBondContact ND2-OH 2.89Å; N98-Y112 VanDerWaalsContact ND2-OH 3.14Å; N98-R113 CarbonylContact C-O 3.55Å; N98-R113 WeakPolarHBondContact CA-O 3.31Å; N98-D114 PolarHBondContact OD1-OD1 3.34Å; N98-D114 VanDerWaalsContact OD1-OD1 3.05Å
99	L	94.7	Very high	91.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.9	168.6	178.4	64	0	0	0	108.9	L92 F111 R113 V115 I122 I137 F146	L92-L99 HydrophobicContact CD2-CD1 4.23Å; L99-F111 HydrophobicContact CD2-CE2 3.82Å; L99-F111 HydrophobicContact CD2-CZ 3.96Å; L99-F111 HydrophobicContact CG-CE2 3.93Å; L99-F111 HydrophobicContact CG-CZ 4.37Å; L99-R113 PolarHBondContact N-O 3.14Å; L99-R113 PolarHBondContact O-N 2.67Å; L99-V115 HydrophobicContact CB-CG2 3.8Å; L99-I122 HydrophobicContact CD1-CD1 3.62Å; L99-I137 HydrophobicContact CD1-CG2 4.05Å; L99-I137 HydrophobicContact CD2-CD1 4.49Å; L99-I137 HydrophobicContact CD2-CG2 3.85Å; L99-F146 HydrophobicContact CD2-CD2 3.53Å; L99-F146 HydrophobicContact CD2-CE2 3.91Å; L99-F146 HydrophobicContact CD2-CG 4.44Å
100	L	95.2	Very high	91.7	Very high	10 Å²	10	28.5 Å²	28.5	5%	0.052	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.4	174.3	169.9	65.7	0	0	0	109.2	I70 L92 V93 D109 Y112	I70-L100 HydrophobicContact CD1-CD2 3.96Å; L92-L100 WeakPolarHBondContact CA-O 3.35Å; V93-L100 HydrophobicContact CB-CB 4.45Å; V93-L100 PolarHBondContact N-O 2.91Å; V93-L100 PolarHBondContact O-N 2.92Å; L100-D109 HydrophobicContact CD1-CB 4.29Å; L100-Y112 HydrophobicContact CB-CD2 4.01Å; L100-Y112 HydrophobicContact CB-CE2 4.27Å; L100-Y112 HydrophobicContact CD1-CD2 3.89Å; L100-Y112 HydrophobicContact CG-CD2 4.48Å
101	A	94.9	Very high	91.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122.1	163.9	0	0	0	0	0	108.5	L82 T90 L92 V110 F111	L82-A101 HydrophobicContact CD2-CB 4.24Å; T90-A101 HydrophobicContact CG2-CB 4.03Å; L92-A101 HydrophobicContact CD2-CB 3.72Å; A101-V110 HydrophobicContact CB-CB 3.98Å; A101-V110 HydrophobicContact CB-CG1 4.45Å; A101-V110 PolarHBondContact O-N 2.94Å; A101-F111 HydrophobicContact CB-CD1 3.63Å; A101-F111 HydrophobicContact CB-CD2 4.15Å; A101-F111 HydrophobicContact CB-CE1 3.47Å; A101-F111 VanDerWaalsContact CB-CE1 3.47Å; A101-F111 HydrophobicContact CB-CE2 4Å; A101-F111 HydrophobicContact CB-CG 3.98Å; A101-F111 HydrophobicContact CB-CZ 3.66Å; A101-F111 PolarHBondContact N-O 3.36Å; A101-F111 PolarHBondContact O-N 2.73Å
102	Y	93.8	Very high	91.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.9	-167	-175.6	-108.6	0	0	0	112	L56 L68 L91 V104 N107 T108 D109	L56-Y102 HydrophobicContact CD1-CE1 3.99Å; L56-Y102 WeakPolarHBondContact CD1-OH 3.29Å; L68-Y102 HydrophobicContact CD1-CD1 4.4Å; L68-Y102 HydrophobicContact CD1-CE1 3.75Å; L68-Y102 HydrophobicContact CD1-CE2 4.38Å; L68-Y102 HydrophobicContact CD2-CD1 3.83Å; L68-Y102 HydrophobicContact CD2-CE1 3.93Å; L68-Y102 HydrophobicContact CD2-CG 4.4Å; L68-Y102 HydrophobicContact CG-CE1 4.48Å; L91-Y102 PolarHBondContact N-O 2.68Å; L91-Y102 PolarHBondContact O-N 3.21Å; Y102-V104 HydrophobicContact CD1-CB 4.49Å; Y102-V104 HydrophobicContact CD1-CG2 3.68Å; Y102-V104 HydrophobicContact CE1-CB 4.38Å; Y102-V104 HydrophobicContact CE1-CG2 3.9Å; Y102-N107 PolarHBondContact OH-OD1 3.3Å; Y102-T108 WeakPolarHBondContact CD2-O 3.27Å; Y102-D109 WeakPolarHBondContact CD2-OD1 3.38Å
103	D	91.8	Very high	91.1	Very high	10 Å²	10	39 Å²	39	5%	0.053	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	109.9	169.5	-168.3	-41.2	0	0	0	108.8	H105 D106 N107 T108 V110	D103-H105 WeakPolarHBondContact OD1-CB 3.4Å; D103-H105 PolarHBondContact OD1-N 3.28Å; D103-D106 PolarHBondContact OD1-N 3.11Å; D103-N107 WeakPolarHBondContact O-CA 3.24Å; D103-N107 PolarHBondContact O-N 3.34Å; D103-T108 PolarHBondContact N-O 3.22Å; D103-T108 PolarHBondContact O-N 3.24Å; D103-T108 VanDerWaalsContact O-N 3.13Å; D103-V110 HydrophobicContact CB-CG2 4.15Å
104	V	90.1	Very high	90.7	Very high	23 Å²	23	44.8 Å²	44.8	14%	0.139	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-30.6	-178.1	170.9	0	0	0	0	111.6	F23 I41 L91 Y102	F23-V104 HydrophobicContact CB-CB 3.79Å; F23-V104 HydrophobicContact CB-CG1 3.96Å; F23-V104 HydrophobicContact CD1-CB 3.87Å; F23-V104 HydrophobicContact CD1-CG2 3.71Å; F23-V104 HydrophobicContact CD2-CB 4.28Å; F23-V104 HydrophobicContact CD2-CG1 4.09Å; F23-V104 HydrophobicContact CD2-CG2 4.32Å; F23-V104 HydrophobicContact CE1-CG2 3.98Å; F23-V104 HydrophobicContact CG-CB 3.7Å; F23-V104 HydrophobicContact CG-CG1 3.94Å; F23-V104 HydrophobicContact CG-CG2 3.92Å; F23-V104 HydrophobicContact CZ-CG2 4.38Å; I41-V104 HydrophobicContact CD1-CB 4.36Å; I41-V104 HydrophobicContact CD1-CG1 3.67Å; I41-V104 HydrophobicContact CD1-CG2 3.69Å; L91-V104 HydrophobicContact CB-CG2 3.95Å; L91-V104 HydrophobicContact CD2-CG2 4.07Å; Y102-V104 HydrophobicContact CD1-CB 4.49Å; Y102-V104 HydrophobicContact CD1-CG2 3.68Å; Y102-V104 HydrophobicContact CE1-CB 4.38Å; Y102-V104 HydrophobicContact CE1-CG2 3.9Å
105	H	87.1	Confident	90.3	Very high	105 Å²	105	44.9 Å²	44.9	49%	0.486	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-51.2	-177.2	-177	77	0	0	0	110.9	F23 D103 N107	F23-H105 WeakPolarHBondContact O-CB 3.09Å; D103-H105 WeakPolarHBondContact OD1-CB 3.4Å; D103-H105 PolarHBondContact OD1-N 3.28Å; H105-N107 VanDerWaalsContact C-N 3.31Å
106	D	85.3	Confident	89.6	Confident	93 Å²	93	48.3 Å²	48.3	50%	0.497	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.6	-179.5	-71.9	-29	0	0	0	112.8	D103 T108	D103-D106 PolarHBondContact OD1-N 3.11Å; D106-T108 VanDerWaalsContact C-N 3.34Å; D106-T108 HydrophobicContact CB-CG2 4.23Å; D106-T108 PolarHBondContact O-N 3.06Å
107	N	87.3	Confident	89.5	Confident	45 Å²	45	45.7 Å²	45.7	24%	0.241	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	52.5	-174.1	176	27.9	0	0	0	111.2	T53 L56 Y102 D103 H105	T53-N107 PolarHBondContact OG1-ND2 3.32Å; L56-N107 HydrophobicContact CD1-CB 4.28Å; Y102-N107 PolarHBondContact OH-OD1 3.3Å; D103-N107 WeakPolarHBondContact O-CA 3.24Å; D103-N107 PolarHBondContact O-N 3.34Å; H105-N107 VanDerWaalsContact C-N 3.31Å
108	T	88.6	Confident	89.5	Confident	71 Å²	71	43.6 Å²	43.6	44%	0.436	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.7	178.9	60.4	0	0	0	0	111.4	Y102 D103 D106 V110	Y102-T108 WeakPolarHBondContact CD2-O 3.27Å; D103-T108 PolarHBondContact N-O 3.22Å; D103-T108 PolarHBondContact O-N 3.24Å; D103-T108 VanDerWaalsContact O-N 3.13Å; D106-T108 VanDerWaalsContact C-N 3.34Å; D106-T108 HydrophobicContact CB-CG2 4.23Å; D106-T108 PolarHBondContact O-N 3.06Å; T108-V110 PolarHBondContact O-N 3.28Å
109	D	90.4	Very high	89.6	Confident	62 Å²	62	42.9 Å²	42.9	33%	0.332	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	117.9	170.4	-65.3	-8.5	0	0	0	107.1	R55 L100 Y102	R55-D109 IonicContact CZ-OD1 3.35Å; R55-D109 IonicContact CZ-OD2 3.72Å; R55-D109 VanDerWaalsContact CZ-OD2 3.31Å; R55-D109 IonicContact NH1-OD1 3.2Å; R55-D109 PolarHBondContact NH1-OD1 2.94Å; R55-D109 IonicContact NH1-OD2 2.94Å; R55-D109 PolarHBondContact NH1-OD2 3.49Å; R55-D109 IonicContact NH2-OD2 3.47Å; R55-D109 PolarHBondContact NH2-OD2 2.8Å; R55-D109 VanDerWaalsContact NH2-OD2 3.13Å; L100-D109 HydrophobicContact CD1-CB 4.29Å; Y102-D109 WeakPolarHBondContact CD2-OD1 3.38Å
110	V	91.3	Very high	89.6	Confident	45 Å²	45	44.1 Å²	44.1	27%	0.273	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	-49.5	172.3	176.4	0	0	0	0	108.5	T90 A101 D103 T108 Y148	T90-V110 HydrophobicContact CG2-CB 4.47Å; T90-V110 HydrophobicContact CG2-CG2 3.91Å; A101-V110 HydrophobicContact CB-CB 3.98Å; A101-V110 HydrophobicContact CB-CG1 4.45Å; A101-V110 PolarHBondContact O-N 2.94Å; D103-V110 HydrophobicContact CB-CG2 4.15Å; T108-V110 PolarHBondContact O-N 3.28Å; V110-Y148 WeakPolarHBondContact CG1-O 2.94Å
111	F	93.3	Very high	89.7	Confident	13 Å²	13	44.1 Å²	44.1	6%	0.057	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	160.9	163.8	67.3	-105.4	0	0	0	110.8	L82 L92 L99 A101 R113 F146 D147	L82-F111 HydrophobicContact CD2-CE1 3.85Å; L92-F111 HydrophobicContact CD2-CZ 4.43Å; L99-F111 HydrophobicContact CD2-CE2 3.82Å; L99-F111 HydrophobicContact CD2-CZ 3.96Å; L99-F111 HydrophobicContact CG-CE2 3.93Å; L99-F111 HydrophobicContact CG-CZ 4.37Å; A101-F111 HydrophobicContact CB-CD1 3.63Å; A101-F111 HydrophobicContact CB-CD2 4.15Å; A101-F111 HydrophobicContact CB-CE1 3.47Å; A101-F111 VanDerWaalsContact CB-CE1 3.47Å; A101-F111 HydrophobicContact CB-CE2 4Å; A101-F111 HydrophobicContact CB-CG 3.98Å; A101-F111 HydrophobicContact CB-CZ 3.66Å; A101-F111 PolarHBondContact N-O 3.36Å; A101-F111 PolarHBondContact O-N 2.73Å; F111-R113 HydrophobicContact CD2-CB 4.26Å; F111-R113 HydrophobicContact CD2-CG 3.72Å; F111-R113 HydrophobicContact CE2-CB 4.39Å; F111-R113 HydrophobicContact CE2-CG 4.12Å; F111-F146 HydrophobicContact CE1-CB 4.43Å; F111-F146 HydrophobicContact CZ-CB 3.99Å; F111-D147 VanDerWaalsContact CE1-O 3.24Å; F111-D147 WeakPolarHBondContact CE1-O 3.49Å
112	Y	92.1	Very high	89.8	Confident	103 Å²	103	45.1 Å²	45.1	40%	0.404	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	119.1	169.1	-171	-92.4	0	0	0	108.4	N98 L100	N98-Y112 HydrophobicContact CB-CE1 4.35Å; N98-Y112 HydrophobicContact CB-CE2 4.28Å; N98-Y112 PolarHBondContact ND2-OH 2.89Å; N98-Y112 VanDerWaalsContact ND2-OH 3.14Å; L100-Y112 HydrophobicContact CB-CD2 4.01Å; L100-Y112 HydrophobicContact CB-CE2 4.27Å; L100-Y112 HydrophobicContact CD1-CD2 3.89Å; L100-Y112 HydrophobicContact CG-CD2 4.48Å
113	R	90.8	Very high	89.9	Confident	104 Å²	104	46 Å²	46	39%	0.392	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.1	-177.4	-72.5	-66.3	-177.1	-178.7	-2.8	110.9	N98 L99 F111 G150	N98-R113 CarbonylContact C-O 3.55Å; N98-R113 WeakPolarHBondContact CA-O 3.31Å; L99-R113 PolarHBondContact N-O 3.14Å; L99-R113 PolarHBondContact O-N 2.67Å; F111-R113 HydrophobicContact CD2-CB 4.26Å; F111-R113 HydrophobicContact CD2-CG 3.72Å; F111-R113 HydrophobicContact CE2-CB 4.39Å; F111-R113 HydrophobicContact CE2-CG 4.12Å; R113-G150 VanDerWaalsContact CZ-O 3.3Å; R113-G150 PolarHBondContact NE-O 2.96Å; R113-G150 PolarHBondContact NH2-O 2.95Å
114	D	86.5	Confident	90.1	Very high	125 Å²	125	47.2 Å²	47.2	67%	0.668	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.3	170.1	-59.2	-18.6	0	0	0	108.5	N98	N98-D114 PolarHBondContact OD1-OD1 3.34Å; N98-D114 VanDerWaalsContact OD1-OD1 3.05Å
115	V	87.2	Confident	90.3	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.012	24%	0.244	C	C	.	.			trans	-118.2	98.9	179.2	-175.7	0	0	0	0	107.9	T97 L99 D117 G118 I137 F146	T97-V115 CarbonylContact C-O 3.6Å; T97-V115 WeakPolarHBondContact CA-O 3.17Å; T97-V115 CarbonylContact O-C 3.47Å; T97-V115 PolarHBondContact O-N 2.85Å; T97-V115 VanDerWaalsContact O-O 3.14Å; L99-V115 HydrophobicContact CB-CG2 3.8Å; V115-D117 VanDerWaalsContact C-N 3.26Å; V115-D117 PolarHBondContact O-N 3.2Å; V115-G118 PolarHBondContact O-N 3.1Å; V115-G118 VanDerWaalsContact O-N 3.08Å; V115-I137 HydrophobicContact CB-CD1 4.06Å; V115-I137 HydrophobicContact CG1-CD1 3.38Å; V115-I137 HydrophobicContact CG2-CD1 3.51Å; V115-F146 HydrophobicContact CG2-CE2 4.5Å
116	T	78.9	Confident	90.6	Very high	77 Å²	77	47.2 Å²	47.2	47%	0.472	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-32.9	-176.8	50.9	0	0	0	0	113.4	G118 L658	T116-G118 VanDerWaalsContact C-N 3.29Å; T116-L658 WeakPolarHBondContact O-CD2 3.42Å
117	D	83.1	Confident	91	Very high	12 Å²	12	42.8 Å²	42.8	6%	0.064	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.9	179.9	-57.9	-46.7	0	0	0	113	V115 G139 N140 A142 Q144 N665	V115-D117 VanDerWaalsContact C-N 3.26Å; V115-D117 PolarHBondContact O-N 3.2Å; D117-G139 CarbonylContact O-C 3.58Å; D117-G139 WeakPolarHBondContact O-CA 3.17Å; D117-N140 WeakPolarHBondContact O-CB 3.22Å; D117-N140 VanDerWaalsContact O-CG 3.25Å; D117-N140 PolarHBondContact O-N 3.15Å; D117-N140 PolarHBondContact O-ND2 3.25Å; D117-A142 HydrophobicContact CB-CB 4.12Å; D117-A142 WeakPolarHBondContact OD2-CB 3.33Å; D117-Q144 PolarHBondContact OD2-NE2 3.32Å; D117-N665 PolarHBondContact OD1-ND2 2.66Å
118	G	87.1	Confident	91.1	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.01	22%	0.216	C	C	.	.			trans	76	165.7	-176	0	0	0	0	0	116	Q96 V115 T116 G139	Q96-G118 WeakPolarHBondContact O-CA 3.37Å; V115-G118 PolarHBondContact O-N 3.1Å; V115-G118 VanDerWaalsContact O-N 3.08Å; T116-G118 VanDerWaalsContact C-N 3.29Å; G118-G139 WeakPolarHBondContact O-CA 3.09Å
119	A	93.1	Very high	91.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.			trans	-115.9	90.7	178.9	0	0	0	0	0	110.4	T75 C76 S95 I137	T75-A119 WeakPolarHBondContact CB-O 3.49Å; T75-A119 PolarHBondContact OG1-O 3.05Å; C76-A119 PolarHBondContact SG-O 3.14Å; C76-A119 VanDerWaalsContact SG-O 3.41Å; S95-A119 WeakPolarHBondContact O-CB 3.25Å; S95-A119 PolarHBondContact O-N 3.27Å; A119-I137 HydrophobicContact CB-CB 4.49Å; A119-I137 HydrophobicContact CB-CG2 4.42Å
120	N	94.8	Very high	91	Very high	26 Å²	26	41.7 Å²	41.7	14%	0.139	22%	0.215	C	C	.	.	S	Bend	trans	-84.4	-32.7	179.8	-64.5	-29.7	0	0	0	112.3	G138 G139 N140 V162	N120-G138 WeakPolarHBondContact CA-O 3.48Å; N120-G138 WeakPolarHBondContact CB-O 3.23Å; N120-G138 PolarHBondContact N-O 3.23Å; N120-G139 PolarHBondContact ND2-O 3.41Å; N120-N140 PolarHBondContact ND2-OD1 2.91Å; N120-V162 WeakPolarHBondContact CB-O 3.44Å
121	A	95.9	Very high	90.7	Very high	9 Å²	9	44.4 Å²	44.4	7%	0.074	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	152.4	176	0	0	0	0	0	109.8	I137 G138 V162 L165	A121-I137 WeakPolarHBondContact O-CA 3.43Å; A121-G138 PolarHBondContact N-O 3.23Å; A121-G138 PolarHBondContact O-N 2.94Å; A121-V162 HydrophobicContact CB-CG1 4.26Å; A121-L165 HydrophobicContact CB-CD1 4.27Å; A121-L165 HydrophobicContact CB-CG 4.06Å
122	I	97.2	Very high	90.5	Very high	21 Å²	21	45.2 Å²	45.2	11%	0.108	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	142.8	179.6	-169.3	166.3	0	0	0	110.8	C76 T78 L92 L99 I136 I137	C76-I122 HydrophobicContact CB-CB 4.28Å; C76-I122 HydrophobicContact CB-CG2 3.75Å; T78-I122 HydrophobicContact CG2-CB 4.48Å; T78-I122 HydrophobicContact CG2-CD1 4.16Å; T78-I122 HydrophobicContact CG2-CG1 4Å; T78-I122 HydrophobicContact CG2-CG2 3.74Å; L92-I122 HydrophobicContact CB-CD1 3.68Å; L92-I122 HydrophobicContact CD1-CD1 4.03Å; L92-I122 HydrophobicContact CD2-CD1 4.29Å; L92-I122 HydrophobicContact CG-CD1 4.24Å; L99-I122 HydrophobicContact CD1-CD1 3.62Å; I122-I136 CarbonylContact C-O 3.39Å; I122-I136 WeakPolarHBondContact CA-O 3.43Å; I122-I136 WeakPolarHBondContact CG1-O 3.26Å; I122-I137 HydrophobicContact CB-CG2 4.25Å; I122-I137 HydrophobicContact CD1-CG2 3.78Å; I122-I137 HydrophobicContact CG1-CG2 3.82Å
123	V	96.8	Very high	90.5	Very high	20 Å²	20	41.5 Å²	41.5	12%	0.121	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.1	169.4	66.5	0	0	0	0	109	I136 L165 L167 L178	V123-I136 HydrophobicContact CG1-CB 3.93Å; V123-I136 HydrophobicContact CG1-CG2 4.5Å; V123-I136 PolarHBondContact N-O 3.39Å; V123-I136 PolarHBondContact O-N 3.46Å; V123-L165 HydrophobicContact CB-CB 4.04Å; V123-L165 HydrophobicContact CG1-CB 3.79Å; V123-L165 HydrophobicContact CG1-CD1 4.29Å; V123-L167 HydrophobicContact CG1-CD1 4Å; V123-L167 HydrophobicContact CG1-CG 3.95Å; V123-L167 HydrophobicContact CG2-CB 4.35Å; V123-L167 HydrophobicContact CG2-CD1 4Å; V123-L167 HydrophobicContact CG2-CG 4.05Å; V123-L178 HydrophobicContact CG1-CD1 3.82Å
124	L	95.7	Very high	90.7	Very high	34 Å²	34	36.6 Å²	36.6	18%	0.178	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.9	176	176.9	155.6	0	0	0	108.7	T78 L82 L92 L134	T78-L124 HydrophobicContact CG2-CB 4.29Å; L82-L124 HydrophobicContact CB-CD1 4.08Å; L82-L124 HydrophobicContact CD1-CD1 4.25Å; L92-L124 HydrophobicContact CD1-CB 4.02Å; L92-L124 HydrophobicContact CD1-CD1 3.52Å; L92-L124 HydrophobicContact CD1-CG 4.3Å; L124-L134 WeakPolarHBondContact CA-O 3.43Å
125	G	93.6	Very high	91.2	Very high	15 Å²	15	30.6 Å²	30.6	16%	0.155	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-177.4	175.2	0	0	0	0	0	113.1	P133 L134	G125-P133 WeakPolarHBondContact O-CA 3.35Å; G125-L134 PolarHBondContact N-O 2.89Å; G125-L134 VanDerWaalsContact N-O 3.13Å; G125-L134 PolarHBondContact O-N 3.37Å
126	K	93.3	Very high	91.6	Very high	114 Å²	114	30.5 Å²	30.5	50%	0.496	18%	0.181	S	C	.	.			trans	-84.2	141.5	174.1	-63.8	-172.5	178.7	-168.4	0	110.2	S131 P133 N176	K126-S131 WeakPolarHBondContact CE-O 3.23Å; K126-S131 PolarHBondContact NZ-O 2.98Å; K126-P133 HydrophobicContact CG-CB 4.3Å; K126-N176 VanDerWaalsContact O-CB 3.3Å; K126-N176 WeakPolarHBondContact O-CB 3.42Å; K126-N176 PolarHBondContact O-ND2 2.8Å
127	L	93.3	Very high	92.4	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.159	C	C	.	.			trans	-122.1	123.4	178.8	177.3	66	0	0	0	109.4	D129 I130 I136 F154 L167 L178	L127-D129 PolarHBondContact O-N 3.14Å; L127-I130 VanDerWaalsContact O-CB 3.31Å; L127-I130 WeakPolarHBondContact O-CB 3.49Å; L127-I130 WeakPolarHBondContact O-CG1 3.35Å; L127-I130 PolarHBondContact O-N 3.01Å; L127-I136 HydrophobicContact CB-CD1 4.14Å; L127-I136 HydrophobicContact CD2-CD1 4.03Å; L127-F154 HydrophobicContact CD2-CB 4.44Å; L127-F154 HydrophobicContact CD2-CD1 3.99Å; L127-F154 HydrophobicContact CD2-CD2 3.83Å; L127-F154 HydrophobicContact CD2-CE1 4.18Å; L127-F154 HydrophobicContact CD2-CE2 4.08Å; L127-F154 HydrophobicContact CD2-CG 3.79Å; L127-F154 HydrophobicContact CD2-CZ 4.22Å; L127-L167 HydrophobicContact CB-CD2 4.48Å; L127-L167 HydrophobicContact CD1-CD2 3.92Å; L127-L178 HydrophobicContact CD1-CB 3.82Å
128	G	90.8	Very high	93	Very high	14 Å²	14	26.4 Å²	26.4	14%	0.144	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	-129.3	175.4	0	0	0	0	0	113.6	N176	G128-N176 PolarHBondContact N-O 3.42Å
129	D	88.8	Confident	93.2	Very high	105 Å²	105	26.4 Å²	26.4	56%	0.561	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	1.7	177.7	-74.8	-48.7	0	0	0	114	L127 S131 K175 E192	L127-D129 PolarHBondContact O-N 3.14Å; D129-S131 PolarHBondContact O-N 3.4Å; D129-K175 WeakPolarHBondContact OD1-CD 3.5Å; D129-K175 WeakPolarHBondContact OD1-CE 3.21Å; D129-K175 IonicContact OD1-NZ 3.68Å; D129-K175 PolarHBondContact OD1-NZ 2.67Å; D129-K175 IonicContact OD2-NZ 2.69Å; D129-K175 PolarHBondContact OD2-NZ 3.09Å; D129-E192 WeakPolarHBondContact CB-OE1 3.33Å; D129-E192 PolarHBondContact N-OE1 2.9Å
130	I	88.6	Confident	93	Very high	36 Å²	36	27.2 Å²	27.2	19%	0.185	16%	0.16	C	C	.	.			trans	-70.8	117.3	179.4	-54.3	177.6	0	0	0	109.1	L127 S132 L134	L127-I130 VanDerWaalsContact O-CB 3.31Å; L127-I130 WeakPolarHBondContact O-CB 3.49Å; L127-I130 WeakPolarHBondContact O-CG1 3.35Å; L127-I130 PolarHBondContact O-N 3.01Å; I130-S132 PolarHBondContact O-N 2.95Å; I130-L134 HydrophobicContact CD1-CD1 3.69Å; I130-L134 HydrophobicContact CG2-CD1 4.17Å; I130-L134 HydrophobicContact CG2-CD2 4.48Å; I130-L134 HydrophobicContact CG2-CG 4.32Å
131	S	84.1	Confident	92.7	Very high	102 Å²	102	26 Å²	26	71%	0.713	15%	0.153	S	C	*	.	S	Bend	trans	-67.7	-35.9	-171.6	54.7	0	0	0	0	113.7	K126 D129	K126-S131 WeakPolarHBondContact CE-O 3.23Å; K126-S131 PolarHBondContact NZ-O 2.98Å; D129-S131 PolarHBondContact O-N 3.4Å
132	S	88.2	Confident	92.4	Very high	29 Å²	29	25.5 Å²	25.5	20%	0.203	15%	0.15	C	C	.	.	S	Bend	trans	-87	141.7	179.1	49.3	0	0	0	0	111	I130	I130-S132 PolarHBondContact O-N 2.95Å
133	P	92.8	Very high	92.3	Very high	26 Å²	26	24.5 Å²	24.5	17%	0.169	15%	0.145	C	C	.	.			trans	-64.1	145.2	168.6	32.2	-35.5	0	0	0	109.6	L82 G125 K126	L82-P133 WeakPolarHBondContact O-CG 3.2Å; G125-P133 WeakPolarHBondContact O-CA 3.35Å; K126-P133 HydrophobicContact CG-CB 4.3Å
134	L	95	Very high	92.1	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	-116.4	144.1	179.8	-62.6	177.9	0	0	0	110.3	L124 G125 I130 I136 F146 D147 H153 F154	L124-L134 WeakPolarHBondContact CA-O 3.43Å; G125-L134 PolarHBondContact N-O 2.89Å; G125-L134 VanDerWaalsContact N-O 3.13Å; G125-L134 PolarHBondContact O-N 3.37Å; I130-L134 HydrophobicContact CD1-CD1 3.69Å; I130-L134 HydrophobicContact CG2-CD1 4.17Å; I130-L134 HydrophobicContact CG2-CD2 4.48Å; I130-L134 HydrophobicContact CG2-CG 4.32Å; L134-I136 HydrophobicContact CB-CG1 3.9Å; L134-I136 PolarHBondContact O-N 3.22Å; L134-F146 CarbonylContact C-O 3.52Å; L134-F146 VanDerWaalsContact CA-O 3.29Å; L134-F146 WeakPolarHBondContact CA-O 3.49Å; L134-D147 HydrophobicContact CD2-CB 4.24Å; L134-H153 HydrophobicContact CD1-CB 4.46Å; L134-H153 HydrophobicContact CD2-CB 4.09Å; L134-F154 HydrophobicContact CD1-CB 4.03Å
135	A	96.4	Very high	92.1	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	97.1	160.8	0	0	0	0	0	108.1	L82 L92 G145 F146	L82-A135 HydrophobicContact CD1-CB 4.22Å; L92-A135 HydrophobicContact CD1-CB 3.82Å; L92-A135 HydrophobicContact CD2-CB 3.78Å; L92-A135 HydrophobicContact CG-CB 4.49Å; A135-G145 WeakPolarHBondContact O-CA 3.47Å; A135-F146 PolarHBondContact N-O 3.03Å; A135-F146 PolarHBondContact O-N 2.81Å
136	I	96.6	Very high	92.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122	-178.4	-54.5	174.8	0	0	0	109.2	I122 V123 L127 L134 Q144 F154 L165 L167 L178	I122-I136 CarbonylContact C-O 3.39Å; I122-I136 WeakPolarHBondContact CA-O 3.43Å; I122-I136 WeakPolarHBondContact CG1-O 3.26Å; V123-I136 HydrophobicContact CG1-CB 3.93Å; V123-I136 HydrophobicContact CG1-CG2 4.5Å; V123-I136 PolarHBondContact N-O 3.39Å; V123-I136 PolarHBondContact O-N 3.46Å; L127-I136 HydrophobicContact CB-CD1 4.14Å; L127-I136 HydrophobicContact CD2-CD1 4.03Å; L134-I136 HydrophobicContact CB-CG1 3.9Å; L134-I136 PolarHBondContact O-N 3.22Å; I136-Q144 CarbonylContact C-O 3.59Å; I136-Q144 VanDerWaalsContact CA-O 3.32Å; I136-Q144 WeakPolarHBondContact CA-O 3.49Å; I136-F154 HydrophobicContact CG2-CD1 4.18Å; I136-F154 HydrophobicContact CG2-CE1 4.08Å; I136-L165 HydrophobicContact CG2-CD1 4.34Å; I136-L167 HydrophobicContact CD1-CD1 4.07Å; I136-L167 HydrophobicContact CD1-CD2 3.98Å; I136-L167 HydrophobicContact CD1-CG 4.44Å; I136-L178 HydrophobicContact CD1-CD1 4.17Å; I136-L178 HydrophobicContact CG2-CD1 4.2Å; I136-L178 HydrophobicContact CG2-CD2 3.82Å
137	I	96.5	Very high	92.2	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.01	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	148.4	177.4	60.2	167.1	0	0	0	111.2	L99 V115 A119 A121 I122 L143 Q144 F146	L99-I137 HydrophobicContact CD1-CG2 4.05Å; L99-I137 HydrophobicContact CD2-CD1 4.49Å; L99-I137 HydrophobicContact CD2-CG2 3.85Å; V115-I137 HydrophobicContact CB-CD1 4.06Å; V115-I137 HydrophobicContact CG1-CD1 3.38Å; V115-I137 HydrophobicContact CG2-CD1 3.51Å; A119-I137 HydrophobicContact CB-CB 4.49Å; A119-I137 HydrophobicContact CB-CG2 4.42Å; A121-I137 WeakPolarHBondContact O-CA 3.43Å; I122-I137 HydrophobicContact CB-CG2 4.25Å; I122-I137 HydrophobicContact CD1-CG2 3.78Å; I122-I137 HydrophobicContact CG1-CG2 3.82Å; I137-L143 WeakPolarHBondContact O-CA 3.37Å; I137-Q144 HydrophobicContact CD1-CB 4.19Å; I137-Q144 HydrophobicContact CD1-CG 4.48Å; I137-Q144 HydrophobicContact CG1-CB 3.81Å; I137-Q144 HydrophobicContact CG1-CG 4.38Å; I137-Q144 WeakPolarHBondContact CG1-O 3.5Å; I137-Q144 PolarHBondContact N-O 3.06Å; I137-Q144 PolarHBondContact O-N 3.14Å; I137-F146 HydrophobicContact CD1-CE2 3.7Å; I137-F146 HydrophobicContact CG1-CE2 4.03Å
138	G	94.8	Very high	92.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.9	170.6	0	0	0	0	0	110.9	N120 A121	N120-G138 WeakPolarHBondContact CA-O 3.48Å; N120-G138 WeakPolarHBondContact CB-O 3.23Å; N120-G138 PolarHBondContact N-O 3.23Å; A121-G138 PolarHBondContact N-O 3.23Å; A121-G138 PolarHBondContact O-N 2.94Å
139	G	91.7	Very high	92.1	Very high	2 Å²	2	26.4 Å²	26.4	2%	0.021	14%	0.142	C	C	.	.			trans	-117.4	-140.7	-179.5	0	0	0	0	0	112.7	D117 G118 N120 C141 A142 V162	D117-G139 CarbonylContact O-C 3.58Å; D117-G139 WeakPolarHBondContact O-CA 3.17Å; G118-G139 WeakPolarHBondContact O-CA 3.09Å; N120-G139 PolarHBondContact ND2-O 3.41Å; G139-C141 PolarHBondContact O-N 3.15Å; G139-A142 PolarHBondContact N-O 3.5Å; G139-V162 PolarHBondContact O-N 3.01Å
140	N	89	Confident	92.2	Very high	16 Å²	16	21.5 Å²	21.5	9%	0.086	12%	0.116	C	C	.	.	S	Bend	trans	-81.4	94	178.5	-63.2	-20.3	0	0	0	110.7	D117 N120 A142 N161 N665	D117-N140 WeakPolarHBondContact O-CB 3.22Å; D117-N140 VanDerWaalsContact O-CG 3.25Å; D117-N140 PolarHBondContact O-N 3.15Å; D117-N140 PolarHBondContact O-ND2 3.25Å; N120-N140 PolarHBondContact ND2-OD1 2.91Å; N140-A142 PolarHBondContact O-N 3.43Å; N140-A142 VanDerWaalsContact O-N 3.08Å; N140-N161 WeakPolarHBondContact CA-OD1 3.33Å; N140-N161 PolarHBondContact OD1-OD1 2.87Å; N140-N665 PolarHBondContact O-ND2 3.36Å; N140-N665 VanDerWaalsContact O-ND2 3.1Å
141	C	87.8	Confident	92.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	61.6	6.5	-176.2	-58	0	0	0	0	115.3	G139 V157 T158 G159 D160 N665	G139-C141 PolarHBondContact O-N 3.15Å; C141-V157 CarbonylContact O-C 3.6Å; C141-V157 WeakPolarHBondContact O-CA 3.29Å; C141-V157 WeakPolarHBondContact O-CG2 3.28Å; C141-T158 PolarHBondContact O-N 3.46Å; C141-G159 PolarHBondContact SG-O 3.5Å; C141-D160 VanDerWaalsContact SG-CA 3.54Å; C141-N665 HydrophobicContact CB-CB 3.69Å
142	A	90.6	Very high	92.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.1	-178.2	0	0	0	0	0	112.1	D117 G139 N140	D117-A142 HydrophobicContact CB-CB 4.12Å; D117-A142 WeakPolarHBondContact OD2-CB 3.33Å; G139-A142 PolarHBondContact N-O 3.5Å; N140-A142 PolarHBondContact O-N 3.43Å; N140-A142 VanDerWaalsContact O-N 3.08Å
143	L	93.9	Very high	92.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.8	172.3	-66.4	163.1	0	0	0	108.2	I137 F154 W155 T156 V162 L165 L178 V180 F190	I137-L143 WeakPolarHBondContact O-CA 3.37Å; L143-F154 HydrophobicContact CB-CE1 4Å; L143-F154 HydrophobicContact CB-CZ 4.41Å; L143-W155 VanDerWaalsContact O-CA 3.26Å; L143-W155 WeakPolarHBondContact O-CA 3.32Å; L143-T156 HydrophobicContact CB-CG2 4.02Å; L143-T156 HydrophobicContact CD1-CG2 3.64Å; L143-T156 HydrophobicContact CG-CG2 4.38Å; L143-T156 PolarHBondContact N-O 2.8Å; L143-T156 PolarHBondContact O-N 3.16Å; L143-V162 HydrophobicContact CD2-CG1 4.33Å; L143-V162 HydrophobicContact CD2-CG2 3.78Å; L143-V162 HydrophobicContact CG-CG2 4.31Å; L143-L165 HydrophobicContact CD2-CD1 4.38Å; L143-L165 HydrophobicContact CD2-CD2 3.78Å; L143-L178 HydrophobicContact CD1-CD2 4.27Å; L143-L178 HydrophobicContact CD2-CD2 4.47Å; L143-V180 HydrophobicContact CD1-CG1 4.18Å; L143-V180 HydrophobicContact CD1-CG2 3.64Å; L143-V180 HydrophobicContact CD2-CG1 4.17Å; L143-V180 HydrophobicContact CD2-CG2 4.19Å; L143-F190 HydrophobicContact CD1-CD2 4.18Å; L143-F190 HydrophobicContact CD1-CE2 3.98Å
144	Q	93.8	Very high	92.6	Very high	21 Å²	21	23.2 Å²	23.2	10%	0.098	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143.3	179.5	-41.7	-169.1	-19	0	0	109.4	D117 I136 I137 F146 F154	D117-Q144 PolarHBondContact OD2-NE2 3.32Å; I136-Q144 CarbonylContact C-O 3.59Å; I136-Q144 VanDerWaalsContact CA-O 3.32Å; I136-Q144 WeakPolarHBondContact CA-O 3.49Å; I137-Q144 HydrophobicContact CD1-CB 4.19Å; I137-Q144 HydrophobicContact CD1-CG 4.48Å; I137-Q144 HydrophobicContact CG1-CB 3.81Å; I137-Q144 HydrophobicContact CG1-CG 4.38Å; I137-Q144 WeakPolarHBondContact CG1-O 3.5Å; I137-Q144 PolarHBondContact N-O 3.06Å; I137-Q144 PolarHBondContact O-N 3.14Å; Q144-F146 HydrophobicContact CB-CE2 3.92Å; Q144-F146 HydrophobicContact CB-CZ 4.05Å; Q144-F154 CarbonylContact C-O 3.54Å; Q144-F154 VanDerWaalsContact CA-O 3.25Å; Q144-F154 WeakPolarHBondContact CA-O 3.39Å
145	G	94.9	Very high	92.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119.3	-179.6	0	0	0	0	0	111.9	A135 H153 F154	A135-G145 WeakPolarHBondContact O-CA 3.47Å; G145-H153 PolarHBondContact O-N 2.86Å; G145-F154 PolarHBondContact N-O 3.42Å; G145-F154 PolarHBondContact O-N 2.83Å
146	F	95	Very high	92.1	Very high	11 Å²	11	25 Å²	25	5%	0.048	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.4	-175.6	-58.1	-79.2	0	0	0	112.4	L99 F111 V115 L134 A135 I137 Q144 N151 D152	L99-F146 HydrophobicContact CD2-CD2 3.53Å; L99-F146 HydrophobicContact CD2-CE2 3.91Å; L99-F146 HydrophobicContact CD2-CG 4.44Å; F111-F146 HydrophobicContact CE1-CB 4.43Å; F111-F146 HydrophobicContact CZ-CB 3.99Å; V115-F146 HydrophobicContact CG2-CE2 4.5Å; L134-F146 CarbonylContact C-O 3.52Å; L134-F146 VanDerWaalsContact CA-O 3.29Å; L134-F146 WeakPolarHBondContact CA-O 3.49Å; A135-F146 PolarHBondContact N-O 3.03Å; A135-F146 PolarHBondContact O-N 2.81Å; I137-F146 HydrophobicContact CD1-CE2 3.7Å; I137-F146 HydrophobicContact CG1-CE2 4.03Å; Q144-F146 HydrophobicContact CB-CE2 3.92Å; Q144-F146 HydrophobicContact CB-CZ 4.05Å; F146-N151 VanDerWaalsContact CA-O 3.28Å; F146-N151 WeakPolarHBondContact CA-O 3.39Å; F146-D152 HydrophobicContact CD1-CB 4.32Å; F146-D152 HydrophobicContact CE1-CB 4.1Å
147	D	93.6	Very high	91.7	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.048	12%	0.119	C	C	.	.			trans	-78.5	-175.6	169	68.5	10	0	0	0	112.2	F111 L134 E149 G150 N151 H153	F111-D147 VanDerWaalsContact CE1-O 3.24Å; F111-D147 WeakPolarHBondContact CE1-O 3.49Å; L134-D147 HydrophobicContact CD2-CB 4.24Å; D147-E149 PolarHBondContact O-N 3.49Å; D147-E149 WeakPolarHBondContact OD1-CA 3.39Å; D147-E149 WeakPolarHBondContact OD1-CB 3.32Å; D147-E149 PolarHBondContact OD1-N 2.64Å; D147-G150 PolarHBondContact O-N 3.1Å; D147-G150 PolarHBondContact OD1-N 3.36Å; D147-N151 PolarHBondContact N-O 3.42Å; D147-N151 VanDerWaalsContact N-O 3.08Å; D147-N151 PolarHBondContact OD1-N 3.36Å; D147-N151 WeakPolarHBondContact OD2-CB 3.49Å; D147-N151 PolarHBondContact OD2-ND2 2.74Å; D147-H153 IonicContact OD2-CD2 4Å; D147-H153 PolarHBondContact OD2-CD2 3.3Å; D147-H153 IonicContact OD2-CE1 3.17Å; D147-H153 IonicContact OD2-NE2 3.72Å; D147-H153 PolarHBondContact OD2-NE2 2.86Å
148	Y	91.1	Very high	91.3	Very high	93 Å²	93	25.1 Å²	25.1	37%	0.365	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16	178.1	72.1	-89.5	0	0	0	114.1	V110	V110-Y148 WeakPolarHBondContact CG1-O 2.94Å
149	E	91.1	Very high	90.7	Very high	102 Å²	102	25.6 Å²	25.6	48%	0.477	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.1	174.5	-55.9	-175.8	168.5	0	0	111.6	D147 N151	D147-E149 PolarHBondContact O-N 3.49Å; D147-E149 WeakPolarHBondContact OD1-CA 3.39Å; D147-E149 WeakPolarHBondContact OD1-CB 3.32Å; D147-E149 PolarHBondContact OD1-N 2.64Å; E149-N151 PolarHBondContact OE2-ND2 2.64Å
150	G	90.1	Very high	90.5	Very high	2 Å²	2	27 Å²	27	2%	0.021	13%	0.13	C	C	.	.			trans	75.9	23.1	-174.3	0	0	0	0	0	113.2	R113 D147	R113-G150 VanDerWaalsContact CZ-O 3.3Å; R113-G150 PolarHBondContact NE-O 2.96Å; R113-G150 PolarHBondContact NH2-O 2.95Å; D147-G150 PolarHBondContact O-N 3.1Å; D147-G150 PolarHBondContact OD1-N 3.36Å
151	N	91.6	Very high	90.7	Very high	65 Å²	65	27.2 Å²	27.2	35%	0.348	13%	0.132	S	C	.	.			trans	-80.3	138.8	171.4	-58	-48.7	0	0	0	110.2	F146 D147 E149 H153	F146-N151 VanDerWaalsContact CA-O 3.28Å; F146-N151 WeakPolarHBondContact CA-O 3.39Å; D147-N151 PolarHBondContact N-O 3.42Å; D147-N151 VanDerWaalsContact N-O 3.08Å; D147-N151 PolarHBondContact OD1-N 3.36Å; D147-N151 WeakPolarHBondContact OD2-CB 3.49Å; D147-N151 PolarHBondContact OD2-ND2 2.74Å; E149-N151 PolarHBondContact OE2-ND2 2.64Å; N151-H153 PolarHBondContact O-CD2 3.06Å; N151-H153 PolarHBondContact O-N 2.97Å
152	D	89.9	Confident	91.1	Very high	54 Å²	54	27.2 Å²	27.2	29%	0.289	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	108.1	178.1	172.1	25.6	0	0	0	110.9	F146 F154 R688	F146-D152 HydrophobicContact CD1-CB 4.32Å; F146-D152 HydrophobicContact CE1-CB 4.1Å; D152-F154 PolarHBondContact OD1-N 2.75Å; D152-R688 IonicContact OD2-CZ 2.68Å; D152-R688 VanDerWaalsContact OD2-CZ 3.27Å; D152-R688 IonicContact OD2-NH1 3.36Å; D152-R688 PolarHBondContact OD2-NH1 2.58Å; D152-R688 IonicContact OD2-NH2 3.82Å; D152-R688 PolarHBondContact OD2-NH2 2.89Å
153	H	90.3	Very high	91.3	Very high	102 Å²	102	32.6 Å²	32.6	47%	0.472	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-14.5	178.4	-72.4	-81	0	0	0	113.5	L134 G145 D147 N151	L134-H153 HydrophobicContact CD1-CB 4.46Å; L134-H153 HydrophobicContact CD2-CB 4.09Å; G145-H153 PolarHBondContact O-N 2.86Å; D147-H153 IonicContact OD2-CD2 4Å; D147-H153 PolarHBondContact OD2-CD2 3.3Å; D147-H153 IonicContact OD2-CE1 3.17Å; D147-H153 IonicContact OD2-NE2 3.72Å; D147-H153 PolarHBondContact OD2-NE2 2.86Å; N151-H153 PolarHBondContact O-CD2 3.06Å; N151-H153 PolarHBondContact O-N 2.97Å
154	F	91	Very high	91.4	Very high	8 Å²	8	33 Å²	33	4%	0.035	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	124.9	-175.9	169.4	-113.1	0	0	0	109.9	L127 L134 I136 L143 Q144 G145 D152 T156 L178 E192	L127-F154 HydrophobicContact CD2-CB 4.44Å; L127-F154 HydrophobicContact CD2-CD1 3.99Å; L127-F154 HydrophobicContact CD2-CD2 3.83Å; L127-F154 HydrophobicContact CD2-CE1 4.18Å; L127-F154 HydrophobicContact CD2-CE2 4.08Å; L127-F154 HydrophobicContact CD2-CG 3.79Å; L127-F154 HydrophobicContact CD2-CZ 4.22Å; L134-F154 HydrophobicContact CD1-CB 4.03Å; I136-F154 HydrophobicContact CG2-CD1 4.18Å; I136-F154 HydrophobicContact CG2-CE1 4.08Å; L143-F154 HydrophobicContact CB-CE1 4Å; L143-F154 HydrophobicContact CB-CZ 4.41Å; Q144-F154 CarbonylContact C-O 3.54Å; Q144-F154 VanDerWaalsContact CA-O 3.25Å; Q144-F154 WeakPolarHBondContact CA-O 3.39Å; G145-F154 PolarHBondContact N-O 3.42Å; G145-F154 PolarHBondContact O-N 2.83Å; D152-F154 PolarHBondContact OD1-N 2.75Å; F154-T156 HydrophobicContact CE2-CG2 4.05Å; F154-T156 HydrophobicContact CZ-CG2 3.62Å; F154-L178 HydrophobicContact CE1-CD2 3.75Å; F154-L178 HydrophobicContact CZ-CD2 4.05Å; F154-E192 WeakPolarHBondContact CE2-O 3.35Å
155	W	91.3	Very high	91.6	Very high	34 Å²	34	32.8 Å²	32.8	13%	0.129	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	136.3	170.9	-176.1	98.1	0	0	0	111.3	L143 V157 I668 I684 R688	L143-W155 VanDerWaalsContact O-CA 3.26Å; L143-W155 WeakPolarHBondContact O-CA 3.32Å; W155-V157 HydrophobicContact CH2-CB 4.41Å; W155-I668 HydrophobicContact CH2-CD1 4.38Å; W155-I684 HydrophobicContact CE3-CG2 4.42Å; W155-I684 HydrophobicContact CZ3-CG2 3.7Å; W155-R688 VanDerWaalsContact CD2-CD 3.48Å; W155-R688 HydrophobicContact CD2-CG 4.11Å; W155-R688 HydrophobicContact CE3-CB 4.14Å; W155-R688 HydrophobicContact CE3-CG 3.84Å; W155-R688 VanDerWaalsContact CG-NH2 3.26Å; W155-R688 HydrophobicContact CH2-CB 3.96Å; W155-R688 HydrophobicContact CH2-CG 3.82Å; W155-R688 HydrophobicContact CZ2-CG 4.1Å; W155-R688 HydrophobicContact CZ3-CB 3.62Å; W155-R688 HydrophobicContact CZ3-CG 3.67Å
156	T	90.1	Very high	91.7	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	170	170.1	-166.1	0	0	0	0	110.2	L143 F154 F190	L143-T156 HydrophobicContact CB-CG2 4.02Å; L143-T156 HydrophobicContact CD1-CG2 3.64Å; L143-T156 HydrophobicContact CG-CG2 4.38Å; L143-T156 PolarHBondContact N-O 2.8Å; L143-T156 PolarHBondContact O-N 3.16Å; F154-T156 HydrophobicContact CE2-CG2 4.05Å; F154-T156 HydrophobicContact CZ-CG2 3.62Å; T156-F190 HydrophobicContact CG2-CD1 4.13Å; T156-F190 HydrophobicContact CG2-CE1 4.04Å; T156-F190 HydrophobicContact CG2-CZ 4.36Å
157	V	88.5	Confident	91.7	Very high	5 Å²	5	34 Å²	34	3%	0.03	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.6	-179	75.4	0	0	0	0	109.8	C141 W155 N665 I668 Q669 I684	C141-V157 CarbonylContact O-C 3.6Å; C141-V157 WeakPolarHBondContact O-CA 3.29Å; C141-V157 WeakPolarHBondContact O-CG2 3.28Å; W155-V157 HydrophobicContact CH2-CB 4.41Å; V157-N665 HydrophobicContact CG2-CB 4.02Å; V157-N665 WeakPolarHBondContact CG2-O 3.48Å; V157-I668 HydrophobicContact CG1-CG2 4.18Å; V157-Q669 HydrophobicContact CG1-CB 3.92Å; V157-Q669 HydrophobicContact CG1-CG 4.36Å; V157-Q669 HydrophobicContact CG2-CB 4.12Å; V157-I684 HydrophobicContact CB-CG2 4.46Å; V157-I684 HydrophobicContact CG1-CD1 3.92Å; V157-I684 HydrophobicContact CG1-CG1 3.95Å; V157-I684 HydrophobicContact CG1-CG2 3.85Å
158	T	87.4	Confident	91.8	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	16%	0.16	C	C	.	.			trans	-115.6	169.5	174.4	-173.1	0	0	0	0	110.3	C141 D160 V162 S182 R188	C141-T158 PolarHBondContact O-N 3.46Å; T158-D160 WeakPolarHBondContact CG2-O 3.3Å; T158-V162 HydrophobicContact CG2-CG2 3.56Å; T158-S182 PolarHBondContact OG1-OG 2.95Å; T158-S182 VanDerWaalsContact OG1-OG 3.09Å; T158-R188 PolarHBondContact OG1-NH1 2.89Å
159	G	80.9	Confident	92	Very high	10 Å²	10	31 Å²	31	10%	0.103	15%	0.151	C	C	.	.	S	Bend	trans	-63.7	-46.6	-175.6	0	0	0	0	0	113.4	C141 D184	C141-G159 PolarHBondContact SG-O 3.5Å; G159-D184 WeakPolarHBondContact CA-OD2 3.26Å
160	D	89.1	Confident	92.1	Very high	31 Å²	31	26.6 Å²	26.6	17%	0.166	13%	0.131	C	C	.	.	S	Bend	trans	-141.9	176.8	-178.7	-147.5	-22.6	0	0	0	111.9	C141 T158 V162 S182 E183 D184 K662	C141-D160 VanDerWaalsContact SG-CA 3.54Å; T158-D160 WeakPolarHBondContact CG2-O 3.3Å; D160-V162 PolarHBondContact O-N 2.83Å; D160-S182 PolarHBondContact O-OG 3.45Å; D160-S182 VanDerWaalsContact O-OG 3.14Å; D160-E183 HydrophobicContact CB-CB 4.09Å; D160-D184 HydrophobicContact CB-CB 3.89Å; D160-K662 WeakPolarHBondContact OD1-CE 3.49Å; D160-K662 IonicContact OD1-NZ 3.97Å; D160-K662 PolarHBondContact OD1-NZ 3.44Å; D160-K662 IonicContact OD2-NZ 2.64Å
161	N	92.6	Very high	92.1	Very high	21 Å²	21	29.1 Å²	29.1	11%	0.112	15%	0.146	C	C	.	.			trans	-43.8	128.4	178.2	-64.5	-16.4	0	0	0	111.3	N140 S182 E183 K662	N140-N161 WeakPolarHBondContact CA-OD1 3.33Å; N140-N161 PolarHBondContact OD1-OD1 2.87Å; N161-S182 WeakPolarHBondContact O-CA 3.28Å; N161-E183 HydrophobicContact CB-CB 4.43Å; N161-E183 HydrophobicContact CB-CG 3.91Å; N161-E183 WeakPolarHBondContact CB-OE2 3.38Å; N161-E183 PolarHBondContact ND2-OE2 3.21Å; N161-E183 PolarHBondContact O-N 3.15Å; N161-K662 PolarHBondContact ND2-NZ 2.87Å; N161-K662 PolarHBondContact OD1-NZ 2.8Å
162	V	95.6	Very high	92.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	134.2	178.7	-178.4	0	0	0	0	109	N120 A121 G139 L143 T158 D160 L165 V180	N120-V162 WeakPolarHBondContact CB-O 3.44Å; A121-V162 HydrophobicContact CB-CG1 4.26Å; G139-V162 PolarHBondContact O-N 3.01Å; L143-V162 HydrophobicContact CD2-CG1 4.33Å; L143-V162 HydrophobicContact CD2-CG2 3.78Å; L143-V162 HydrophobicContact CG-CG2 4.31Å; T158-V162 HydrophobicContact CG2-CG2 3.56Å; D160-V162 PolarHBondContact O-N 2.83Å; V162-L165 HydrophobicContact CG1-CD1 4.43Å; V162-L165 HydrophobicContact CG1-CD2 3.67Å; V162-L165 HydrophobicContact CG1-CG 3.86Å; V162-V180 HydrophobicContact CB-CG1 4.47Å; V162-V180 HydrophobicContact CG1-CG1 3.85Å; V162-V180 HydrophobicContact CG2-CG1 3.89Å
163	R	95.7	Very high	92.1	Very high	112 Å²	112	29.7 Å²	29.7	42%	0.423	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	-22.5	-179.5	-70.7	-58.7	-163.9	168.6	-1.3	113.9	G181 E183 T204 V205	R163-G181 PolarHBondContact N-O 3.44Å; R163-E183 HydrophobicContact CG-CG 3.73Å; R163-E183 IonicContact CZ-OE1 3.41Å; R163-E183 IonicContact NE-OE1 3.58Å; R163-E183 PolarHBondContact NE-OE1 3.01Å; R163-E183 IonicContact NH2-OE1 3.27Å; R163-E183 PolarHBondContact NH2-OE1 3.42Å; R163-T204 HydrophobicContact CB-CG2 4.29Å; R163-T204 HydrophobicContact CG-CG2 3.77Å; R163-V205 VanDerWaalsContact CB-O 3.23Å; R163-V205 WeakPolarHBondContact CB-O 3.45Å
164	S	96.4	Very high	92.1	Very high	8 Å²	8	28 Å²	28	6%	0.056	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	147	176.4	51.6	0	0	0	0	111.3	G181 V205	S164-G181 PolarHBondContact N-O 3.38Å; S164-G181 PolarHBondContact O-N 2.73Å; S164-V205 PolarHBondContact OG-O 2.78Å; S164-V205 VanDerWaalsContact OG-O 3.07Å
165	L	97.5	Very high	92.2	Very high	17 Å²	17	30.7 Å²	30.7	9%	0.089	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.7	179.8	-67.1	177.8	0	0	0	109.4	A121 V123 I136 L143 V162 L178 L179 V180	A121-L165 HydrophobicContact CB-CD1 4.27Å; A121-L165 HydrophobicContact CB-CG 4.06Å; V123-L165 HydrophobicContact CB-CB 4.04Å; V123-L165 HydrophobicContact CG1-CB 3.79Å; V123-L165 HydrophobicContact CG1-CD1 4.29Å; I136-L165 HydrophobicContact CG2-CD1 4.34Å; L143-L165 HydrophobicContact CD2-CD1 4.38Å; L143-L165 HydrophobicContact CD2-CD2 3.78Å; V162-L165 HydrophobicContact CG1-CD1 4.43Å; V162-L165 HydrophobicContact CG1-CD2 3.67Å; V162-L165 HydrophobicContact CG1-CG 3.86Å; L165-L178 HydrophobicContact CB-CD1 4.45Å; L165-L178 HydrophobicContact CD2-CD1 4.16Å; L165-L178 HydrophobicContact CD2-CG 4.43Å; L165-L179 WeakPolarHBondContact CA-O 3.42Å; L165-V180 HydrophobicContact CD2-CB 4.08Å; L165-V180 HydrophobicContact CD2-CG1 3.95Å; L165-V180 HydrophobicContact CD2-CG2 3.68Å
166	V	97.1	Very high	92.4	Very high	15 Å²	15	31.9 Å²	31.9	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	147	169.7	68.2	0	0	0	0	110.4	F168 L179 L208 H210	V166-F168 HydrophobicContact CG1-CD1 3.97Å; V166-F168 HydrophobicContact CG1-CE1 3.74Å; V166-F168 HydrophobicContact CG2-CD1 4.24Å; V166-L179 HydrophobicContact CG1-CB 3.67Å; V166-L179 PolarHBondContact N-O 2.95Å; V166-L179 VanDerWaalsContact N-O 3.08Å; V166-L179 PolarHBondContact O-N 2.97Å; V166-L208 HydrophobicContact CB-CB 4.14Å; V166-L208 HydrophobicContact CG1-CB 3.71Å; V166-L208 HydrophobicContact CG1-CD1 4.41Å; V166-H210 HydrophobicContact CG2-CB 3.99Å
167	L	95.6	Very high	92.7	Very high	22 Å²	22	31.8 Å²	31.8	12%	0.115	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.4	178.2	-75.7	168.6	0	0	0	110	V123 L127 I136 E177 L178	V123-L167 HydrophobicContact CG1-CD1 4Å; V123-L167 HydrophobicContact CG1-CG 3.95Å; V123-L167 HydrophobicContact CG2-CB 4.35Å; V123-L167 HydrophobicContact CG2-CD1 4Å; V123-L167 HydrophobicContact CG2-CG 4.05Å; L127-L167 HydrophobicContact CB-CD2 4.48Å; L127-L167 HydrophobicContact CD1-CD2 3.92Å; I136-L167 HydrophobicContact CD1-CD1 4.07Å; I136-L167 HydrophobicContact CD1-CD2 3.98Å; I136-L167 HydrophobicContact CD1-CG 4.44Å; L167-E177 WeakPolarHBondContact CA-O 3.4Å; L167-L178 HydrophobicContact CD2-CB 4.02Å; L167-L178 HydrophobicContact CD2-CD1 3.8Å; L167-L178 HydrophobicContact CG-CD1 4.12Å
168	F	94.9	Very high	93.1	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	164.5	168.5	64.7	-86.3	0	0	0	111.4	V166 F170 E177 L179 H210 F216	V166-F168 HydrophobicContact CG1-CD1 3.97Å; V166-F168 HydrophobicContact CG1-CE1 3.74Å; V166-F168 HydrophobicContact CG2-CD1 4.24Å; F168-F170 HydrophobicContact CD2-CB 4.43Å; F168-F170 HydrophobicContact CE2-CB 3.94Å; F168-F170 HydrophobicContact CE2-CD2 4.01Å; F168-F170 HydrophobicContact CE2-CG 4.47Å; F168-F170 HydrophobicContact CZ-CD2 4.08Å; F168-F170 PolarHBondContact O-N 3.16Å; F168-F170 VanDerWaalsContact O-N 3.08Å; F168-E177 PolarHBondContact N-O 2.83Å; F168-E177 VanDerWaalsContact N-O 3.1Å; F168-E177 PolarHBondContact O-N 2.71Å; F168-L179 HydrophobicContact CD1-CD1 4.27Å; F168-L179 HydrophobicContact CE1-CB 4.4Å; F168-L179 HydrophobicContact CE1-CD1 3.57Å; F168-L179 HydrophobicContact CE1-CD2 3.6Å; F168-L179 HydrophobicContact CE1-CG 4.02Å; F168-L179 HydrophobicContact CE2-CD1 4.37Å; F168-L179 HydrophobicContact CZ-CD1 3.6Å; F168-L179 HydrophobicContact CZ-CD2 3.51Å; F168-L179 HydrophobicContact CZ-CG 4.15Å; F168-H210 HydrophobicContact CB-CB 4Å; F168-H210 WeakPolarHBondContact CB-CD2 2.95Å; F168-H210 VanDerWaalsContact CB-CG 3.47Å; F168-H210 HydrophobicContact CD1-CB 3.88Å; F168-H210 AromaticContact CD1-CD2 3.8Å; F168-H210 AromaticContact CD2-CD2 3.52Å; F168-H210 AromaticContact CD2-NE2 3.91Å; F168-H210 HydrophobicContact CG-CB 4.11Å; F168-H210 AromaticContact CG-CD2 3.25Å; F168-H210 WeakPolarHBondContact CG-CD2 3.38Å; F168-H210 AromaticContact CG-CG 3.78Å; F168-H210 AromaticContact CG-NE2 3.86Å; F168-F216 HydrophobicContact CE1-CB 3.76Å; F168-F216 HydrophobicContact CE1-CD1 4.34Å; F168-F216 HydrophobicContact CE1-CG 4.15Å; F168-F216 HydrophobicContact CE2-CD1 4.29Å; F168-F216 HydrophobicContact CZ-CB 3.65Å; F168-F216 AromaticContact CZ-CD1 3.51Å; F168-F216 HydrophobicContact CZ-CD1 3.51Å; F168-F216 HydrophobicContact CZ-CE1 4.36Å; F168-F216 AromaticContact CZ-CG 3.76Å; F168-F216 HydrophobicContact CZ-CG 3.76Å
169	D	95	Very high	93.5	Very high	36 Å²	36	31.5 Å²	31.5	19%	0.193	19%	0.192	C	C	.	.			trans	-72.2	96	174.5	-178.3	9.9	0	0	0	111.1	T171 G172 D173 G174 K175 N176	D169-T171 PolarHBondContact OD1-N 2.99Å; D169-G172 WeakPolarHBondContact OD1-CA 3.42Å; D169-G172 PolarHBondContact OD1-N 2.91Å; D169-G172 VanDerWaalsContact OD2-C 3.27Å; D169-G172 VanDerWaalsContact OD2-CA 3.27Å; D169-G172 WeakPolarHBondContact OD2-CA 3.39Å; D169-D173 PolarHBondContact OD1-N 3.5Å; D169-D173 PolarHBondContact OD2-N 3.28Å; D169-G174 WeakPolarHBondContact OD2-CA 3.48Å; D169-G174 PolarHBondContact OD2-N 3.09Å; D169-K175 WeakPolarHBondContact CA-O 3.25Å; D169-K175 WeakPolarHBondContact CB-O 3.49Å; D169-N176 PolarHBondContact N-OD1 3.09Å
170	F	93.1	Very high	94.3	Very high	10 Å²	10	31 Å²	31	4%	0.044	19%	0.187	C	C	.	.	S	Bend	trans	-81.5	-34.2	178.1	179.5	-86.9	0	0	0	111.1	F168 E177 L179 V189 F216 R230 T231	F168-F170 HydrophobicContact CD2-CB 4.43Å; F168-F170 HydrophobicContact CE2-CB 3.94Å; F168-F170 HydrophobicContact CE2-CD2 4.01Å; F168-F170 HydrophobicContact CE2-CG 4.47Å; F168-F170 HydrophobicContact CZ-CD2 4.08Å; F168-F170 PolarHBondContact O-N 3.16Å; F168-F170 VanDerWaalsContact O-N 3.08Å; F170-E177 WeakPolarHBondContact CA-OE2 3.34Å; F170-E177 HydrophobicContact CB-CB 4.29Å; F170-E177 WeakPolarHBondContact CB-OE2 3.46Å; F170-E177 PolarHBondContact N-OE2 3.44Å; F170-L179 HydrophobicContact CB-CD1 4.23Å; F170-L179 HydrophobicContact CD2-CD1 4.12Å; F170-L179 HydrophobicContact CD2-CD2 4.39Å; F170-L179 HydrophobicContact CG-CD1 4.47Å; F170-V189 HydrophobicContact CB-CG1 4.07Å; F170-V189 HydrophobicContact CD1-CG1 3.87Å; F170-V189 HydrophobicContact CD1-CG2 4.31Å; F170-V189 HydrophobicContact CD2-CG1 4.38Å; F170-V189 HydrophobicContact CD2-CG2 3.99Å; F170-V189 HydrophobicContact CE1-CG1 4.39Å; F170-V189 HydrophobicContact CE1-CG2 4.13Å; F170-V189 HydrophobicContact CE2-CG2 3.77Å; F170-V189 HydrophobicContact CG-CG1 3.86Å; F170-V189 HydrophobicContact CG-CG2 4.24Å; F170-V189 HydrophobicContact CZ-CG2 3.86Å; F170-F216 HydrophobicContact CD2-CE1 4.37Å; F170-F216 AromaticContact CE2-CE1 3.97Å; F170-F216 HydrophobicContact CE2-CE1 3.97Å; F170-R230 HydrophobicContact CE1-CB 4.38Å; F170-R230 VanDerWaalsContact CE2-CA 3.48Å; F170-R230 HydrophobicContact CE2-CB 4.37Å; F170-R230 WeakPolarHBondContact CE2-O 3.36Å; F170-R230 VanDerWaalsContact CZ-CA 3.49Å; F170-R230 HydrophobicContact CZ-CB 3.98Å; F170-R230 HydrophobicContact CZ-CG 4.46Å; F170-T231 HydrophobicContact CZ-CG2 4.34Å
171	T	91.2	Very high	94.7	Very high	55 Å²	55	29.5 Å²	29.5	34%	0.337	18%	0.179	S	C	.	.	S	Bend	trans	-84.2	-18.4	-176.2	64.4	0	0	0	0	113.8	D169 D173 E177 I196	D169-T171 PolarHBondContact OD1-N 2.99Å; T171-D173 VanDerWaalsContact OG1-CG 3.3Å; T171-D173 PolarHBondContact OG1-OD1 3.5Å; T171-E177 WeakPolarHBondContact CG2-OE1 3.19Å; T171-E177 PolarHBondContact N-OE2 3.15Å; T171-E177 PolarHBondContact OG1-OE1 3.43Å; T171-I196 HydrophobicContact CG2-CD1 3.83Å; T171-I196 HydrophobicContact CG2-CG2 4.49Å
172	G	90.1	Very high	94.7	Very high	61 Å²	61	28.5 Å²	28.5	63%	0.629	17%	0.174	S	C	*	.	S	Bend	trans	78.2	21.4	-174.3	0	0	0	0	0	113.1	D169	D169-G172 WeakPolarHBondContact OD1-CA 3.42Å; D169-G172 PolarHBondContact OD1-N 2.91Å; D169-G172 VanDerWaalsContact OD2-C 3.27Å; D169-G172 VanDerWaalsContact OD2-CA 3.27Å; D169-G172 WeakPolarHBondContact OD2-CA 3.39Å
173	D	91.3	Very high	94.6	Very high	71 Å²	71	30.5 Å²	30.5	38%	0.38	18%	0.183	S	C	.	.	S	Bend	trans	-95.2	3.2	-176.3	85.7	-23	0	0	0	113.7	D169 T171 K175 K191	D169-D173 PolarHBondContact OD1-N 3.5Å; D169-D173 PolarHBondContact OD2-N 3.28Å; T171-D173 VanDerWaalsContact OG1-CG 3.3Å; T171-D173 PolarHBondContact OG1-OD1 3.5Å; D173-K175 VanDerWaalsContact C-N 3.32Å; D173-K175 WeakPolarHBondContact OD1-CA 3.47Å; D173-K175 WeakPolarHBondContact OD1-CB 3.13Å; D173-K175 PolarHBondContact OD1-N 3.05Å; D173-K191 IonicContact OD1-NZ 2.83Å; D173-K191 IonicContact OD2-NZ 2.73Å; D173-K191 PolarHBondContact OD2-NZ 3.16Å
174	G	90.6	Very high	94.2	Very high	67 Å²	67	26.1 Å²	26.1	69%	0.691	17%	0.168	S	C	*	.	S	Bend	trans	82.9	3.1	-178.6	0	0	0	0	0	114.3	D169	D169-G174 WeakPolarHBondContact OD2-CA 3.48Å; D169-G174 PolarHBondContact OD2-N 3.09Å
175	K	93.2	Very high	94	Very high	64 Å²	64	27.9 Å²	27.9	28%	0.278	18%	0.175	S	C	.	.	S	Bend	trans	-113	143.6	175.4	-55.2	178.9	-170.6	176.1	0	109.6	D129 D169 D173	D129-K175 WeakPolarHBondContact OD1-CD 3.5Å; D129-K175 WeakPolarHBondContact OD1-CE 3.21Å; D129-K175 IonicContact OD1-NZ 3.68Å; D129-K175 PolarHBondContact OD1-NZ 2.67Å; D129-K175 IonicContact OD2-NZ 2.69Å; D129-K175 PolarHBondContact OD2-NZ 3.09Å; D169-K175 WeakPolarHBondContact CA-O 3.25Å; D169-K175 WeakPolarHBondContact CB-O 3.49Å; D173-K175 VanDerWaalsContact C-N 3.32Å; D173-K175 WeakPolarHBondContact OD1-CA 3.47Å; D173-K175 WeakPolarHBondContact OD1-CB 3.13Å; D173-K175 PolarHBondContact OD1-N 3.05Å
176	N	94.4	Very high	93.8	Very high	59 Å²	59	27.6 Å²	27.6	32%	0.316	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-80.6	133	179.8	-65.9	-25.9	0	0	0	110.8	K126 G128 D169	K126-N176 VanDerWaalsContact O-CB 3.3Å; K126-N176 WeakPolarHBondContact O-CB 3.42Å; K126-N176 PolarHBondContact O-ND2 2.8Å; G128-N176 PolarHBondContact N-O 3.42Å; D169-N176 PolarHBondContact N-OD1 3.09Å
177	E	95.9	Very high	93.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	158.3	164.6	-71.2	92.7	-167.6	0	0	111.5	L167 F168 F170 T171 V189 F190 K191 I196	L167-E177 WeakPolarHBondContact CA-O 3.4Å; F168-E177 PolarHBondContact N-O 2.83Å; F168-E177 VanDerWaalsContact N-O 3.1Å; F168-E177 PolarHBondContact O-N 2.71Å; F170-E177 WeakPolarHBondContact CA-OE2 3.34Å; F170-E177 HydrophobicContact CB-CB 4.29Å; F170-E177 WeakPolarHBondContact CB-OE2 3.46Å; F170-E177 PolarHBondContact N-OE2 3.44Å; T171-E177 WeakPolarHBondContact CG2-OE1 3.19Å; T171-E177 PolarHBondContact N-OE2 3.15Å; T171-E177 PolarHBondContact OG1-OE1 3.43Å; E177-V189 HydrophobicContact CB-CG1 3.9Å; E177-V189 HydrophobicContact CG-CG1 4.37Å; E177-F190 WeakPolarHBondContact CA-O 3.45Å; E177-F190 WeakPolarHBondContact CB-O 3.38Å; E177-K191 HydrophobicContact CG-CB 3.77Å; E177-K191 HydrophobicContact CG-CG 4.27Å; E177-K191 IonicContact OE1-NZ 3.62Å; E177-K191 PolarHBondContact OE1-NZ 3.3Å; E177-I196 HydrophobicContact CG-CD1 3.73Å
178	L	96.9	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	116.6	176.5	-179	69.8	0	0	0	110.1	V123 L127 I136 L143 F154 L165 L167 V180 F190	V123-L178 HydrophobicContact CG1-CD1 3.82Å; L127-L178 HydrophobicContact CD1-CB 3.82Å; I136-L178 HydrophobicContact CD1-CD1 4.17Å; I136-L178 HydrophobicContact CG2-CD1 4.2Å; I136-L178 HydrophobicContact CG2-CD2 3.82Å; L143-L178 HydrophobicContact CD1-CD2 4.27Å; L143-L178 HydrophobicContact CD2-CD2 4.47Å; F154-L178 HydrophobicContact CE1-CD2 3.75Å; F154-L178 HydrophobicContact CZ-CD2 4.05Å; L165-L178 HydrophobicContact CB-CD1 4.45Å; L165-L178 HydrophobicContact CD2-CD1 4.16Å; L165-L178 HydrophobicContact CD2-CG 4.43Å; L167-L178 HydrophobicContact CD2-CB 4.02Å; L167-L178 HydrophobicContact CD2-CD1 3.8Å; L167-L178 HydrophobicContact CG-CD1 4.12Å; L178-V180 HydrophobicContact CD2-CG2 3.88Å; L178-V180 HydrophobicContact CG-CG2 3.82Å; L178-F190 HydrophobicContact CB-CB 4.39Å; L178-F190 PolarHBondContact N-O 3.42Å; L178-F190 PolarHBondContact O-N 3.43Å
179	L	97.1	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.2	168.8	-86.6	73.5	0	0	0	110.3	L165 V166 F168 F170 I187 R188 V189 L208 F216	L165-L179 WeakPolarHBondContact CA-O 3.42Å; V166-L179 HydrophobicContact CG1-CB 3.67Å; V166-L179 PolarHBondContact N-O 2.95Å; V166-L179 VanDerWaalsContact N-O 3.08Å; V166-L179 PolarHBondContact O-N 2.97Å; F168-L179 HydrophobicContact CD1-CD1 4.27Å; F168-L179 HydrophobicContact CE1-CB 4.4Å; F168-L179 HydrophobicContact CE1-CD1 3.57Å; F168-L179 HydrophobicContact CE1-CD2 3.6Å; F168-L179 HydrophobicContact CE1-CG 4.02Å; F168-L179 HydrophobicContact CE2-CD1 4.37Å; F168-L179 HydrophobicContact CZ-CD1 3.6Å; F168-L179 HydrophobicContact CZ-CD2 3.51Å; F168-L179 HydrophobicContact CZ-CG 4.15Å; F170-L179 HydrophobicContact CB-CD1 4.23Å; F170-L179 HydrophobicContact CD2-CD1 4.12Å; F170-L179 HydrophobicContact CD2-CD2 4.39Å; F170-L179 HydrophobicContact CG-CD1 4.47Å; L179-I187 HydrophobicContact CD2-CG2 4.25Å; L179-R188 CarbonylContact C-O 3.56Å; L179-R188 WeakPolarHBondContact CA-O 3.26Å; L179-V189 HydrophobicContact CD1-CB 4.41Å; L179-V189 HydrophobicContact CD1-CG1 3.93Å; L179-V189 HydrophobicContact CD1-CG2 4.05Å; L179-V189 HydrophobicContact CD2-CG2 4.39Å; L179-V189 HydrophobicContact CG-CG2 3.91Å; L179-L208 HydrophobicContact CB-CD1 4.25Å; L179-F216 HydrophobicContact CD2-CD1 3.9Å; L179-F216 HydrophobicContact CD2-CD2 3.91Å; L179-F216 HydrophobicContact CD2-CE1 3.79Å; L179-F216 HydrophobicContact CD2-CE2 3.81Å; L179-F216 HydrophobicContact CD2-CG 3.94Å; L179-F216 HydrophobicContact CD2-CZ 3.74Å
180	V	97.2	Very high	93.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.9	-172.6	-175.8	0	0	0	0	109.2	L143 V162 L165 L178 I187 R188 F190	L143-V180 HydrophobicContact CD1-CG1 4.18Å; L143-V180 HydrophobicContact CD1-CG2 3.64Å; L143-V180 HydrophobicContact CD2-CG1 4.17Å; L143-V180 HydrophobicContact CD2-CG2 4.19Å; V162-V180 HydrophobicContact CB-CG1 4.47Å; V162-V180 HydrophobicContact CG1-CG1 3.85Å; V162-V180 HydrophobicContact CG2-CG1 3.89Å; L165-V180 HydrophobicContact CD2-CB 4.08Å; L165-V180 HydrophobicContact CD2-CG1 3.95Å; L165-V180 HydrophobicContact CD2-CG2 3.68Å; L178-V180 HydrophobicContact CD2-CG2 3.88Å; L178-V180 HydrophobicContact CG-CG2 3.82Å; V180-I187 CarbonylContact O-C 3.59Å; V180-I187 WeakPolarHBondContact O-CA 3.23Å; V180-R188 PolarHBondContact N-O 3.14Å; V180-R188 PolarHBondContact O-N 2.98Å; V180-F190 HydrophobicContact CB-CD2 4.32Å; V180-F190 HydrophobicContact CB-CE2 4.18Å; V180-F190 HydrophobicContact CG2-CD2 3.58Å; V180-F190 HydrophobicContact CG2-CE2 3.84Å
181	G	96.7	Very high	93.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.5	171.1	0	0	0	0	0	110.9	R163 S164	R163-G181 PolarHBondContact N-O 3.44Å; S164-G181 PolarHBondContact N-O 3.38Å; S164-G181 PolarHBondContact O-N 2.73Å
182	S	93	Very high	93.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	166.2	-176.6	-81	0	0	0	0	113	T158 D160 N161 D184 D186 V205	T158-S182 PolarHBondContact OG1-OG 2.95Å; T158-S182 VanDerWaalsContact OG1-OG 3.09Å; D160-S182 PolarHBondContact O-OG 3.45Å; D160-S182 VanDerWaalsContact O-OG 3.14Å; N161-S182 WeakPolarHBondContact O-CA 3.28Å; S182-D184 VanDerWaalsContact C-N 3.27Å; S182-D184 WeakPolarHBondContact CB-OD1 3.28Å; S182-D184 PolarHBondContact O-N 3Å; S182-D186 PolarHBondContact N-O 3.35Å; S182-D186 VanDerWaalsContact N-O 3.08Å; S182-V205 PolarHBondContact O-N 2.92Å
183	E	92.9	Very high	92.6	Very high	41 Å²	41	27.3 Å²	27.3	19%	0.192	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.4	174.5	-73.6	-170.1	157.6	0	0	114.3	D160 N161 R163 F185 T204	D160-E183 HydrophobicContact CB-CB 4.09Å; N161-E183 HydrophobicContact CB-CB 4.43Å; N161-E183 HydrophobicContact CB-CG 3.91Å; N161-E183 WeakPolarHBondContact CB-OE2 3.38Å; N161-E183 PolarHBondContact ND2-OE2 3.21Å; N161-E183 PolarHBondContact O-N 3.15Å; R163-E183 HydrophobicContact CG-CG 3.73Å; R163-E183 IonicContact CZ-OE1 3.41Å; R163-E183 IonicContact NE-OE1 3.58Å; R163-E183 PolarHBondContact NE-OE1 3.01Å; R163-E183 IonicContact NH2-OE1 3.27Å; R163-E183 PolarHBondContact NH2-OE1 3.42Å; E183-F185 WeakPolarHBondContact O-CD1 3.28Å; E183-F185 VanDerWaalsContact O-CE1 3.31Å; E183-F185 WeakPolarHBondContact O-CE1 3.49Å; E183-F185 PolarHBondContact O-N 2.96Å; E183-T204 HydrophobicContact CG-CG2 4Å
184	D	88.9	Confident	92.2	Very high	21 Å²	21	27.8 Å²	27.8	11%	0.112	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	0.7	175.5	57.2	2.3	0	0	0	114.1	G159 D160 S182 D186 R188 K443	G159-D184 WeakPolarHBondContact CA-OD2 3.26Å; D160-D184 HydrophobicContact CB-CB 3.89Å; S182-D184 VanDerWaalsContact C-N 3.27Å; S182-D184 WeakPolarHBondContact CB-OD1 3.28Å; S182-D184 PolarHBondContact O-N 3Å; D184-D186 PolarHBondContact OD1-N 2.84Å; D184-R188 IonicContact OD1-CZ 3.03Å; D184-R188 IonicContact OD1-NH1 3.73Å; D184-R188 PolarHBondContact OD1-NH1 2.76Å; D184-R188 IonicContact OD1-NH2 3.88Å; D184-R188 IonicContact OD2-CZ 3.25Å; D184-R188 IonicContact OD2-NH1 3.99Å; D184-R188 PolarHBondContact OD2-NH1 2.84Å; D184-R188 IonicContact OD2-NH2 2.78Å; D184-R188 PolarHBondContact OD2-NH2 3.46Å; D184-K443 PolarHBondContact O-NZ 3.15Å
185	F	92.2	Very high	92	Very high	45 Å²	45	26.3 Å²	26.3	20%	0.197	13%	0.127	C	C	.	.	S	Bend	trans	83.4	9.8	-179.8	-41.1	-27.1	0	0	0	114.3	E183 E201 E203	E183-F185 WeakPolarHBondContact O-CD1 3.28Å; E183-F185 VanDerWaalsContact O-CE1 3.31Å; E183-F185 WeakPolarHBondContact O-CE1 3.49Å; E183-F185 PolarHBondContact O-N 2.96Å; F185-E201 WeakPolarHBondContact CB-O 3.1Å; F185-E201 WeakPolarHBondContact O-CA 3.24Å; F185-E201 VanDerWaalsContact O-CB 3.25Å; F185-E201 WeakPolarHBondContact O-CB 3.42Å; F185-E201 PolarHBondContact O-N 3.16Å; F185-E203 VanDerWaalsContact CD1-CA 3.42Å; F185-E203 WeakPolarHBondContact CE1-OE1 3.43Å
186	D	91.7	Very high	91.7	Very high	11 Å²	11	26.4 Å²	26.4	6%	0.059	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	145.1	-178.1	-60.1	-32.2	0	0	0	112.1	S182 D184 R188 E198 L199 N200	S182-D186 PolarHBondContact N-O 3.35Å; S182-D186 VanDerWaalsContact N-O 3.08Å; D184-D186 PolarHBondContact OD1-N 2.84Å; D186-R188 IonicContact OD2-CZ 2.67Å; D186-R188 IonicContact OD2-NH2 2.93Å; D186-R188 PolarHBondContact OD2-NH2 3.03Å; D186-E198 HydrophobicContact CB-CG 4.23Å; D186-L199 CarbonylContact C-O 3.39Å; D186-L199 WeakPolarHBondContact CA-O 3.48Å; D186-N200 WeakPolarHBondContact OD1-CA 3.21Å; D186-N200 VanDerWaalsContact OD1-CG 3.27Å; D186-N200 PolarHBondContact OD1-OD1 3.23Å; D186-N200 VanDerWaalsContact OD1-OD1 3.13Å
187	I	96	Very high	91.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.2	166.3	-53	172.6	0	0	0	107.4	L179 V180 E198 L199 E201 V205 L208 F216 Y218	L179-I187 HydrophobicContact CD2-CG2 4.25Å; V180-I187 CarbonylContact O-C 3.59Å; V180-I187 WeakPolarHBondContact O-CA 3.23Å; I187-E198 WeakPolarHBondContact O-CA 3.27Å; I187-L199 HydrophobicContact CB-CB 4.21Å; I187-L199 PolarHBondContact N-O 3.11Å; I187-L199 PolarHBondContact O-N 3.4Å; I187-E201 HydrophobicContact CD1-CG 4.04Å; I187-E201 HydrophobicContact CG1-CG 4.4Å; I187-V205 HydrophobicContact CD1-CG1 4.25Å; I187-V205 HydrophobicContact CD1-CG2 4.28Å; I187-V205 HydrophobicContact CG1-CB 4.38Å; I187-V205 HydrophobicContact CG1-CG1 4.01Å; I187-V205 HydrophobicContact CG1-CG2 3.61Å; I187-L208 HydrophobicContact CD1-CD2 4.11Å; I187-L208 HydrophobicContact CG2-CD1 4.34Å; I187-L208 HydrophobicContact CG2-CD2 4.36Å; I187-F216 HydrophobicContact CD1-CE2 4.24Å; I187-F216 HydrophobicContact CG2-CE2 4.41Å; I187-Y218 HydrophobicContact CD1-CD2 4.45Å; I187-Y218 HydrophobicContact CD1-CG 4.36Å
188	R	94.4	Very high	91.1	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.015	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.1	-177.5	-68	-178.7	-176.9	97.6	3.7	111	T158 L179 V180 D184 D186 F190 L195 S197 E198	T158-R188 PolarHBondContact OG1-NH1 2.89Å; L179-R188 CarbonylContact C-O 3.56Å; L179-R188 WeakPolarHBondContact CA-O 3.26Å; V180-R188 PolarHBondContact N-O 3.14Å; V180-R188 PolarHBondContact O-N 2.98Å; D184-R188 IonicContact OD1-CZ 3.03Å; D184-R188 IonicContact OD1-NH1 3.73Å; D184-R188 PolarHBondContact OD1-NH1 2.76Å; D184-R188 IonicContact OD1-NH2 3.88Å; D184-R188 IonicContact OD2-CZ 3.25Å; D184-R188 IonicContact OD2-NH1 3.99Å; D184-R188 PolarHBondContact OD2-NH1 2.84Å; D184-R188 IonicContact OD2-NH2 2.78Å; D184-R188 PolarHBondContact OD2-NH2 3.46Å; D186-R188 IonicContact OD2-CZ 2.67Å; D186-R188 IonicContact OD2-NH2 2.93Å; D186-R188 PolarHBondContact OD2-NH2 3.03Å; R188-F190 HydrophobicContact CB-CD2 4.22Å; R188-F190 HydrophobicContact CB-CE2 3.62Å; R188-F190 HydrophobicContact CB-CZ 4.22Å; R188-L195 HydrophobicContact CB-CD1 3.73Å; R188-L195 HydrophobicContact CG-CD1 4.08Å; R188-S197 WeakPolarHBondContact CA-O 3.34Å; R188-E198 HydrophobicContact CG-CG 4.08Å; R188-E198 IonicContact CZ-OE1 3.89Å; R188-E198 IonicContact NE-OE1 3.13Å; R188-E198 PolarHBondContact NE-OE1 3.04Å; R188-E198 IonicContact NH2-OE1 3.75Å; R188-E198 PolarHBondContact NH2-OE1 3.33Å
189	V	94.9	Very high	90.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	113.8	177.5	-174.9	0	0	0	0	108.5	F170 E177 L179 I196 S197	F170-V189 HydrophobicContact CB-CG1 4.07Å; F170-V189 HydrophobicContact CD1-CG1 3.87Å; F170-V189 HydrophobicContact CD1-CG2 4.31Å; F170-V189 HydrophobicContact CD2-CG1 4.38Å; F170-V189 HydrophobicContact CD2-CG2 3.99Å; F170-V189 HydrophobicContact CE1-CG1 4.39Å; F170-V189 HydrophobicContact CE1-CG2 4.13Å; F170-V189 HydrophobicContact CE2-CG2 3.77Å; F170-V189 HydrophobicContact CG-CG1 3.86Å; F170-V189 HydrophobicContact CG-CG2 4.24Å; F170-V189 HydrophobicContact CZ-CG2 3.86Å; E177-V189 HydrophobicContact CB-CG1 3.9Å; E177-V189 HydrophobicContact CG-CG1 4.37Å; L179-V189 HydrophobicContact CD1-CB 4.41Å; L179-V189 HydrophobicContact CD1-CG1 3.93Å; L179-V189 HydrophobicContact CD1-CG2 4.05Å; L179-V189 HydrophobicContact CD2-CG2 4.39Å; L179-V189 HydrophobicContact CG-CG2 3.91Å; V189-I196 HydrophobicContact CB-CB 4.43Å; V189-I196 HydrophobicContact CG1-CB 4.33Å; V189-I196 HydrophobicContact CG1-CD1 4.25Å; V189-I196 PolarHBondContact O-N 3.19Å; V189-S197 PolarHBondContact N-O 3.5Å
190	F	92.6	Very high	90.4	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.035	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.7	176.5	-67.7	-85.1	0	0	0	111.1	L143 T156 E177 L178 V180 R188 Q194 L195	L143-F190 HydrophobicContact CD1-CD2 4.18Å; L143-F190 HydrophobicContact CD1-CE2 3.98Å; T156-F190 HydrophobicContact CG2-CD1 4.13Å; T156-F190 HydrophobicContact CG2-CE1 4.04Å; T156-F190 HydrophobicContact CG2-CZ 4.36Å; E177-F190 WeakPolarHBondContact CA-O 3.45Å; E177-F190 WeakPolarHBondContact CB-O 3.38Å; L178-F190 HydrophobicContact CB-CB 4.39Å; L178-F190 PolarHBondContact N-O 3.42Å; L178-F190 PolarHBondContact O-N 3.43Å; V180-F190 HydrophobicContact CB-CD2 4.32Å; V180-F190 HydrophobicContact CB-CE2 4.18Å; V180-F190 HydrophobicContact CG2-CD2 3.58Å; V180-F190 HydrophobicContact CG2-CE2 3.84Å; R188-F190 HydrophobicContact CB-CD2 4.22Å; R188-F190 HydrophobicContact CB-CE2 3.62Å; R188-F190 HydrophobicContact CB-CZ 4.22Å; F190-Q194 CarbonylContact C-O 3.56Å; F190-Q194 WeakPolarHBondContact CA-O 3.32Å; F190-L195 HydrophobicContact CD1-CB 4.27Å; F190-L195 HydrophobicContact CD1-CD1 4.26Å; F190-L195 HydrophobicContact CE1-CB 4.09Å; F190-L195 HydrophobicContact CE1-CD1 3.95Å; F190-L195 HydrophobicContact CE2-CD1 4.35Å; F190-L195 HydrophobicContact CZ-CD1 4.01Å
191	K	89.9	Confident	90.1	Very high	43 Å²	43	31.3 Å²	31.3	19%	0.187	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	103.2	164.4	177	172.4	-164.5	144.6	0	107.8	D173 E177 D193 Q194 I196	D173-K191 IonicContact OD1-NZ 2.83Å; D173-K191 IonicContact OD2-NZ 2.73Å; D173-K191 PolarHBondContact OD2-NZ 3.16Å; E177-K191 HydrophobicContact CG-CB 3.77Å; E177-K191 HydrophobicContact CG-CG 4.27Å; E177-K191 IonicContact OE1-NZ 3.62Å; E177-K191 PolarHBondContact OE1-NZ 3.3Å; K191-D193 PolarHBondContact O-N 2.86Å; K191-D193 VanDerWaalsContact O-N 3.16Å; K191-Q194 PolarHBondContact N-O 3.24Å; K191-Q194 PolarHBondContact O-N 2.82Å; K191-I196 HydrophobicContact CB-CD1 3.33Å; K191-I196 HydrophobicContact CB-CG1 4.03Å; K191-I196 HydrophobicContact CD-CD1 4.02Å; K191-I196 HydrophobicContact CG-CD1 4.34Å
192	E	86.6	Confident	89.6	Confident	55 Å²	55	33.2 Å²	33.2	26%	0.257	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	-121.6	-170.1	-58.8	171.3	-167	0	0	109.4	D129 F154 Q194	D129-E192 WeakPolarHBondContact CB-OE1 3.33Å; D129-E192 PolarHBondContact N-OE1 2.9Å; F154-E192 WeakPolarHBondContact CE2-O 3.35Å; E192-Q194 VanDerWaalsContact C-N 3.33Å; E192-Q194 PolarHBondContact O-N 3.37Å
193	D	78.2	Confident	89.5	Confident	84 Å²	84	36 Å²	36	45%	0.449	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.7	179.5	71.4	-26.3	0	0	0	114.2	K191 N681	K191-D193 PolarHBondContact O-N 2.86Å; K191-D193 VanDerWaalsContact O-N 3.16Å; D193-N681 PolarHBondContact O-ND2 3.48Å; D193-N681 PolarHBondContact O-OD1 2.86Å
194	Q	83.1	Confident	89.5	Confident	82 Å²	82	35.2 Å²	35.2	38%	0.383	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.4	-173.4	-170.6	179.2	8.6	0	0	113.9	F190 K191 E192 I196 N681	F190-Q194 CarbonylContact C-O 3.56Å; F190-Q194 WeakPolarHBondContact CA-O 3.32Å; K191-Q194 PolarHBondContact N-O 3.24Å; K191-Q194 PolarHBondContact O-N 2.82Å; E192-Q194 VanDerWaalsContact C-N 3.33Å; E192-Q194 PolarHBondContact O-N 3.37Å; Q194-I196 PolarHBondContact O-N 2.86Å; Q194-N681 VanDerWaalsContact CA-ND2 3.29Å; Q194-N681 WeakPolarHBondContact CA-ND2 3.45Å
195	L	86.1	Confident	89.9	Confident	35 Å²	35	34.2 Å²	34.2	18%	0.183	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	119	166.9	-177.5	70.5	0	0	0	110.2	R188 F190	R188-L195 HydrophobicContact CB-CD1 3.73Å; R188-L195 HydrophobicContact CG-CD1 4.08Å; F190-L195 HydrophobicContact CD1-CB 4.27Å; F190-L195 HydrophobicContact CD1-CD1 4.26Å; F190-L195 HydrophobicContact CE1-CB 4.09Å; F190-L195 HydrophobicContact CE1-CD1 3.95Å; F190-L195 HydrophobicContact CE2-CD1 4.35Å; F190-L195 HydrophobicContact CZ-CD1 4.01Å
196	I	87.5	Confident	90	Very high	67 Å²	67	32.8 Å²	32.8	34%	0.344	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-48.1	178	-66.1	161.9	0	0	0	111.5	T171 E177 V189 K191 Q194	T171-I196 HydrophobicContact CG2-CD1 3.83Å; T171-I196 HydrophobicContact CG2-CG2 4.49Å; E177-I196 HydrophobicContact CG-CD1 3.73Å; V189-I196 HydrophobicContact CB-CB 4.43Å; V189-I196 HydrophobicContact CG1-CB 4.33Å; V189-I196 HydrophobicContact CG1-CD1 4.25Å; V189-I196 PolarHBondContact O-N 3.19Å; K191-I196 HydrophobicContact CB-CD1 3.33Å; K191-I196 HydrophobicContact CB-CG1 4.03Å; K191-I196 HydrophobicContact CD-CD1 4.02Å; K191-I196 HydrophobicContact CG-CD1 4.34Å; Q194-I196 PolarHBondContact O-N 2.86Å
197	S	87.1	Confident	90.3	Very high	19 Å²	19	33 Å²	33	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	150.3	-171.6	-171.5	0	0	0	0	110.9	R188 V189	R188-S197 WeakPolarHBondContact CA-O 3.34Å; V189-S197 PolarHBondContact N-O 3.5Å
198	E	90.1	Very high	90.3	Very high	61 Å²	61	33.8 Å²	33.8	29%	0.285	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.3	175.7	-175.1	165.3	-152.8	0	0	107.9	D186 I187 R188 R673	D186-E198 HydrophobicContact CB-CG 4.23Å; I187-E198 WeakPolarHBondContact O-CA 3.27Å; R188-E198 HydrophobicContact CG-CG 4.08Å; R188-E198 IonicContact CZ-OE1 3.89Å; R188-E198 IonicContact NE-OE1 3.13Å; R188-E198 PolarHBondContact NE-OE1 3.04Å; R188-E198 IonicContact NH2-OE1 3.75Å; R188-E198 PolarHBondContact NH2-OE1 3.33Å; E198-R673 IonicContact OE1-NH1 3.42Å
199	L	91.3	Very high	90.4	Very high	14 Å²	14	34 Å²	34	7%	0.073	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.5	-180	-51.3	170.5	0	0	0	108.3	D186 I187 F216 Y228 T231	D186-L199 CarbonylContact C-O 3.39Å; D186-L199 WeakPolarHBondContact CA-O 3.48Å; I187-L199 HydrophobicContact CB-CB 4.21Å; I187-L199 PolarHBondContact N-O 3.11Å; I187-L199 PolarHBondContact O-N 3.4Å; L199-F216 HydrophobicContact CD1-CE1 4.49Å; L199-F216 HydrophobicContact CD1-CZ 3.74Å; L199-Y228 HydrophobicContact CD1-CD1 4.25Å; L199-Y228 HydrophobicContact CD1-CE1 4.3Å; L199-Y228 HydrophobicContact CD1-CG 4.4Å; L199-T231 HydrophobicContact CD2-CG2 4.02Å
200	N	88.8	Confident	90.5	Very high	67 Å²	67	37.5 Å²	37.5	36%	0.358	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	124.3	-177.2	-59.6	11.4	0	0	0	109.6	D186 M445	D186-N200 WeakPolarHBondContact OD1-CA 3.21Å; D186-N200 VanDerWaalsContact OD1-CG 3.27Å; D186-N200 PolarHBondContact OD1-OD1 3.23Å; D186-N200 VanDerWaalsContact OD1-OD1 3.13Å; N200-M445 HydrophobicContact CB-SD 3.99Å; N200-M445 PolarHBondContact ND2-SD 3.31Å
201	E	90.9	Very high	90.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.192	C	C	.	.			trans	-106.1	179.7	169.3	-66.7	-65	144.5	0	0	110.5	F185 I187 Y218 L220 Y228 R233	F185-E201 WeakPolarHBondContact CB-O 3.1Å; F185-E201 WeakPolarHBondContact O-CA 3.24Å; F185-E201 VanDerWaalsContact O-CB 3.25Å; F185-E201 WeakPolarHBondContact O-CB 3.42Å; F185-E201 PolarHBondContact O-N 3.16Å; I187-E201 HydrophobicContact CD1-CG 4.04Å; I187-E201 HydrophobicContact CG1-CG 4.4Å; E201-Y218 VanDerWaalsContact CD-CE2 3.41Å; E201-Y218 HydrophobicContact CG-CD2 4.39Å; E201-Y218 HydrophobicContact CG-CE2 4.09Å; E201-Y218 VanDerWaalsContact OE2-CE2 3.22Å; E201-Y218 WeakPolarHBondContact OE2-CE2 3.49Å; E201-Y218 PolarHBondContact OE2-OH 3.42Å; E201-L220 HydrophobicContact CB-CD1 3.98Å; E201-L220 HydrophobicContact CB-CD2 3.98Å; E201-L220 HydrophobicContact CG-CD1 4.44Å; E201-L220 HydrophobicContact CG-CD2 4.09Å; E201-Y228 WeakPolarHBondContact OE1-CE2 3.33Å; E201-Y228 PolarHBondContact OE1-OH 2.84Å; E201-R233 IonicContact OE1-CZ 2.83Å; E201-R233 IonicContact OE1-NE 3.68Å; E201-R233 IonicContact OE1-NH2 3.92Å; E201-R233 PolarHBondContact OE1-NH2 2.83Å; E201-R233 IonicContact OE2-CZ 2.72Å; E201-R233 IonicContact OE2-NH2 3.19Å; E201-R233 PolarHBondContact OE2-NH2 3.13Å
202	N	85.9	Confident	90.7	Very high	40 Å²	40	38.8 Å²	38.8	21%	0.214	20%	0.198	C	C	.	.	S	Bend	trans	-103.4	-0.9	-172.8	-54.7	-43.1	0	0	0	113.7	E414	N202-E414 HydrophobicContact CB-CB 4.07Å; N202-E414 VanDerWaalsContact CG-CB 3.41Å; N202-E414 WeakPolarHBondContact ND2-CB 3.35Å; N202-E414 PolarHBondContact ND2-OE1 3.15Å; N202-E414 PolarHBondContact ND2-OE2 3.01Å
203	E	91	Very high	91	Very high	59 Å²	59	38.7 Å²	38.7	28%	0.276	21%	0.212	S	C	.	.	S	Bend	trans	-160.7	164	-176.3	-171.3	61.1	-93.6	0	0	109.7	F185 V205 L220 A221 N222	F185-E203 VanDerWaalsContact CD1-CA 3.42Å; F185-E203 WeakPolarHBondContact CE1-OE1 3.43Å; E203-V205 PolarHBondContact O-N 2.93Å; E203-L220 HydrophobicContact CB-CB 4.16Å; E203-L220 HydrophobicContact CB-CD1 4.26Å; E203-A221 HydrophobicContact CG-CB 3.83Å; E203-N222 HydrophobicContact CB-CB 4.19Å; E203-N222 WeakPolarHBondContact CB-ND2 3.34Å; E203-N222 HydrophobicContact CG-CB 3.87Å
204	T	93.3	Very high	91.6	Very high	23 Å²	23	35.9 Å²	35.9	14%	0.141	20%	0.198	C	C	.	.			trans	-49.4	130.1	178.9	-63.1	0	0	0	0	112.1	R163 E183 T206 L220 A221	R163-T204 HydrophobicContact CB-CG2 4.29Å; R163-T204 HydrophobicContact CG-CG2 3.77Å; E183-T204 HydrophobicContact CG-CG2 4Å; T204-T206 HydrophobicContact CG2-CG2 4.23Å; T204-T206 WeakPolarHBondContact O-CG2 3.31Å; T204-T206 PolarHBondContact O-N 2.92Å; T204-L220 VanDerWaalsContact O-CA 3.32Å; T204-L220 WeakPolarHBondContact O-CA 3.42Å; T204-A221 PolarHBondContact O-N 3.21Å
205	V	96.2	Very high	92.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	102.2	-179.8	-174.6	0	0	0	0	109.6	R163 S164 S182 I187 E203 L208 L220	R163-V205 VanDerWaalsContact CB-O 3.23Å; R163-V205 WeakPolarHBondContact CB-O 3.45Å; S164-V205 PolarHBondContact OG-O 2.78Å; S164-V205 VanDerWaalsContact OG-O 3.07Å; S182-V205 PolarHBondContact O-N 2.92Å; I187-V205 HydrophobicContact CD1-CG1 4.25Å; I187-V205 HydrophobicContact CD1-CG2 4.28Å; I187-V205 HydrophobicContact CG1-CB 4.38Å; I187-V205 HydrophobicContact CG1-CG1 4.01Å; I187-V205 HydrophobicContact CG1-CG2 3.61Å; E203-V205 PolarHBondContact O-N 2.93Å; V205-L208 HydrophobicContact CG1-CD1 4.38Å; V205-L208 HydrophobicContact CG1-CD2 3.92Å; V205-L208 HydrophobicContact CG1-CG 3.99Å; V205-L220 HydrophobicContact CB-CD2 4.31Å; V205-L220 HydrophobicContact CG2-CD2 3.88Å
206	T	95.6	Very high	92.8	Very high	15 Å²	15	31.9 Å²	31.9	9%	0.092	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-26.7	-168	72.5	0	0	0	0	113.3	R16 T204 A219 A221	R16-T206 VanDerWaalsContact NH1-CB 3.27Å; R16-T206 PolarHBondContact NH1-O 3.48Å; R16-T206 PolarHBondContact NH2-OG1 3Å; T204-T206 HydrophobicContact CG2-CG2 4.23Å; T204-T206 WeakPolarHBondContact O-CG2 3.31Å; T204-T206 PolarHBondContact O-N 2.92Å; T206-A219 PolarHBondContact N-O 2.74Å; T206-A219 PolarHBondContact OG1-O 2.97Å; T206-A221 HydrophobicContact CG2-CB 3.6Å
207	S	96.3	Very high	93.2	Very high	15 Å²	15	28.7 Å²	28.7	11%	0.105	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	145.2	175.9	-55.9	0	0	0	0	110.6	R16 Y218 A219	R16-S207 PolarHBondContact NH2-OG 3.38Å; S207-Y218 WeakPolarHBondContact O-CA 3.48Å; S207-A219 PolarHBondContact N-O 2.75Å; S207-A219 PolarHBondContact O-N 2.94Å
208	L	97.6	Very high	93.8	Very high	18 Å²	18	27.8 Å²	27.8	9%	0.094	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.9	174.8	-67.9	168.2	0	0	0	107.6	V166 L179 I187 V205 F216 G217	V166-L208 HydrophobicContact CB-CB 4.14Å; V166-L208 HydrophobicContact CG1-CB 3.71Å; V166-L208 HydrophobicContact CG1-CD1 4.41Å; L179-L208 HydrophobicContact CB-CD1 4.25Å; I187-L208 HydrophobicContact CD1-CD2 4.11Å; I187-L208 HydrophobicContact CG2-CD1 4.34Å; I187-L208 HydrophobicContact CG2-CD2 4.36Å; V205-L208 HydrophobicContact CG1-CD1 4.38Å; V205-L208 HydrophobicContact CG1-CD2 3.92Å; V205-L208 HydrophobicContact CG1-CG 3.99Å; L208-F216 HydrophobicContact CD2-CD2 4.05Å; L208-F216 HydrophobicContact CD2-CE2 4.12Å; L208-G217 WeakPolarHBondContact CA-O 3.1Å
209	C	96.5	Very high	94.1	Very high	9 Å²	9	24.9 Å²	24.9	6%	0.061	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.8	172.2	66	0	0	0	0	110.8	F216 G217 I246 L259	C209-F216 CarbonylContact O-C 3.51Å; C209-F216 WeakPolarHBondContact O-CA 3.4Å; C209-F216 VanDerWaalsContact O-CB 3.29Å; C209-F216 WeakPolarHBondContact O-CB 3.44Å; C209-G217 PolarHBondContact N-O 3.15Å; C209-G217 PolarHBondContact O-N 3.42Å; C209-I246 HydrophobicContact CB-CD1 4.43Å; C209-I246 HydrophobicContact CB-CG1 4.18Å; C209-L259 WeakPolarHBondContact SG-CD1 3.48Å
210	H	96.6	Very high	94.3	Very high	72 Å²	72	24.3 Å²	24.3	33%	0.333	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	136.1	171.7	176.6	-129.5	0	0	0	108.9	V166 F168 G213 A248	V166-H210 HydrophobicContact CG2-CB 3.99Å; F168-H210 HydrophobicContact CB-CB 4Å; F168-H210 WeakPolarHBondContact CB-CD2 2.95Å; F168-H210 VanDerWaalsContact CB-CG 3.47Å; F168-H210 HydrophobicContact CD1-CB 3.88Å; F168-H210 AromaticContact CD1-CD2 3.8Å; F168-H210 AromaticContact CD2-CD2 3.52Å; F168-H210 AromaticContact CD2-NE2 3.91Å; F168-H210 HydrophobicContact CG-CB 4.11Å; F168-H210 AromaticContact CG-CD2 3.25Å; F168-H210 WeakPolarHBondContact CG-CD2 3.38Å; F168-H210 AromaticContact CG-CG 3.78Å; F168-H210 AromaticContact CG-NE2 3.86Å; H210-G213 PolarHBondContact NE2-O 2.98Å; H210-A248 WeakPolarHBondContact O-CB 3.43Å
211	M	94.6	Very high	94.5	Very high	11 Å²	11	22.9 Å²	22.9	5%	0.054	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	-71.2	176	-62.8	-171.6	73.9	0	0	110.6	R215 V227 A248 V257 L259 D273	M211-R215 HydrophobicContact CB-CB 4.36Å; M211-R215 PolarHBondContact N-O 3.39Å; M211-V227 HydrophobicContact SD-CG1 3.94Å; M211-V227 HydrophobicContact SD-CG2 3.73Å; M211-A248 HydrophobicContact CB-CB 4.18Å; M211-A248 HydrophobicContact CG-CB 3.9Å; M211-V257 HydrophobicContact CB-CG2 3.79Å; M211-V257 HydrophobicContact CE-CG2 4.22Å; M211-V257 WeakPolarHBondContact CE-O 3.44Å; M211-V257 WeakPolarHBondContact O-CG2 3.47Å; M211-L259 HydrophobicContact CE-CB 3.93Å; M211-L259 HydrophobicContact SD-CB 4.38Å; M211-D273 HydrophobicContact CE-CB 3.6Å; M211-D273 HydrophobicContact SD-CB 4.36Å
212	H	92.3	Very high	94.5	Very high	68 Å²	68	24.8 Å²	24.8	32%	0.315	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	148	176.5	59.7	-88.5	0	0	0	109.4	S214 R215 D273	H212-S214 PolarHBondContact O-N 2.9Å; H212-R215 WeakPolarHBondContact O-CB 3.45Å; H212-R215 PolarHBondContact O-N 3.06Å; H212-D273 IonicContact CE1-OD2 3.67Å; H212-D273 PolarHBondContact CE1-OD2 2.83Å; H212-D273 IonicContact NE2-OD2 2.75Å
213	G	91.3	Very high	94.8	Very high	53 Å²	53	22.9 Å²	22.9	55%	0.546	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	-128.1	-175.4	0	0	0	0	0	111.2	H210	H210-G213 PolarHBondContact NE2-O 2.98Å
214	S	92.6	Very high	95	Very high	24 Å²	24	20.5 Å²	20.5	17%	0.168	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	7.8	177.4	54.5	0	0	0	0	115.1	H212 D229 R230	H212-S214 PolarHBondContact O-N 2.9Å; S214-D229 PolarHBondContact OG-OD1 2.74Å; S214-R230 PolarHBondContact O-N 2.83Å
215	R	95.3	Very high	95.2	Very high	34 Å²	34	19.4 Å²	19.4	13%	0.128	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	137.9	-179.1	-64.5	-165.5	-175	175.2	15	112.3	M211 H212 Y228 D229 Y234 D273	M211-R215 HydrophobicContact CB-CB 4.36Å; M211-R215 PolarHBondContact N-O 3.39Å; H212-R215 WeakPolarHBondContact O-CB 3.45Å; H212-R215 PolarHBondContact O-N 3.06Å; R215-Y228 VanDerWaalsContact CA-O 3.25Å; R215-Y228 WeakPolarHBondContact CA-O 3.42Å; R215-D229 HydrophobicContact CG-CB 3.85Å; R215-D229 IonicContact NE-OD2 3.18Å; R215-Y234 VanDerWaalsContact CZ-CE1 3.5Å; R215-Y234 PolarHBondContact NH2-OH 3.49Å; R215-Y234 VanDerWaalsContact NH2-OH 3.13Å; R215-D273 IonicContact CZ-OD2 3.86Å; R215-D273 IonicContact NH1-OD2 2.85Å; R215-D273 PolarHBondContact NH1-OD2 2.94Å
216	F	97.4	Very high	95.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	145.3	178.1	66.8	-82.4	0	0	0	111.7	F168 F170 L179 I187 L199 L208 C209 V227 Y228	F168-F216 HydrophobicContact CE1-CB 3.76Å; F168-F216 HydrophobicContact CE1-CD1 4.34Å; F168-F216 HydrophobicContact CE1-CG 4.15Å; F168-F216 HydrophobicContact CE2-CD1 4.29Å; F168-F216 HydrophobicContact CZ-CB 3.65Å; F168-F216 AromaticContact CZ-CD1 3.51Å; F168-F216 HydrophobicContact CZ-CD1 3.51Å; F168-F216 HydrophobicContact CZ-CE1 4.36Å; F168-F216 AromaticContact CZ-CG 3.76Å; F168-F216 HydrophobicContact CZ-CG 3.76Å; F170-F216 HydrophobicContact CD2-CE1 4.37Å; F170-F216 AromaticContact CE2-CE1 3.97Å; F170-F216 HydrophobicContact CE2-CE1 3.97Å; L179-F216 HydrophobicContact CD2-CD1 3.9Å; L179-F216 HydrophobicContact CD2-CD2 3.91Å; L179-F216 HydrophobicContact CD2-CE1 3.79Å; L179-F216 HydrophobicContact CD2-CE2 3.81Å; L179-F216 HydrophobicContact CD2-CG 3.94Å; L179-F216 HydrophobicContact CD2-CZ 3.74Å; I187-F216 HydrophobicContact CD1-CE2 4.24Å; I187-F216 HydrophobicContact CG2-CE2 4.41Å; L199-F216 HydrophobicContact CD1-CE1 4.49Å; L199-F216 HydrophobicContact CD1-CZ 3.74Å; L208-F216 HydrophobicContact CD2-CD2 4.05Å; L208-F216 HydrophobicContact CD2-CE2 4.12Å; C209-F216 CarbonylContact O-C 3.51Å; C209-F216 WeakPolarHBondContact O-CA 3.4Å; C209-F216 VanDerWaalsContact O-CB 3.29Å; C209-F216 WeakPolarHBondContact O-CB 3.44Å; F216-V227 WeakPolarHBondContact O-CA 3.5Å; F216-Y228 HydrophobicContact CE1-CG 4.15Å; F216-Y228 AromaticContact CE2-CD2 3.92Å; F216-Y228 HydrophobicContact CE2-CD2 3.92Å; F216-Y228 HydrophobicContact CE2-CG 4.22Å; F216-Y228 AromaticContact CZ-CD2 3.82Å; F216-Y228 HydrophobicContact CZ-CD2 3.82Å; F216-Y228 AromaticContact CZ-CG 3.7Å; F216-Y228 HydrophobicContact CZ-CG 3.7Å; F216-Y228 PolarHBondContact N-O 2.89Å; F216-Y228 PolarHBondContact O-N 3.37Å
217	G	97.6	Very high	95.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	146.5	170.8	0	0	0	0	0	110.7	L208 C209 G226	L208-G217 WeakPolarHBondContact CA-O 3.1Å; C209-G217 PolarHBondContact N-O 3.15Å; C209-G217 PolarHBondContact O-N 3.42Å; G217-G226 WeakPolarHBondContact CA-O 3.3Å
218	Y	97.9	Very high	95.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.2	174.7	77.3	-80.6	0	0	0	111.3	I187 E201 S207 L220 V225 G226 Y228 R233	I187-Y218 HydrophobicContact CD1-CD2 4.45Å; I187-Y218 HydrophobicContact CD1-CG 4.36Å; E201-Y218 VanDerWaalsContact CD-CE2 3.41Å; E201-Y218 HydrophobicContact CG-CD2 4.39Å; E201-Y218 HydrophobicContact CG-CE2 4.09Å; E201-Y218 VanDerWaalsContact OE2-CE2 3.22Å; E201-Y218 WeakPolarHBondContact OE2-CE2 3.49Å; E201-Y218 PolarHBondContact OE2-OH 3.42Å; S207-Y218 WeakPolarHBondContact O-CA 3.48Å; Y218-L220 HydrophobicContact CD2-CD2 3.79Å; Y218-L220 HydrophobicContact CD2-CG 4.05Å; Y218-L220 HydrophobicContact CE2-CD1 4.16Å; Y218-L220 HydrophobicContact CE2-CD2 4.03Å; Y218-L220 HydrophobicContact CE2-CG 3.92Å; Y218-V225 WeakPolarHBondContact O-CA 3.46Å; Y218-G226 VanDerWaalsContact CD1-C 3.42Å; Y218-G226 VanDerWaalsContact CD1-O 3.24Å; Y218-G226 WeakPolarHBondContact CD1-O 3.48Å; Y218-G226 VanDerWaalsContact CE1-C 3.42Å; Y218-G226 VanDerWaalsContact CE1-CA 3.44Å; Y218-G226 PolarHBondContact N-O 3.06Å; Y218-G226 PolarHBondContact O-N 2.81Å; Y218-Y228 AromaticContact CD1-CD2 3.5Å; Y218-Y228 HydrophobicContact CD1-CD2 3.5Å; Y218-Y228 VanDerWaalsContact CD1-CD2 3.5Å; Y218-Y228 AromaticContact CD1-CE2 3.74Å; Y218-Y228 HydrophobicContact CD1-CE2 3.74Å; Y218-Y228 AromaticContact CE1-CD2 3.55Å; Y218-Y228 HydrophobicContact CE1-CD2 3.55Å; Y218-Y228 AromaticContact CE1-CE2 3.43Å; Y218-Y228 HydrophobicContact CE1-CE2 3.43Å; Y218-Y228 VanDerWaalsContact CE1-CE2 3.43Å; Y218-Y228 HydrophobicContact CG-CD2 4.32Å; Y218-Y228 HydrophobicContact CG-CE2 4.38Å; Y218-Y228 AromaticContact CZ-CE2 3.85Å; Y218-R233 WeakPolarHBondContact OH-CD 3.23Å; Y218-R233 PolarHBondContact OH-NE 2.86Å
219	A	97.3	Very high	95.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.5	177.5	0	0	0	0	0	111.8	T206 S207 T224 V225 A243 I246	T206-A219 PolarHBondContact N-O 2.74Å; T206-A219 PolarHBondContact OG1-O 2.97Å; S207-A219 PolarHBondContact N-O 2.75Å; S207-A219 PolarHBondContact O-N 2.94Å; A219-T224 CarbonylContact C-O 3.51Å; A219-T224 WeakPolarHBondContact CA-O 3.32Å; A219-V225 HydrophobicContact CB-CG2 4.2Å; A219-A243 HydrophobicContact CB-CB 3.84Å; A219-I246 HydrophobicContact CB-CD1 4.05Å; A219-I246 HydrophobicContact CB-CG2 4Å
220	L	95.9	Very high	94.9	Very high	1 Å²	1	25 Å²	25	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	158.2	-177.9	-52.2	-173.9	0	0	0	112.5	E201 E203 T204 V205 Y218 N222 G223 T224	E201-L220 HydrophobicContact CB-CD1 3.98Å; E201-L220 HydrophobicContact CB-CD2 3.98Å; E201-L220 HydrophobicContact CG-CD1 4.44Å; E201-L220 HydrophobicContact CG-CD2 4.09Å; E203-L220 HydrophobicContact CB-CB 4.16Å; E203-L220 HydrophobicContact CB-CD1 4.26Å; T204-L220 VanDerWaalsContact O-CA 3.32Å; T204-L220 WeakPolarHBondContact O-CA 3.42Å; V205-L220 HydrophobicContact CB-CD2 4.31Å; V205-L220 HydrophobicContact CG2-CD2 3.88Å; Y218-L220 HydrophobicContact CD2-CD2 3.79Å; Y218-L220 HydrophobicContact CD2-CG 4.05Å; Y218-L220 HydrophobicContact CE2-CD1 4.16Å; Y218-L220 HydrophobicContact CE2-CD2 4.03Å; Y218-L220 HydrophobicContact CE2-CG 3.92Å; L220-N222 WeakPolarHBondContact CB-OD1 3.48Å; L220-N222 PolarHBondContact O-N 2.84Å; L220-G223 PolarHBondContact O-N 3.28Å; L220-G223 VanDerWaalsContact O-N 3.12Å; L220-T224 HydrophobicContact CD1-CG2 4.26Å; L220-T224 PolarHBondContact N-O 3.08Å
221	A	93.1	Very high	94.7	Very high	37 Å²	37	25.8 Å²	25.8	31%	0.306	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.5	-179.4	0	0	0	0	0	112.7	E203 T204 T206 G223 H242	E203-A221 HydrophobicContact CG-CB 3.83Å; T204-A221 PolarHBondContact O-N 3.21Å; T206-A221 HydrophobicContact CG2-CB 3.6Å; A221-G223 PolarHBondContact O-N 2.69Å; A221-H242 PolarHBondContact O-CE1 2.73Å; A221-H242 PolarHBondContact O-ND1 3.49Å
222	N	90.5	Very high	94.6	Very high	41 Å²	41	27.7 Å²	27.7	22%	0.219	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	6.5	177.9	65.9	14.3	0	0	0	114.3	E203 L220 T224	E203-N222 HydrophobicContact CB-CB 4.19Å; E203-N222 WeakPolarHBondContact CB-ND2 3.34Å; E203-N222 HydrophobicContact CG-CB 3.87Å; L220-N222 WeakPolarHBondContact CB-OD1 3.48Å; L220-N222 PolarHBondContact O-N 2.84Å; N222-T224 WeakPolarHBondContact OD1-CB 3.34Å; N222-T224 PolarHBondContact OD1-N 3.03Å; N222-T224 PolarHBondContact OD1-OG1 2.75Å
223	G	92.3	Very high	94.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	83.7	13.3	-178.6	0	0	0	0	0	114.4	L220 A221 S239 N241	L220-G223 PolarHBondContact O-N 3.28Å; L220-G223 VanDerWaalsContact O-N 3.12Å; A221-G223 PolarHBondContact O-N 2.69Å; G223-S239 PolarHBondContact O-N 3.39Å; G223-N241 WeakPolarHBondContact CA-O 3.42Å
224	T	94.8	Very high	94.8	Very high	9 Å²	9	30.4 Å²	30.4	6%	0.055	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.6	170.3	-55.5	0	0	0	0	110.5	A219 L220 N222 R236 I237	A219-T224 CarbonylContact C-O 3.51Å; A219-T224 WeakPolarHBondContact CA-O 3.32Å; L220-T224 HydrophobicContact CD1-CG2 4.26Å; L220-T224 PolarHBondContact N-O 3.08Å; N222-T224 WeakPolarHBondContact OD1-CB 3.34Å; N222-T224 PolarHBondContact OD1-N 3.03Å; N222-T224 PolarHBondContact OD1-OG1 2.75Å; T224-R236 HydrophobicContact CG2-CB 4.2Å; T224-I237 CarbonylContact C-O 3.51Å; T224-I237 WeakPolarHBondContact CA-O 3.26Å; T224-I237 WeakPolarHBondContact CG2-O 3.44Å
225	V	97.3	Very high	94.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.2	172.5	178.9	0	0	0	0	108.2	Y218 A219 R236 I237 A243 I246 L259 T261 W263	Y218-V225 WeakPolarHBondContact O-CA 3.46Å; A219-V225 HydrophobicContact CB-CG2 4.2Å; V225-R236 CarbonylContact O-C 3.56Å; V225-R236 VanDerWaalsContact O-CA 3.31Å; V225-R236 WeakPolarHBondContact O-CA 3.26Å; V225-I237 HydrophobicContact CB-CG1 4.39Å; V225-I237 PolarHBondContact N-O 2.72Å; V225-I237 PolarHBondContact O-N 2.75Å; V225-A243 HydrophobicContact CG2-CB 3.55Å; V225-I246 HydrophobicContact CG1-CG2 4.49Å; V225-L259 HydrophobicContact CG1-CD2 3.55Å; V225-T261 HydrophobicContact CG2-CG2 4.12Å; V225-W263 HydrophobicContact CB-CH2 4.49Å; V225-W263 HydrophobicContact CG2-CH2 3.76Å; V225-W263 HydrophobicContact CG2-CZ2 4.29Å; V225-W263 HydrophobicContact CG2-CZ3 4.32Å
226	G	96.8	Very high	94.9	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	-179.8	178.6	0	0	0	0	0	113.2	G217 Y218 W235	G217-G226 WeakPolarHBondContact CA-O 3.3Å; Y218-G226 VanDerWaalsContact CD1-C 3.42Å; Y218-G226 VanDerWaalsContact CD1-O 3.24Å; Y218-G226 WeakPolarHBondContact CD1-O 3.48Å; Y218-G226 VanDerWaalsContact CE1-C 3.42Å; Y218-G226 VanDerWaalsContact CE1-CA 3.44Å; Y218-G226 PolarHBondContact N-O 3.06Å; Y218-G226 PolarHBondContact O-N 2.81Å; G226-W235 WeakPolarHBondContact CA-O 3.29Å
227	V	97.4	Very high	94.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.6	178.9	175.4	0	0	0	0	109.5	M211 F216 Y234 W235 L259	M211-V227 HydrophobicContact SD-CG1 3.94Å; M211-V227 HydrophobicContact SD-CG2 3.73Å; F216-V227 WeakPolarHBondContact O-CA 3.5Å; V227-Y234 PolarHBondContact O-N 2.81Å; V227-W235 HydrophobicContact CB-CZ2 4.35Å; V227-W235 HydrophobicContact CG2-CH2 4.29Å; V227-W235 HydrophobicContact CG2-CZ2 3.44Å; V227-W235 VanDerWaalsContact CG2-CZ2 3.44Å; V227-W235 PolarHBondContact N-O 2.96Å; V227-L259 HydrophobicContact CG2-CD2 3.89Å
228	Y	96.9	Very high	94.4	Very high	12 Å²	12	40.3 Å²	40.3	5%	0.047	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	151.8	169.7	-87	-79.8	0	0	0	110.9	L199 E201 R215 F216 Y218 A232 R233	L199-Y228 HydrophobicContact CD1-CD1 4.25Å; L199-Y228 HydrophobicContact CD1-CE1 4.3Å; L199-Y228 HydrophobicContact CD1-CG 4.4Å; E201-Y228 WeakPolarHBondContact OE1-CE2 3.33Å; E201-Y228 PolarHBondContact OE1-OH 2.84Å; R215-Y228 VanDerWaalsContact CA-O 3.25Å; R215-Y228 WeakPolarHBondContact CA-O 3.42Å; F216-Y228 HydrophobicContact CE1-CG 4.15Å; F216-Y228 AromaticContact CE2-CD2 3.92Å; F216-Y228 HydrophobicContact CE2-CD2 3.92Å; F216-Y228 HydrophobicContact CE2-CG 4.22Å; F216-Y228 AromaticContact CZ-CD2 3.82Å; F216-Y228 HydrophobicContact CZ-CD2 3.82Å; F216-Y228 AromaticContact CZ-CG 3.7Å; F216-Y228 HydrophobicContact CZ-CG 3.7Å; F216-Y228 PolarHBondContact N-O 2.89Å; F216-Y228 PolarHBondContact O-N 3.37Å; Y218-Y228 AromaticContact CD1-CD2 3.5Å; Y218-Y228 HydrophobicContact CD1-CD2 3.5Å; Y218-Y228 VanDerWaalsContact CD1-CD2 3.5Å; Y218-Y228 AromaticContact CD1-CE2 3.74Å; Y218-Y228 HydrophobicContact CD1-CE2 3.74Å; Y218-Y228 AromaticContact CE1-CD2 3.55Å; Y218-Y228 HydrophobicContact CE1-CD2 3.55Å; Y218-Y228 AromaticContact CE1-CE2 3.43Å; Y218-Y228 HydrophobicContact CE1-CE2 3.43Å; Y218-Y228 VanDerWaalsContact CE1-CE2 3.43Å; Y218-Y228 HydrophobicContact CG-CD2 4.32Å; Y218-Y228 HydrophobicContact CG-CE2 4.38Å; Y218-Y228 AromaticContact CZ-CE2 3.85Å; Y228-A232 WeakPolarHBondContact CA-O 3.21Å; Y228-A232 VanDerWaalsContact CD1-C 3.44Å; Y228-A232 WeakPolarHBondContact CD1-O 3.47Å; Y228-R233 HydrophobicContact CD1-CB 4.01Å; Y228-R233 HydrophobicContact CE1-CB 3.53Å; Y228-R233 HydrophobicContact CE1-CG 4.19Å; Y228-R233 HydrophobicContact CE2-CG 4.4Å; Y228-R233 PolarHBondContact OH-NE 3.18Å; Y228-R233 PolarHBondContact OH-NH2 2.99Å
229	D	94.3	Very high	94.1	Very high	24 Å²	24	42 Å²	42	13%	0.128	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	109.6	160.3	-174.8	3.5	0	0	0	107.5	S214 R215 T231 A232 Y234	S214-D229 PolarHBondContact OG-OD1 2.74Å; R215-D229 HydrophobicContact CG-CB 3.85Å; R215-D229 IonicContact NE-OD2 3.18Å; D229-T231 PolarHBondContact O-N 3.05Å; D229-A232 PolarHBondContact N-O 2.79Å; D229-A232 PolarHBondContact O-N 2.91Å; D229-Y234 HydrophobicContact CB-CD2 3.8Å; D229-Y234 HydrophobicContact CB-CE2 3.23Å; D229-Y234 PolarHBondContact OD2-OH 2.98Å
230	R	91.6	Very high	93.8	Very high	138 Å²	138	51.8 Å²	51.8	52%	0.521	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	-112.3	-167.1	-64.8	179.8	-88.5	-165	-7.1	110.9	F170 S214	F170-R230 HydrophobicContact CE1-CB 4.38Å; F170-R230 VanDerWaalsContact CE2-CA 3.48Å; F170-R230 HydrophobicContact CE2-CB 4.37Å; F170-R230 WeakPolarHBondContact CE2-O 3.36Å; F170-R230 VanDerWaalsContact CZ-CA 3.49Å; F170-R230 HydrophobicContact CZ-CB 3.98Å; F170-R230 HydrophobicContact CZ-CG 4.46Å; S214-R230 PolarHBondContact O-N 2.83Å
231	T	91.8	Very high	93.7	Very high	89 Å²	89	54.1 Å²	54.1	55%	0.546	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-6.9	-178.7	60.7	0	0	0	0	113.6	F170 L199 D229	F170-T231 HydrophobicContact CZ-CG2 4.34Å; L199-T231 HydrophobicContact CD2-CG2 4.02Å; D229-T231 PolarHBondContact O-N 3.05Å
232	A	92.4	Very high	93.7	Very high	51 Å²	51	56.8 Å²	56.8	42%	0.421	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.1	-176.6	0	0	0	0	0	111.1	Y228 D229	Y228-A232 WeakPolarHBondContact CA-O 3.21Å; Y228-A232 VanDerWaalsContact CD1-C 3.44Å; Y228-A232 WeakPolarHBondContact CD1-O 3.47Å; D229-A232 PolarHBondContact N-O 2.79Å; D229-A232 PolarHBondContact O-N 2.91Å
233	R	94.1	Very high	93.9	Very high	82 Å²	82	54.9 Å²	54.9	31%	0.309	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.9	173.8	-165.8	-175.6	-67.2	156.4	-9.3	109.7	E201 Y218 Y228 R236	E201-R233 IonicContact OE1-CZ 2.83Å; E201-R233 IonicContact OE1-NE 3.68Å; E201-R233 IonicContact OE1-NH2 3.92Å; E201-R233 PolarHBondContact OE1-NH2 2.83Å; E201-R233 IonicContact OE2-CZ 2.72Å; E201-R233 IonicContact OE2-NH2 3.19Å; E201-R233 PolarHBondContact OE2-NH2 3.13Å; Y218-R233 WeakPolarHBondContact OH-CD 3.23Å; Y218-R233 PolarHBondContact OH-NE 2.86Å; Y228-R233 HydrophobicContact CD1-CB 4.01Å; Y228-R233 HydrophobicContact CE1-CB 3.53Å; Y228-R233 HydrophobicContact CE1-CG 4.19Å; Y228-R233 HydrophobicContact CE2-CG 4.4Å; Y228-R233 PolarHBondContact OH-NE 3.18Å; Y228-R233 PolarHBondContact OH-NH2 2.99Å; R233-R236 VanDerWaalsContact NH1-CZ 3.33Å
234	Y	93.6	Very high	94.1	Very high	97 Å²	97	56.4 Å²	56.4	38%	0.38	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-50.6	179	-90.5	-130.7	0	0	0	111.3	R215 V227 D229	R215-Y234 VanDerWaalsContact CZ-CE1 3.5Å; R215-Y234 PolarHBondContact NH2-OH 3.49Å; R215-Y234 VanDerWaalsContact NH2-OH 3.13Å; V227-Y234 PolarHBondContact O-N 2.81Å; D229-Y234 HydrophobicContact CB-CD2 3.8Å; D229-Y234 HydrophobicContact CB-CE2 3.23Å; D229-Y234 PolarHBondContact OD2-OH 2.98Å
235	W	95.6	Very high	94.2	Very high	22 Å²	22	56.7 Å²	56.7	8%	0.083	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	159.4	176.3	61.3	-92.8	0	0	0	110	G226 V227 I237 L259 R271 S272 D273	G226-W235 WeakPolarHBondContact CA-O 3.29Å; V227-W235 HydrophobicContact CB-CZ2 4.35Å; V227-W235 HydrophobicContact CG2-CH2 4.29Å; V227-W235 HydrophobicContact CG2-CZ2 3.44Å; V227-W235 VanDerWaalsContact CG2-CZ2 3.44Å; V227-W235 PolarHBondContact N-O 2.96Å; W235-I237 HydrophobicContact CE3-CG2 4.27Å; W235-I237 HydrophobicContact CZ3-CG1 4.03Å; W235-I237 HydrophobicContact CZ3-CG2 4.33Å; W235-L259 HydrophobicContact CH2-CD2 3.91Å; W235-L259 HydrophobicContact CZ2-CD2 4.16Å; W235-R271 HydrophobicContact CH2-CB 4.04Å; W235-R271 HydrophobicContact CZ2-CB 4.13Å; W235-S272 WeakPolarHBondContact CZ2-O 3.26Å; W235-S272 PolarHBondContact NE1-O 3.34Å; W235-S272 VanDerWaalsContact NE1-O 3.12Å; W235-D273 VanDerWaalsContact CD1-O 3.32Å; W235-D273 PolarHBondContact NE1-O 3.28Å
236	R	94.5	Very high	94.2	Very high	90 Å²	90	57.2 Å²	57.2	34%	0.34	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	150.5	167	61.9	175	-179.5	-177.2	2	109.6	T224 V225 R233 E414	T224-R236 HydrophobicContact CG2-CB 4.2Å; V225-R236 CarbonylContact O-C 3.56Å; V225-R236 VanDerWaalsContact O-CA 3.31Å; V225-R236 WeakPolarHBondContact O-CA 3.26Å; R233-R236 VanDerWaalsContact NH1-CZ 3.33Å; R236-E414 IonicContact CZ-OE1 3.14Å; R236-E414 IonicContact CZ-OE2 2.81Å; R236-E414 VanDerWaalsContact CZ-OE2 3.28Å; R236-E414 IonicContact NH1-OE1 3.76Å; R236-E414 PolarHBondContact NH1-OE1 3.4Å; R236-E414 IonicContact NH1-OE2 3.31Å; R236-E414 PolarHBondContact NH1-OE2 3.19Å; R236-E414 IonicContact NH2-OE1 2.71Å; R236-E414 PolarHBondContact NH2-OE1 2.65Å; R236-E414 IonicContact NH2-OE2 2.77Å; R236-E414 PolarHBondContact NH2-OE2 2.79Å
237	I	93.8	Very high	94.2	Very high	46 Å²	46	59.4 Å²	59.4	24%	0.236	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	153.4	167.9	60.4	137.8	0	0	0	109.2	T224 V225 W235 W263	T224-I237 CarbonylContact C-O 3.51Å; T224-I237 WeakPolarHBondContact CA-O 3.26Å; T224-I237 WeakPolarHBondContact CG2-O 3.44Å; V225-I237 HydrophobicContact CB-CG1 4.39Å; V225-I237 PolarHBondContact N-O 2.72Å; V225-I237 PolarHBondContact O-N 2.75Å; W235-I237 HydrophobicContact CE3-CG2 4.27Å; W235-I237 HydrophobicContact CZ3-CG1 4.03Å; W235-I237 HydrophobicContact CZ3-CG2 4.33Å; I237-W263 HydrophobicContact CD1-CH2 3.95Å; I237-W263 HydrophobicContact CD1-CZ2 3.9Å
238	K	91.4	Very high	94.2	Very high	108 Å²	108	59.8 Å²	59.8	47%	0.47	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132	173	-171.7	179.8	178.4	-166.5	0	109.5	E420	K238-E420 IonicContact NZ-OE2 3.41Å; K238-E420 PolarHBondContact NZ-OE2 2.87Å
239	S	90.8	Very high	94.2	Very high	36 Å²	36	59.8 Å²	59.8	25%	0.252	28%	0.282	S	S	.	.			trans	-119.9	160	178.7	-176.8	0	0	0	0	110.1	G223 N241 W263	G223-S239 PolarHBondContact O-N 3.39Å; S239-N241 PolarHBondContact O-N 2.83Å; S239-N241 PolarHBondContact OG-N 2.85Å; S239-W263 VanDerWaalsContact CB-CH2 3.5Å
240	K	90.4	Very high	94.2	Very high	204 Å²	204	60.4 Å²	60.4	89%	0.887	29%	0.286	S	S	*	.	S	Bend	trans	-70.8	-24.2	171.4	-65.1	-175.6	178.9	-177.1	0	112.6
241	N	93.6	Very high	94.1	Very high	51 Å²	51	53.8 Å²	53.8	27%	0.273	26%	0.261	S	S	.	.	S	Bend	trans	-95	151.9	-179.5	-60.7	-43.8	0	0	0	109.8	G223 S239 W263 S264 N265	G223-N241 WeakPolarHBondContact CA-O 3.42Å; S239-N241 PolarHBondContact O-N 2.83Å; S239-N241 PolarHBondContact OG-N 2.85Å; N241-W263 HydrophobicContact CB-CB 4.47Å; N241-W263 HydrophobicContact CB-CE3 4.09Å; N241-W263 VanDerWaalsContact O-CE3 3.25Å; N241-W263 WeakPolarHBondContact O-CZ3 3.37Å; N241-S264 WeakPolarHBondContact CB-OG 3.41Å; N241-N265 PolarHBondContact ND2-ND2 2.72Å
242	H	93.8	Very high	93.9	Very high	93 Å²	93	50.9 Å²	50.9	43%	0.431	24%	0.242	S	C	.	.			trans	-83.9	142.3	178.4	-53.7	-53.5	0	0	0	110.4	A221 M244 W263 S264	A221-H242 PolarHBondContact O-CE1 2.73Å; A221-H242 PolarHBondContact O-ND1 3.49Å; H242-M244 HydrophobicContact CB-SD 4.37Å; H242-M244 PolarHBondContact O-N 3.31Å; H242-W263 CarbonylContact O-C 3.52Å; H242-W263 WeakPolarHBondContact O-CA 3.47Å; H242-S264 PolarHBondContact N-OG 3.29Å; H242-S264 VanDerWaalsContact N-OG 3.15Å; H242-S264 PolarHBondContact O-N 2.66Å
243	A	95.8	Very high	93.7	Very high	1 Å²	1	50 Å²	50	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	111.2	169.3	0	0	0	0	0	108.7	R16 A219 V225 T261 W263	R16-A243 PolarHBondContact NH2-O 2.93Å; A219-A243 HydrophobicContact CB-CB 3.84Å; V225-A243 HydrophobicContact CG2-CB 3.55Å; A243-T261 HydrophobicContact CB-CG2 3.78Å; A243-W263 HydrophobicContact CB-CE3 4.46Å; A243-W263 HydrophobicContact CB-CZ3 4.33Å
244	M	95.6	Very high	93.3	Very high	32 Å²	32	50.1 Å²	50.1	16%	0.158	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-36.9	-176.9	-62.2	-53.8	-60.4	0	0	111.6	P15 R16 H242 G262 V288	P15-M244 HydrophobicContact CB-CE 3.47Å; P15-M244 VanDerWaalsContact CB-CE 3.47Å; P15-M244 HydrophobicContact CG-CE 3.75Å; R16-M244 WeakPolarHBondContact CG-O 3.3Å; R16-M244 PolarHBondContact NE-O 3.22Å; H242-M244 HydrophobicContact CB-SD 4.37Å; H242-M244 PolarHBondContact O-N 3.31Å; M244-G262 PolarHBondContact N-O 2.89Å; M244-V288 WeakPolarHBondContact CB-O 3.13Å; M244-V288 WeakPolarHBondContact CG-O 3.45Å
245	S	96	Very high	93	Very high	15 Å²	15	48.7 Å²	48.7	11%	0.105	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141.5	179.5	-170.2	0	0	0	0	109.1	G262 V291	S245-G262 PolarHBondContact N-O 2.95Å; S245-G262 PolarHBondContact O-N 2.86Å; S245-V291 PolarHBondContact OG-N 3.26Å; S245-V291 VanDerWaalsContact OG-N 3.14Å
246	I	97.7	Very high	92.8	Very high	11 Å²	11	49.7 Å²	49.7	6%	0.056	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.5	168.1	59.9	175.9	0	0	0	109.1	C209 A219 V225 L259 I260 T261	C209-I246 HydrophobicContact CB-CD1 4.43Å; C209-I246 HydrophobicContact CB-CG1 4.18Å; A219-I246 HydrophobicContact CB-CD1 4.05Å; A219-I246 HydrophobicContact CB-CG2 4Å; V225-I246 HydrophobicContact CG1-CG2 4.49Å; I246-L259 HydrophobicContact CB-CD1 4.12Å; I246-I260 CarbonylContact C-O 3.59Å; I246-I260 VanDerWaalsContact CA-O 3.26Å; I246-I260 WeakPolarHBondContact CA-O 3.4Å; I246-T261 HydrophobicContact CG2-CG2 4.04Å
247	H	97.6	Very high	92.8	Very high	46 Å²	46	47 Å²	47	21%	0.213	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.7	177.8	-168.9	65.6	0	0	0	109.3	I260 V291 E293	H247-I260 PolarHBondContact N-O 3.21Å; H247-I260 WeakPolarHBondContact O-CA 3.47Å; H247-I260 WeakPolarHBondContact O-CB 3.26Å; H247-I260 PolarHBondContact O-N 3.39Å; H247-V291 HydrophobicContact CB-CB 4.19Å; H247-V291 HydrophobicContact CB-CG1 3.89Å; H247-E293 IonicContact CD2-OE2 3.2Å; H247-E293 IonicContact CE1-OE2 3.76Å; H247-E293 VanDerWaalsContact NE2-CD 3.34Å; H247-E293 WeakPolarHBondContact NE2-CG 3.47Å; H247-E293 IonicContact NE2-OE2 3.76Å; H247-E293 PolarHBondContact NE2-OE2 3.26Å
248	A	97	Very high	92.9	Very high	8 Å²	8	45 Å²	45	7%	0.066	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128	177.1	0	0	0	0	0	110	H210 M211 V257 E258	H210-A248 WeakPolarHBondContact O-CB 3.43Å; M211-A248 HydrophobicContact CB-CB 4.18Å; M211-A248 HydrophobicContact CG-CB 3.9Å; A248-V257 HydrophobicContact CB-CB 4.28Å; A248-V257 HydrophobicContact CB-CG2 4.08Å; A248-E258 WeakPolarHBondContact CA-O 3.31Å
249	F	96.3	Very high	93.2	Very high	11 Å²	11	39.8 Å²	39.8	5%	0.048	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	135.4	-179.9	-173.9	-102.6	0	0	0	110.6	L251 E258 I260 E293 V302 L304 P318	F249-L251 HydrophobicContact CD1-CB 4.08Å; F249-L251 HydrophobicContact CD1-CD1 3.93Å; F249-L251 HydrophobicContact CE1-CD1 3.85Å; F249-L251 PolarHBondContact O-N 3.41Å; F249-L251 VanDerWaalsContact O-N 3.16Å; F249-E258 PolarHBondContact N-O 3.16Å; F249-E258 PolarHBondContact O-N 3.2Å; F249-I260 HydrophobicContact CB-CD1 4.4Å; F249-I260 HydrophobicContact CB-CG1 3.83Å; F249-E293 HydrophobicContact CD2-CB 4.14Å; F249-E293 HydrophobicContact CE2-CB 4.36Å; F249-V302 HydrophobicContact CE2-CB 4.44Å; F249-V302 HydrophobicContact CE2-CG1 3.97Å; F249-L304 HydrophobicContact CB-CD1 4.01Å; F249-L304 HydrophobicContact CD1-CB 3.82Å; F249-L304 HydrophobicContact CD1-CD1 4.28Å; F249-L304 HydrophobicContact CD1-CD2 4.4Å; F249-L304 HydrophobicContact CD1-CG 4.4Å; F249-L304 HydrophobicContact CE1-CB 3.77Å; F249-L304 HydrophobicContact CG-CB 4.23Å; F249-L304 HydrophobicContact CG-CD1 4.05Å; F249-L304 HydrophobicContact CZ-CB 4.15Å; F249-P318 HydrophobicContact CE1-CG 3.87Å; F249-P318 HydrophobicContact CZ-CG 3.74Å
250	D	94.5	Very high	93.5	Very high	37 Å²	37	38.1 Å²	38.1	20%	0.198	21%	0.213	C	C	.	.			trans	-79.8	93.8	173.1	178.5	2.4	0	0	0	109.2	N252 A253 D254 G255 V257 P318	D250-N252 PolarHBondContact OD1-N 3.33Å; D250-N252 PolarHBondContact OD1-OD1 2.84Å; D250-A253 WeakPolarHBondContact OD1-CA 3.32Å; D250-A253 PolarHBondContact OD1-N 2.84Å; D250-A253 WeakPolarHBondContact OD2-CA 3.4Å; D250-D254 PolarHBondContact OD1-N 3.12Å; D250-D254 PolarHBondContact OD2-N 2.95Å; D250-G255 VanDerWaalsContact OD2-CA 3.29Å; D250-G255 WeakPolarHBondContact OD2-CA 3.4Å; D250-G255 PolarHBondContact OD2-N 3.44Å; D250-V257 HydrophobicContact CB-CG1 4.2Å; D250-P318 WeakPolarHBondContact O-CG 3.45Å
251	L	90.4	Very high	93.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-86.9	-21.2	-176.7	-166.6	66.9	0	0	0	112	M1 F249 E258 I260 A270 F280 L304 P318 A319	M1-L251 HydrophobicContact CE-CD1 4.44Å; M1-L251 HydrophobicContact CE-CD2 3.55Å; M1-L251 HydrophobicContact CE-CG 3.57Å; M1-L251 HydrophobicContact SD-CD1 4.09Å; M1-L251 HydrophobicContact SD-CD2 4.25Å; M1-L251 HydrophobicContact SD-CG 3.81Å; F249-L251 HydrophobicContact CD1-CB 4.08Å; F249-L251 HydrophobicContact CD1-CD1 3.93Å; F249-L251 HydrophobicContact CE1-CD1 3.85Å; F249-L251 PolarHBondContact O-N 3.41Å; F249-L251 VanDerWaalsContact O-N 3.16Å; L251-E258 PolarHBondContact N-OE2 2.81Å; L251-I260 HydrophobicContact CB-CD1 4.46Å; L251-I260 HydrophobicContact CD2-CD1 4.42Å; L251-A270 HydrophobicContact CD2-CB 3.79Å; L251-F280 HydrophobicContact CD2-CB 3.54Å; L251-F280 HydrophobicContact CD2-CD1 3.48Å; L251-F280 VanDerWaalsContact CD2-CD1 3.48Å; L251-F280 HydrophobicContact CD2-CE1 4.29Å; L251-F280 HydrophobicContact CD2-CG 3.59Å; L251-L304 HydrophobicContact CD1-CD2 4.07Å; L251-P318 CarbonylContact O-C 3.49Å; L251-P318 VanDerWaalsContact O-CA 3.28Å; L251-P318 WeakPolarHBondContact O-CA 3.45Å; L251-A319 PolarHBondContact O-N 2.86Å
252	N	87.6	Confident	94	Very high	28 Å²	28	26 Å²	26	15%	0.15	16%	0.158	C	C	.	.	S	Bend	trans	-102.3	-1.9	-176.1	79.2	19.9	0	0	0	113.7	D250 D254 E258 K324	D250-N252 PolarHBondContact OD1-N 3.33Å; D250-N252 PolarHBondContact OD1-OD1 2.84Å; N252-D254 VanDerWaalsContact C-N 3.32Å; N252-D254 PolarHBondContact ND2-OD2 3.11Å; N252-D254 PolarHBondContact O-N 3Å; N252-D254 WeakPolarHBondContact OD1-CA 3.45Å; N252-D254 WeakPolarHBondContact OD1-CB 3.46Å; N252-D254 PolarHBondContact OD1-N 3.08Å; N252-D254 PolarHBondContact OD1-OD1 3.5Å; N252-D254 PolarHBondContact OD1-OD2 2.95Å; N252-D254 VanDerWaalsContact OD1-OD2 3.13Å; N252-E258 PolarHBondContact ND2-OE1 2.98Å; N252-K324 WeakPolarHBondContact O-CE 3.25Å
253	A	87.2	Confident	94.2	Very high	33 Å²	33	21.6 Å²	21.6	27%	0.273	14%	0.138	S	C	.	.	S	Bend	trans	54.6	41	-176.9	0	0	0	0	0	113.6	D250 P318 A319	D250-A253 WeakPolarHBondContact OD1-CA 3.32Å; D250-A253 PolarHBondContact OD1-N 2.84Å; D250-A253 WeakPolarHBondContact OD2-CA 3.4Å; A253-P318 HydrophobicContact CB-CB 4.11Å; A253-A319 WeakPolarHBondContact CB-O 3.44Å
254	D	86.3	Confident	94.3	Very high	83 Å²	83	23.3 Å²	23.3	44%	0.444	15%	0.15	S	C	.	.	S	Bend	trans	-95.2	-4.9	173.8	75.3	14.9	0	0	0	113.7	D250 N252 V256	D250-D254 PolarHBondContact OD1-N 3.12Å; D250-D254 PolarHBondContact OD2-N 2.95Å; N252-D254 VanDerWaalsContact C-N 3.32Å; N252-D254 PolarHBondContact ND2-OD2 3.11Å; N252-D254 PolarHBondContact O-N 3Å; N252-D254 WeakPolarHBondContact OD1-CA 3.45Å; N252-D254 WeakPolarHBondContact OD1-CB 3.46Å; N252-D254 PolarHBondContact OD1-N 3.08Å; N252-D254 PolarHBondContact OD1-OD1 3.5Å; N252-D254 PolarHBondContact OD1-OD2 2.95Å; N252-D254 VanDerWaalsContact OD1-OD2 3.13Å; D254-V256 WeakPolarHBondContact OD1-CA 3.31Å; D254-V256 WeakPolarHBondContact OD1-CB 3.41Å; D254-V256 PolarHBondContact OD1-N 2.85Å
255	G	87.4	Confident	94.3	Very high	67 Å²	67	25 Å²	25	69%	0.691	16%	0.16	S	C	*	.	S	Bend	trans	88.8	-0.2	-179	0	0	0	0	0	114	D250	D250-G255 VanDerWaalsContact OD2-CA 3.29Å; D250-G255 WeakPolarHBondContact OD2-CA 3.4Å; D250-G255 PolarHBondContact OD2-N 3.44Å
256	V	91.3	Very high	94.2	Very high	43 Å²	43	24.3 Å²	24.3	26%	0.261	16%	0.155	S	C	.	.	S	Bend	trans	-114.7	127.2	173.7	-175.6	0	0	0	0	108.6	D254	D254-V256 WeakPolarHBondContact OD1-CA 3.31Å; D254-V256 WeakPolarHBondContact OD1-CB 3.41Å; D254-V256 PolarHBondContact OD1-N 2.85Å
257	V	94.4	Very high	94.1	Very high	33 Å²	33	25.7 Å²	25.7	20%	0.2	16%	0.16	C	C	.	.			trans	-71.5	140	179.2	-63.3	0	0	0	0	111.9	M211 A248 D250	M211-V257 HydrophobicContact CB-CG2 3.79Å; M211-V257 HydrophobicContact CE-CG2 4.22Å; M211-V257 WeakPolarHBondContact CE-O 3.44Å; M211-V257 WeakPolarHBondContact O-CG2 3.47Å; A248-V257 HydrophobicContact CB-CB 4.28Å; A248-V257 HydrophobicContact CB-CG2 4.08Å; D250-V257 HydrophobicContact CB-CG1 4.2Å
258	E	95.4	Very high	94.1	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.019	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	157	167.3	-72.7	88.3	-172.7	0	0	112.2	A248 F249 L251 N252 I260 A270 R271 I279	A248-E258 WeakPolarHBondContact CA-O 3.31Å; F249-E258 PolarHBondContact N-O 3.16Å; F249-E258 PolarHBondContact O-N 3.2Å; L251-E258 PolarHBondContact N-OE2 2.81Å; N252-E258 PolarHBondContact ND2-OE1 2.98Å; E258-I260 HydrophobicContact CB-CD1 4.18Å; E258-I260 PolarHBondContact O-N 3.14Å; E258-A270 HydrophobicContact CB-CB 4.22Å; E258-R271 WeakPolarHBondContact CA-O 3.3Å; E258-R271 VanDerWaalsContact CB-O 3.31Å; E258-R271 WeakPolarHBondContact CB-O 3.25Å; E258-I279 HydrophobicContact CG-CD1 3.56Å; E258-I279 WeakPolarHBondContact OE1-CD1 3.25Å
259	L	97.6	Very high	94	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	105.9	167.7	-173.8	62.6	0	0	0	109.5	C209 M211 V225 V227 W235 I246 R271	C209-L259 WeakPolarHBondContact SG-CD1 3.48Å; M211-L259 HydrophobicContact CE-CB 3.93Å; M211-L259 HydrophobicContact SD-CB 4.38Å; V225-L259 HydrophobicContact CG1-CD2 3.55Å; V227-L259 HydrophobicContact CG2-CD2 3.89Å; W235-L259 HydrophobicContact CH2-CD2 3.91Å; W235-L259 HydrophobicContact CZ2-CD2 4.16Å; I246-L259 HydrophobicContact CB-CD1 4.12Å; L259-R271 PolarHBondContact N-O 2.71Å; L259-R271 PolarHBondContact O-N 3.18Å
260	I	97.8	Very high	93.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.7	173.7	-45.1	-55.9	0	0	0	108.9	I246 H247 F249 L251 E258 I268 D269 A270 V291 L304	I246-I260 CarbonylContact C-O 3.59Å; I246-I260 VanDerWaalsContact CA-O 3.26Å; I246-I260 WeakPolarHBondContact CA-O 3.4Å; H247-I260 PolarHBondContact N-O 3.21Å; H247-I260 WeakPolarHBondContact O-CA 3.47Å; H247-I260 WeakPolarHBondContact O-CB 3.26Å; H247-I260 PolarHBondContact O-N 3.39Å; F249-I260 HydrophobicContact CB-CD1 4.4Å; F249-I260 HydrophobicContact CB-CG1 3.83Å; L251-I260 HydrophobicContact CB-CD1 4.46Å; L251-I260 HydrophobicContact CD2-CD1 4.42Å; E258-I260 HydrophobicContact CB-CD1 4.18Å; E258-I260 PolarHBondContact O-N 3.14Å; I260-I268 HydrophobicContact CG2-CG2 3.98Å; I260-D269 WeakPolarHBondContact CA-O 3.27Å; I260-A270 HydrophobicContact CD1-CB 3.33Å; I260-V291 HydrophobicContact CB-CG1 4.22Å; I260-V291 HydrophobicContact CG2-CG1 3.79Å; I260-L304 HydrophobicContact CD1-CD2 4.31Å; I260-L304 HydrophobicContact CG1-CD1 4.1Å; I260-L304 HydrophobicContact CG1-CD2 4.16Å; I260-L304 HydrophobicContact CG2-CD1 4.36Å; I260-L304 HydrophobicContact CG2-CD2 3.99Å
261	T	97.9	Very high	93.9	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.4	179.6	-55.8	0	0	0	0	111	V225 A243 I246 W263 I268 D269	V225-T261 HydrophobicContact CG2-CG2 4.12Å; A243-T261 HydrophobicContact CB-CG2 3.78Å; I246-T261 HydrophobicContact CG2-CG2 4.04Å; T261-W263 HydrophobicContact CG2-CD2 4.05Å; T261-W263 HydrophobicContact CG2-CG 4.39Å; T261-W263 HydrophobicContact CG2-CH2 4.42Å; T261-W263 HydrophobicContact CG2-CZ2 3.79Å; T261-I268 WeakPolarHBondContact O-CA 3.32Å; T261-D269 WeakPolarHBondContact CB-OD1 3.25Å; T261-D269 PolarHBondContact N-O 3.32Å; T261-D269 PolarHBondContact O-N 2.94Å; T261-D269 VanDerWaalsContact O-N 3.1Å
262	G	97.4	Very high	94.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119	169.5	0	0	0	0	0	111.5	M244 S245	M244-G262 PolarHBondContact N-O 2.89Å; S245-G262 PolarHBondContact N-O 2.95Å; S245-G262 PolarHBondContact O-N 2.86Å
263	W	97.6	Very high	94.2	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.008	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	158	-175.2	-61	86.5	0	0	0	112.9	V225 I237 S239 N241 H242 A243 T261 N265 G266 K267 D269 V288	V225-W263 HydrophobicContact CB-CH2 4.49Å; V225-W263 HydrophobicContact CG2-CH2 3.76Å; V225-W263 HydrophobicContact CG2-CZ2 4.29Å; V225-W263 HydrophobicContact CG2-CZ3 4.32Å; I237-W263 HydrophobicContact CD1-CH2 3.95Å; I237-W263 HydrophobicContact CD1-CZ2 3.9Å; S239-W263 VanDerWaalsContact CB-CH2 3.5Å; N241-W263 HydrophobicContact CB-CB 4.47Å; N241-W263 HydrophobicContact CB-CE3 4.09Å; N241-W263 VanDerWaalsContact O-CE3 3.25Å; N241-W263 WeakPolarHBondContact O-CZ3 3.37Å; H242-W263 CarbonylContact O-C 3.52Å; H242-W263 WeakPolarHBondContact O-CA 3.47Å; A243-W263 HydrophobicContact CB-CE3 4.46Å; A243-W263 HydrophobicContact CB-CZ3 4.33Å; T261-W263 HydrophobicContact CG2-CD2 4.05Å; T261-W263 HydrophobicContact CG2-CG 4.39Å; T261-W263 HydrophobicContact CG2-CH2 4.42Å; T261-W263 HydrophobicContact CG2-CZ2 3.79Å; W263-N265 VanDerWaalsContact CB-OD1 3.27Å; W263-N265 WeakPolarHBondContact CB-OD1 3.28Å; W263-N265 PolarHBondContact O-N 2.81Å; W263-G266 PolarHBondContact O-N 2.92Å; W263-K267 HydrophobicContact CB-CB 4.15Å; W263-K267 WeakPolarHBondContact CB-O 3.38Å; W263-K267 VanDerWaalsContact CD1-O 3.25Å; W263-K267 HydrophobicContact CG-CB 4.28Å; W263-K267 PolarHBondContact N-O 3.29Å; W263-D269 PolarHBondContact NE1-OD1 3.24Å; W263-V288 PolarHBondContact O-N 2.87Å
264	S	96.8	Very high	94.3	Very high	36 Å²	36	28.3 Å²	28.3	25%	0.252	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19	179.5	64.5	0	0	0	0	114.5	N241 H242 G266 S287	N241-S264 WeakPolarHBondContact CB-OG 3.41Å; H242-S264 PolarHBondContact N-OG 3.29Å; H242-S264 VanDerWaalsContact N-OG 3.15Å; H242-S264 PolarHBondContact O-N 2.66Å; S264-G266 VanDerWaalsContact C-N 3.34Å; S264-S287 WeakPolarHBondContact CA-OG 3.41Å; S264-S287 VanDerWaalsContact O-CA 3.28Å; S264-S287 WeakPolarHBondContact O-CA 3.35Å; S264-S287 WeakPolarHBondContact O-CB 3.05Å; S264-S287 PolarHBondContact O-OG 3.43Å
265	N	95.4	Very high	94.5	Very high	69 Å²	69	28.2 Å²	28.2	37%	0.369	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	6.9	175.3	73.3	-26.6	0	0	0	113.5	N241 W263 K267	N241-N265 PolarHBondContact ND2-ND2 2.72Å; W263-N265 VanDerWaalsContact CB-OD1 3.27Å; W263-N265 WeakPolarHBondContact CB-OD1 3.28Å; W263-N265 PolarHBondContact O-N 2.81Å; N265-K267 VanDerWaalsContact C-N 3.32Å; N265-K267 VanDerWaalsContact OD1-CB 3.24Å; N265-K267 WeakPolarHBondContact OD1-CB 3.47Å; N265-K267 PolarHBondContact OD1-N 2.91Å; N265-K267 VanDerWaalsContact OD1-N 3.12Å
266	G	95.1	Very high	94.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	85.9	-4	-177.9	0	0	0	0	0	114.7	W263 S264 F284 S286	W263-G266 PolarHBondContact O-N 2.92Å; S264-G266 VanDerWaalsContact C-N 3.34Å; G266-F284 WeakPolarHBondContact O-CB 3.37Å; G266-F284 PolarHBondContact O-N 3.44Å; G266-S286 WeakPolarHBondContact CA-O 3.47Å
267	K	96	Very high	94.6	Very high	39 Å²	39	27.9 Å²	27.9	17%	0.17	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	141	173.1	-176.9	-173	165.6	-155.7	0	109.6	W263 N265 D269 K281 N283	W263-K267 HydrophobicContact CB-CB 4.15Å; W263-K267 WeakPolarHBondContact CB-O 3.38Å; W263-K267 VanDerWaalsContact CD1-O 3.25Å; W263-K267 HydrophobicContact CG-CB 4.28Å; W263-K267 PolarHBondContact N-O 3.29Å; N265-K267 VanDerWaalsContact C-N 3.32Å; N265-K267 VanDerWaalsContact OD1-CB 3.24Å; N265-K267 WeakPolarHBondContact OD1-CB 3.47Å; N265-K267 PolarHBondContact OD1-N 2.91Å; N265-K267 VanDerWaalsContact OD1-N 3.12Å; K267-D269 VanDerWaalsContact CE-OD2 3.29Å; K267-D269 WeakPolarHBondContact CE-OD2 3.12Å; K267-D269 IonicContact NZ-OD2 2.65Å; K267-D269 PolarHBondContact NZ-OD2 2.9Å; K267-K281 HydrophobicContact CG-CG 4.34Å; K267-N283 WeakPolarHBondContact CA-OD1 3.48Å
268	I	96.1	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.1	165	-62.4	177.8	0	0	0	107.3	I260 T261 K281 D282 F284 V288 C306	I260-I268 HydrophobicContact CG2-CG2 3.98Å; T261-I268 WeakPolarHBondContact O-CA 3.32Å; I268-K281 CarbonylContact O-C 3.44Å; I268-K281 VanDerWaalsContact O-CA 3.25Å; I268-K281 WeakPolarHBondContact O-CA 3.24Å; I268-D282 PolarHBondContact N-O 2.94Å; I268-D282 PolarHBondContact O-N 3.47Å; I268-F284 HydrophobicContact CD1-CD2 3.52Å; I268-F284 HydrophobicContact CD1-CE2 3.22Å; I268-F284 HydrophobicContact CD1-CZ 4.27Å; I268-F284 HydrophobicContact CG1-CD2 4.18Å; I268-F284 HydrophobicContact CG1-CE2 4.33Å; I268-V288 HydrophobicContact CD1-CG2 4.21Å; I268-V288 HydrophobicContact CG1-CG2 3.75Å; I268-C306 HydrophobicContact CD1-CB 3.46Å; I268-C306 VanDerWaalsContact CD1-CB 3.46Å
269	D	95.1	Very high	94.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.1	168.3	55.2	4	0	0	0	112.4	I260 T261 W263 K267 R271 V278 F280	I260-D269 WeakPolarHBondContact CA-O 3.27Å; T261-D269 WeakPolarHBondContact CB-OD1 3.25Å; T261-D269 PolarHBondContact N-O 3.32Å; T261-D269 PolarHBondContact O-N 2.94Å; T261-D269 VanDerWaalsContact O-N 3.1Å; W263-D269 PolarHBondContact NE1-OD1 3.24Å; K267-D269 VanDerWaalsContact CE-OD2 3.29Å; K267-D269 WeakPolarHBondContact CE-OD2 3.12Å; K267-D269 IonicContact NZ-OD2 2.65Å; K267-D269 PolarHBondContact NZ-OD2 2.9Å; D269-R271 IonicContact OD1-NE 2.73Å; D269-R271 IonicContact OD2-CZ 3.06Å; D269-R271 IonicContact OD2-NE 3.81Å; D269-R271 PolarHBondContact OD2-NE 3.29Å; D269-R271 VanDerWaalsContact OD2-NE 3.13Å; D269-R271 IonicContact OD2-NH2 2.68Å; D269-R271 PolarHBondContact OD2-NH2 3.47Å; D269-V278 HydrophobicContact CB-CG1 4.06Å; D269-F280 CarbonylContact C-O 3.56Å; D269-F280 WeakPolarHBondContact CA-O 3.33Å; D269-F280 WeakPolarHBondContact CB-O 3.36Å
270	A	95.1	Very high	93.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.9	169.1	0	0	0	0	0	108.3	L251 E258 I260 I279 F280	L251-A270 HydrophobicContact CD2-CB 3.79Å; E258-A270 HydrophobicContact CB-CB 4.22Å; I260-A270 HydrophobicContact CD1-CB 3.33Å; A270-I279 PolarHBondContact O-N 3.28Å; A270-F280 HydrophobicContact CB-CB 3.84Å; A270-F280 PolarHBondContact N-O 2.92Å; A270-F280 PolarHBondContact O-N 3.25Å
271	R	94.9	Very high	93.5	Very high	26 Å²	26	40.1 Å²	40.1	10%	0.098	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.5	-177.5	-67.5	174.8	179.1	-91.7	-3.9	111.8	W235 E258 L259 D269 D273 G276 E277 V278	W235-R271 HydrophobicContact CH2-CB 4.04Å; W235-R271 HydrophobicContact CZ2-CB 4.13Å; E258-R271 WeakPolarHBondContact CA-O 3.3Å; E258-R271 VanDerWaalsContact CB-O 3.31Å; E258-R271 WeakPolarHBondContact CB-O 3.25Å; L259-R271 PolarHBondContact N-O 2.71Å; L259-R271 PolarHBondContact O-N 3.18Å; D269-R271 IonicContact OD1-NE 2.73Å; D269-R271 IonicContact OD2-CZ 3.06Å; D269-R271 IonicContact OD2-NE 3.81Å; D269-R271 PolarHBondContact OD2-NE 3.29Å; D269-R271 VanDerWaalsContact OD2-NE 3.13Å; D269-R271 IonicContact OD2-NH2 2.68Å; D269-R271 PolarHBondContact OD2-NH2 3.47Å; R271-D273 PolarHBondContact O-N 3.44Å; R271-G276 PolarHBondContact NH1-O 3.05Å; R271-E277 VanDerWaalsContact CA-O 3.23Å; R271-E277 WeakPolarHBondContact CA-O 3.46Å; R271-V278 HydrophobicContact CG-CG2 4.2Å; R271-V278 VanDerWaalsContact CZ-CG2 3.42Å
272	S	93.6	Very high	93.3	Very high	23 Å²	23	42 Å²	42	16%	0.161	21%	0.208	C	C	.	.			trans	-60.7	135.5	172.6	175.8	0	0	0	0	110.7	W235 R274 G276 E277	W235-S272 WeakPolarHBondContact CZ2-O 3.26Å; W235-S272 PolarHBondContact NE1-O 3.34Å; W235-S272 VanDerWaalsContact NE1-O 3.12Å; S272-R274 PolarHBondContact O-N 2.97Å; S272-R274 PolarHBondContact OG-N 2.86Å; S272-G276 WeakPolarHBondContact O-CA 3.25Å; S272-G276 PolarHBondContact O-N 3.14Å; S272-E277 PolarHBondContact N-O 3.03Å
273	D	90.3	Very high	93.2	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.037	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.5	171.5	69.6	-43.4	0	0	0	113.1	M211 H212 R215 W235 R271	M211-D273 HydrophobicContact CE-CB 3.6Å; M211-D273 HydrophobicContact SD-CB 4.36Å; H212-D273 IonicContact CE1-OD2 3.67Å; H212-D273 PolarHBondContact CE1-OD2 2.83Å; H212-D273 IonicContact NE2-OD2 2.75Å; R215-D273 IonicContact CZ-OD2 3.86Å; R215-D273 IonicContact NH1-OD2 2.85Å; R215-D273 PolarHBondContact NH1-OD2 2.94Å; W235-D273 VanDerWaalsContact CD1-O 3.32Å; W235-D273 PolarHBondContact NE1-O 3.28Å; R271-D273 PolarHBondContact O-N 3.44Å
274	R	89.7	Confident	93	Very high	163 Å²	163	45.8 Å²	45.8	62%	0.615	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-47.6	-174.9	-66.7	179.8	-172.4	-168.6	0.9	113.8	S272	S272-R274 PolarHBondContact O-N 2.97Å; S272-R274 PolarHBondContact OG-N 2.86Å
275	T	90.2	Very high	92.9	Very high	81 Å²	81	48.7 Å²	48.7	50%	0.497	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-16.8	-169.9	61	0	0	0	0	113.8	E277	T275-E277 PolarHBondContact O-N 3.49Å; T275-E277 WeakPolarHBondContact OG1-CB 3.34Å; T275-E277 WeakPolarHBondContact OG1-CG 3.35Å; T275-E277 PolarHBondContact OG1-N 3.21Å
276	G	91.2	Very high	92.9	Very high	5 Å²	5	46.4 Å²	46.4	5%	0.052	24%	0.239	C	C	.	.			trans	73.1	7.8	-172.3	0	0	0	0	0	114.5	R271 S272	R271-G276 PolarHBondContact NH1-O 3.05Å; S272-G276 WeakPolarHBondContact O-CA 3.25Å; S272-G276 PolarHBondContact O-N 3.14Å
277	E	89.6	Confident	93	Very high	97 Å²	97	47.4 Å²	47.4	45%	0.453	25%	0.245	S	C	.	.			trans	-63.8	142.1	174.2	-74.9	-176.8	-156.8	0	0	111.1	R271 S272 T275 I279 R336	R271-E277 VanDerWaalsContact CA-O 3.23Å; R271-E277 WeakPolarHBondContact CA-O 3.46Å; S272-E277 PolarHBondContact N-O 3.03Å; T275-E277 PolarHBondContact O-N 3.49Å; T275-E277 WeakPolarHBondContact OG1-CB 3.34Å; T275-E277 WeakPolarHBondContact OG1-CG 3.35Å; T275-E277 PolarHBondContact OG1-N 3.21Å; E277-I279 PolarHBondContact O-N 2.95Å; E277-R336 IonicContact OE2-CZ 2.74Å; E277-R336 IonicContact OE2-NH2 3.9Å; E277-R336 PolarHBondContact OE2-NH2 2.86Å
278	V	90.4	Very high	93	Very high	69 Å²	69	45.5 Å²	45.5	42%	0.418	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	120.6	-179.9	179.3	0	0	0	0	109.5	D269 R271 F280 K281	D269-V278 HydrophobicContact CB-CG1 4.06Å; R271-V278 HydrophobicContact CG-CG2 4.2Å; R271-V278 VanDerWaalsContact CZ-CG2 3.42Å; V278-F280 WeakPolarHBondContact CG1-O 3.41Å; V278-K281 HydrophobicContact CG1-CB 4.41Å
279	I	89.3	Confident	93.1	Very high	76 Å²	76	45.5 Å²	45.5	39%	0.39	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-39.1	178.4	-65.9	165.7	0	0	0	110.5	E258 A270 E277	E258-I279 HydrophobicContact CG-CD1 3.56Å; E258-I279 WeakPolarHBondContact OE1-CD1 3.25Å; A270-I279 PolarHBondContact O-N 3.28Å; E277-I279 PolarHBondContact O-N 2.95Å
280	F	89.4	Confident	93.1	Very high	17 Å²	17	45.6 Å²	45.6	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.7	179.4	171.7	-106.6	0	0	0	110.6	M1 L251 D269 A270 V278 D282 Y316	M1-F280 HydrophobicContact CB-CD2 4.11Å; M1-F280 HydrophobicContact CB-CE2 3.74Å; M1-F280 HydrophobicContact CB-CZ 4.46Å; M1-F280 HydrophobicContact CE-CB 3.92Å; M1-F280 HydrophobicContact CE-CD2 3.79Å; M1-F280 HydrophobicContact CE-CG 3.95Å; L251-F280 HydrophobicContact CD2-CB 3.54Å; L251-F280 HydrophobicContact CD2-CD1 3.48Å; L251-F280 VanDerWaalsContact CD2-CD1 3.48Å; L251-F280 HydrophobicContact CD2-CE1 4.29Å; L251-F280 HydrophobicContact CD2-CG 3.59Å; D269-F280 CarbonylContact C-O 3.56Å; D269-F280 WeakPolarHBondContact CA-O 3.33Å; D269-F280 WeakPolarHBondContact CB-O 3.36Å; A270-F280 HydrophobicContact CB-CB 3.84Å; A270-F280 PolarHBondContact N-O 2.92Å; A270-F280 PolarHBondContact O-N 3.25Å; V278-F280 WeakPolarHBondContact CG1-O 3.41Å; F280-D282 HydrophobicContact CE1-CB 3.99Å; F280-D282 HydrophobicContact CZ-CB 3.73Å; F280-Y316 HydrophobicContact CE1-CE1 4.41Å; F280-Y316 HydrophobicContact CZ-CD1 4.06Å; F280-Y316 AromaticContact CZ-CE1 3.88Å; F280-Y316 HydrophobicContact CZ-CE1 3.88Å
281	K	92.6	Very high	93.2	Very high	133 Å²	133	45.8 Å²	45.8	58%	0.578	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.3	137.9	174.3	-175.8	-176.4	171.2	-169.5	0	110.3	K267 I268 V278	K267-K281 HydrophobicContact CG-CG 4.34Å; I268-K281 CarbonylContact O-C 3.44Å; I268-K281 VanDerWaalsContact O-CA 3.25Å; I268-K281 WeakPolarHBondContact O-CA 3.24Å; V278-K281 HydrophobicContact CG1-CB 4.41Å
282	D	93.8	Very high	93.3	Very high	38 Å²	38	45.4 Å²	45.4	20%	0.203	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	170.5	165.9	-165	9	0	0	0	110	I268 F280 R314 Y316	I268-D282 PolarHBondContact N-O 2.94Å; I268-D282 PolarHBondContact O-N 3.47Å; F280-D282 HydrophobicContact CE1-CB 3.99Å; F280-D282 HydrophobicContact CZ-CB 3.73Å; D282-R314 IonicContact OD1-NH1 3.69Å; D282-R314 PolarHBondContact OD1-NH1 3.13Å; D282-R314 IonicContact OD2-NH1 3.69Å; D282-R314 PolarHBondContact OD2-NH1 2.64Å; D282-Y316 PolarHBondContact OD2-OH 2.78Å
283	N	94.5	Very high	93.4	Very high	76 Å²	76	48.5 Å²	48.5	41%	0.406	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	129.2	177.2	-144.2	87.3	0	0	0	111.5	K267 R314	K267-N283 WeakPolarHBondContact CA-OD1 3.48Å; N283-R314 PolarHBondContact O-NH1 2.75Å; N283-R314 PolarHBondContact O-NH2 2.96Å
284	F	94.6	Very high	93.5	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.026	26%	0.255	C	S	.	.			trans	-86.6	166.3	168.1	-83	-105.5	0	0	0	111.1	G266 I268 S286 C306 E312 R314	G266-F284 WeakPolarHBondContact O-CB 3.37Å; G266-F284 PolarHBondContact O-N 3.44Å; I268-F284 HydrophobicContact CD1-CD2 3.52Å; I268-F284 HydrophobicContact CD1-CE2 3.22Å; I268-F284 HydrophobicContact CD1-CZ 4.27Å; I268-F284 HydrophobicContact CG1-CD2 4.18Å; I268-F284 HydrophobicContact CG1-CE2 4.33Å; F284-S286 WeakPolarHBondContact CB-O 3.39Å; F284-C306 HydrophobicContact CE2-CB 3.93Å; F284-C306 HydrophobicContact CZ-CB 3.86Å; F284-C306 WeakPolarHBondContact CZ-O 3.35Å; F284-E312 HydrophobicContact CD1-CB 4.1Å; F284-E312 HydrophobicContact CD1-CG 4.03Å; F284-E312 HydrophobicContact CE1-CB 4.09Å; F284-E312 HydrophobicContact CE1-CG 3.88Å; F284-R314 HydrophobicContact CE1-CB 4.47Å; F284-R314 HydrophobicContact CE1-CG 3.85Å; F284-R314 HydrophobicContact CE2-CB 4.43Å; F284-R314 HydrophobicContact CE2-CG 4.28Å; F284-R314 HydrophobicContact CZ-CB 3.72Å; F284-R314 VanDerWaalsContact CZ-CD 3.49Å; F284-R314 HydrophobicContact CZ-CG 3.51Å
285	S	93.8	Very high	93.7	Very high	97 Å²	97	42.2 Å²	42.2	68%	0.678	23%	0.233	S	C	*	.	S	Bend	trans	-74	-27.4	174.5	55	0	0	0	0	113.1	E312	S285-E312 PolarHBondContact OG-OE2 2.52Å
286	S	95.8	Very high	93.7	Very high	22 Å²	22	38.8 Å²	38.8	15%	0.154	21%	0.211	C	C	.	.	S	Bend	trans	-132.9	171.2	-179.4	68.8	0	0	0	0	111.1	G266 F284 S308	G266-S286 WeakPolarHBondContact CA-O 3.47Å; F284-S286 WeakPolarHBondContact CB-O 3.39Å; S286-S308 VanDerWaalsContact OG-CB 3.29Å; S286-S308 WeakPolarHBondContact OG-CB 3.32Å; S286-S308 PolarHBondContact OG-OG 2.95Å; S286-S308 VanDerWaalsContact OG-OG 3.12Å
287	S	96.8	Very high	93.7	Very high	20 Å²	20	43.1 Å²	43.1	14%	0.14	23%	0.226	C	C	.	.			trans	-45.8	140.6	171.3	-178.4	0	0	0	0	112.5	S264 S308 I309	S264-S287 WeakPolarHBondContact CA-OG 3.41Å; S264-S287 VanDerWaalsContact O-CA 3.28Å; S264-S287 WeakPolarHBondContact O-CA 3.35Å; S264-S287 WeakPolarHBondContact O-CB 3.05Å; S264-S287 PolarHBondContact O-OG 3.43Å; S287-S308 WeakPolarHBondContact O-CA 3.41Å; S287-I309 VanDerWaalsContact CB-CD1 3.48Å; S287-I309 PolarHBondContact O-N 2.81Å; S287-I309 WeakPolarHBondContact OG-CD1 3.48Å
288	V	97.5	Very high	93.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.7	172.3	-174.8	0	0	0	0	108.7	M244 W263 I268 V291 T307	M244-V288 WeakPolarHBondContact CB-O 3.13Å; M244-V288 WeakPolarHBondContact CG-O 3.45Å; W263-V288 PolarHBondContact O-N 2.87Å; I268-V288 HydrophobicContact CD1-CG2 4.21Å; I268-V288 HydrophobicContact CG1-CG2 3.75Å; V288-V291 HydrophobicContact CG1-CG2 3.99Å; V288-T307 WeakPolarHBondContact CG1-O 2.99Å
289	A	96.3	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-42.7	177.2	0	0	0	0	0	111.7	I13 P15 R16 T307 I309	I13-A289 HydrophobicContact CB-CB 3.92Å; I13-A289 HydrophobicContact CG2-CB 3.63Å; P15-A289 WeakPolarHBondContact CA-O 3.18Å; R16-A289 PolarHBondContact N-O 2.95Å; A289-T307 PolarHBondContact N-O 2.74Å; A289-I309 HydrophobicContact CB-CG1 4.01Å
290	G	96.3	Very high	93.3	Very high	2 Å²	2	41.2 Å²	41.2	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	150.7	-180	0	0	0	0	0	112.6	T307	G290-T307 PolarHBondContact N-O 3.37Å; G290-T307 PolarHBondContact N-OG1 3.41Å; G290-T307 PolarHBondContact O-N 3.41Å; G290-T307 PolarHBondContact O-OG1 3.33Å
291	V	97.3	Very high	93.3	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.024	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.3	171.9	-178.6	0	0	0	0	106.6	S245 H247 I260 V288 L304	S245-V291 PolarHBondContact OG-N 3.26Å; S245-V291 VanDerWaalsContact OG-N 3.14Å; H247-V291 HydrophobicContact CB-CB 4.19Å; H247-V291 HydrophobicContact CB-CG1 3.89Å; I260-V291 HydrophobicContact CB-CG1 4.22Å; I260-V291 HydrophobicContact CG2-CG1 3.79Å; V288-V291 HydrophobicContact CG1-CG2 3.99Å; V291-L304 HydrophobicContact CG1-CD1 3.5Å; V291-L304 VanDerWaalsContact CG1-CD1 3.5Å; V291-L304 HydrophobicContact CG1-CG 4.33Å
292	V	96.7	Very high	93.3	Very high	18 Å²	18	42.4 Å²	42.4	11%	0.109	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	164.9	-174.5	-64.8	0	0	0	0	109.4	V18 V20 L30 I305	V18-V292 HydrophobicContact CG1-CG1 4.15Å; V18-V292 HydrophobicContact CG1-CG2 4.32Å; V20-V292 HydrophobicContact CG2-CB 4.17Å; V20-V292 HydrophobicContact CG2-CG2 3.52Å; L30-V292 HydrophobicContact CD1-CG2 4.3Å; V292-I305 HydrophobicContact CG2-CB 3.96Å; V292-I305 HydrophobicContact CG2-CG2 4.4Å; V292-I305 PolarHBondContact N-O 2.83Å; V292-I305 PolarHBondContact O-N 2.97Å
293	E	95.1	Very high	93.3	Very high	88 Å²	88	40.6 Å²	40.6	41%	0.411	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	151.5	177.5	70.3	-177.7	-148.7	0	0	112	H247 F249 V302 Q303	H247-E293 IonicContact CD2-OE2 3.2Å; H247-E293 IonicContact CE1-OE2 3.76Å; H247-E293 VanDerWaalsContact NE2-CD 3.34Å; H247-E293 WeakPolarHBondContact NE2-CG 3.47Å; H247-E293 IonicContact NE2-OE2 3.76Å; H247-E293 PolarHBondContact NE2-OE2 3.26Å; F249-E293 HydrophobicContact CD2-CB 4.14Å; F249-E293 HydrophobicContact CE2-CB 4.36Å; E293-V302 HydrophobicContact CB-CG1 3.85Å; E293-V302 HydrophobicContact CG-CG1 4.2Å; E293-Q303 VanDerWaalsContact CA-O 3.29Å; E293-Q303 WeakPolarHBondContact CA-O 3.43Å
294	G	93.4	Very high	93.4	Very high	11 Å²	11	37 Å²	37	11%	0.113	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.9	156.1	174.2	0	0	0	0	0	112.7	Y296 Q303	G294-Y296 PolarHBondContact O-N 3.05Å; G294-Q303 PolarHBondContact N-O 3.26Å; G294-Q303 WeakPolarHBondContact O-CB 3.32Å; G294-Q303 PolarHBondContact O-N 3.06Å
295	D	93.1	Very high	93.5	Very high	27 Å²	27	36.8 Å²	36.8	14%	0.144	22%	0.215	C	C	.	.			trans	-78.9	69.5	174.5	178.8	8.3	0	0	0	111.1	P28 R297 L298 D299 G300	P28-D295 WeakPolarHBondContact CG-O 3.43Å; D295-R297 PolarHBondContact O-N 3.1Å; D295-L298 PolarHBondContact O-N 2.88Å; D295-L298 VanDerWaalsContact OD1-CA 3.25Å; D295-L298 WeakPolarHBondContact OD1-CA 3.4Å; D295-L298 PolarHBondContact OD1-N 3.45Å; D295-L298 WeakPolarHBondContact OD2-CA 3.2Å; D295-D299 PolarHBondContact OD1-N 3.27Å; D295-G300 VanDerWaalsContact OD2-CA 3.23Å; D295-G300 WeakPolarHBondContact OD2-CA 3.5Å; D295-G300 PolarHBondContact OD2-N 3.05Å
296	Y	91.4	Very high	93.7	Very high	8 Å²	8	32.1 Å²	32.1	3%	0.031	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.2	-171.4	-158.9	-119.6	0	0	0	114.3	F5 L7 L30 H42 P44 H45 G294 I305	F5-Y296 AromaticContact CE1-CD1 3.96Å; F5-Y296 HydrophobicContact CE1-CD1 3.96Å; F5-Y296 AromaticContact CE2-CD1 3.91Å; F5-Y296 HydrophobicContact CE2-CD1 3.91Å; F5-Y296 HydrophobicContact CE2-CE1 4.12Å; F5-Y296 AromaticContact CZ-CD1 3.5Å; F5-Y296 HydrophobicContact CZ-CD1 3.5Å; F5-Y296 VanDerWaalsContact CZ-CD1 3.5Å; F5-Y296 HydrophobicContact CZ-CE1 4.14Å; F5-Y296 HydrophobicContact CZ-CG 4.16Å; L7-Y296 HydrophobicContact CD2-CE1 3.93Å; L30-Y296 HydrophobicContact CB-CE2 3.86Å; H42-Y296 PolarHBondContact CE1-OH 2.79Å; H42-Y296 AromaticContact ND1-CZ 3.81Å; H42-Y296 PolarHBondContact ND1-OH 2.97Å; P44-Y296 HydrophobicContact CB-CE1 4.48Å; P44-Y296 HydrophobicContact CG-CD1 4.38Å; P44-Y296 HydrophobicContact CG-CE1 3.92Å; P44-Y296 HydrophobicContact CG-CE2 4.1Å; H45-Y296 PolarHBondContact NE2-O 3.24Å; G294-Y296 PolarHBondContact O-N 3.05Å; Y296-I305 HydrophobicContact CD2-CD1 4.07Å; Y296-I305 HydrophobicContact CG-CD1 4.05Å
297	R	89.3	Confident	93.8	Very high	97 Å²	97	31.1 Å²	31.1	37%	0.366	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.7	-178.1	-61.4	-172.5	-56.3	-177.5	2	113.9	F5 D295 D299	F5-R297 HydrophobicContact CD1-CG 4.26Å; D295-R297 PolarHBondContact O-N 3.1Å; R297-D299 VanDerWaalsContact C-N 3.27Å; R297-D299 IonicContact CZ-OD2 3.22Å; R297-D299 IonicContact NE-OD2 2.88Å; R297-D299 PolarHBondContact NE-OD2 3.17Å; R297-D299 IonicContact NH2-OD2 3.57Å; R297-D299 PolarHBondContact NH2-OD2 3.39Å; R297-D299 PolarHBondContact O-N 2.92Å
298	L	88.3	Confident	93.8	Very high	70 Å²	70	30.1 Å²	30.1	37%	0.366	17%	0.169	S	C	.	.	S	Bend	trans	58.1	39.5	-173	-62.3	171.4	0	0	0	112.5	P28 D295	P28-L298 HydrophobicContact CG-CD2 4.24Å; D295-L298 PolarHBondContact O-N 2.88Å; D295-L298 VanDerWaalsContact OD1-CA 3.25Å; D295-L298 WeakPolarHBondContact OD1-CA 3.4Å; D295-L298 PolarHBondContact OD1-N 3.45Å; D295-L298 WeakPolarHBondContact OD2-CA 3.2Å
299	D	86.9	Confident	93.7	Very high	66 Å²	66	32.3 Å²	32.3	35%	0.353	18%	0.18	S	C	.	.	S	Bend	trans	-97.7	5.1	176.2	62.5	11.1	0	0	0	112.8	D295 R297 Q301 Q303	D295-D299 PolarHBondContact OD1-N 3.27Å; R297-D299 VanDerWaalsContact C-N 3.27Å; R297-D299 IonicContact CZ-OD2 3.22Å; R297-D299 IonicContact NE-OD2 2.88Å; R297-D299 PolarHBondContact NE-OD2 3.17Å; R297-D299 IonicContact NH2-OD2 3.57Å; R297-D299 PolarHBondContact NH2-OD2 3.39Å; R297-D299 PolarHBondContact O-N 2.92Å; D299-Q301 PolarHBondContact O-N 2.91Å; D299-Q301 WeakPolarHBondContact OD1-CB 3.08Å; D299-Q301 PolarHBondContact OD1-N 3.5Å; D299-Q303 PolarHBondContact OD1-NE2 3.33Å; D299-Q303 VanDerWaalsContact OD1-NE2 3.16Å; D299-Q303 PolarHBondContact OD2-NE2 3.05Å
300	G	87.1	Confident	93.7	Very high	66 Å²	66	35.8 Å²	35.8	68%	0.68	20%	0.196	S	C	*	.	S	Bend	trans	79	1.7	-178.2	0	0	0	0	0	113.6	D295	D295-G300 VanDerWaalsContact OD2-CA 3.23Å; D295-G300 WeakPolarHBondContact OD2-CA 3.5Å; D295-G300 PolarHBondContact OD2-N 3.05Å
301	Q	89.4	Confident	93.5	Very high	106 Å²	106	35.7 Å²	35.7	50%	0.495	20%	0.195	S	C	.	.	S	Bend	trans	-111	128.1	178.6	-60.2	-174.7	12.8	0	0	110.4	D299 Q303 L317	D299-Q301 PolarHBondContact O-N 2.91Å; D299-Q301 WeakPolarHBondContact OD1-CB 3.08Å; D299-Q301 PolarHBondContact OD1-N 3.5Å; Q301-Q303 PolarHBondContact O-N 3.43Å; Q301-L317 HydrophobicContact CB-CD2 3.64Å
302	V	92.4	Very high	93.5	Very high	69 Å²	69	36.8 Å²	36.8	42%	0.418	20%	0.2	S	C	.	.			trans	-68.2	130.8	174.3	-173.4	0	0	0	0	108.9	F249 E293	F249-V302 HydrophobicContact CE2-CB 4.44Å; F249-V302 HydrophobicContact CE2-CG1 3.97Å; E293-V302 HydrophobicContact CB-CG1 3.85Å; E293-V302 HydrophobicContact CG-CG1 4.2Å
303	Q	93.8	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.5	-178.6	-63.4	153.1	28.5	0	0	109.4	I4 F5 E293 G294 D299 Q301 Y316 L317	I4-Q303 HydrophobicContact CD1-CB 4.42Å; I4-Q303 HydrophobicContact CD1-CG 3.72Å; F5-Q303 VanDerWaalsContact CE1-OE1 3.29Å; E293-Q303 VanDerWaalsContact CA-O 3.29Å; E293-Q303 WeakPolarHBondContact CA-O 3.43Å; G294-Q303 PolarHBondContact N-O 3.26Å; G294-Q303 WeakPolarHBondContact O-CB 3.32Å; G294-Q303 PolarHBondContact O-N 3.06Å; D299-Q303 PolarHBondContact OD1-NE2 3.33Å; D299-Q303 VanDerWaalsContact OD1-NE2 3.16Å; D299-Q303 PolarHBondContact OD2-NE2 3.05Å; Q301-Q303 PolarHBondContact O-N 3.43Å; Q303-Y316 CarbonylContact C-O 3.54Å; Q303-Y316 WeakPolarHBondContact CA-O 3.43Å; Q303-L317 HydrophobicContact CG-CD2 3.5Å; Q303-L317 VanDerWaalsContact CG-CD2 3.5Å; Q303-L317 HydrophobicContact CG-CG 4.14Å
304	L	96.6	Very high	93.5	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120	168	-179.4	71.2	0	0	0	108.5	F249 L251 I260 V291 G315 Y316	F249-L304 HydrophobicContact CB-CD1 4.01Å; F249-L304 HydrophobicContact CD1-CB 3.82Å; F249-L304 HydrophobicContact CD1-CD1 4.28Å; F249-L304 HydrophobicContact CD1-CD2 4.4Å; F249-L304 HydrophobicContact CD1-CG 4.4Å; F249-L304 HydrophobicContact CE1-CB 3.77Å; F249-L304 HydrophobicContact CG-CB 4.23Å; F249-L304 HydrophobicContact CG-CD1 4.05Å; F249-L304 HydrophobicContact CZ-CB 4.15Å; L251-L304 HydrophobicContact CD1-CD2 4.07Å; I260-L304 HydrophobicContact CD1-CD2 4.31Å; I260-L304 HydrophobicContact CG1-CD1 4.1Å; I260-L304 HydrophobicContact CG1-CD2 4.16Å; I260-L304 HydrophobicContact CG2-CD1 4.36Å; I260-L304 HydrophobicContact CG2-CD2 3.99Å; V291-L304 HydrophobicContact CG1-CD1 3.5Å; V291-L304 VanDerWaalsContact CG1-CD1 3.5Å; V291-L304 HydrophobicContact CG1-CG 4.33Å; L304-G315 CarbonylContact O-C 3.57Å; L304-G315 VanDerWaalsContact O-CA 3.28Å; L304-G315 WeakPolarHBondContact O-CA 3.48Å; L304-Y316 HydrophobicContact CD2-CD2 4.41Å; L304-Y316 PolarHBondContact N-O 3.08Å; L304-Y316 PolarHBondContact O-N 3.17Å
305	I	97	Very high	93.5	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117	-177.4	-52	169.5	0	0	0	108.3	F5 V20 V292 Y296 T307 V313	F5-I305 HydrophobicContact CZ-CG1 4.31Å; V20-I305 HydrophobicContact CG2-CD1 4.07Å; V292-I305 HydrophobicContact CG2-CB 3.96Å; V292-I305 HydrophobicContact CG2-CG2 4.4Å; V292-I305 PolarHBondContact N-O 2.83Å; V292-I305 PolarHBondContact O-N 2.97Å; Y296-I305 HydrophobicContact CD2-CD1 4.07Å; Y296-I305 HydrophobicContact CG-CD1 4.05Å; I305-T307 HydrophobicContact CG2-CG2 4.47Å; I305-V313 HydrophobicContact CG2-CG1 3.61Å
306	C	97.3	Very high	93.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.6	-179.5	-60.6	0	0	0	0	109.5	I268 F284 V313 R314 Y316	I268-C306 HydrophobicContact CD1-CB 3.46Å; I268-C306 VanDerWaalsContact CD1-CB 3.46Å; F284-C306 HydrophobicContact CE2-CB 3.93Å; F284-C306 HydrophobicContact CZ-CB 3.86Å; F284-C306 WeakPolarHBondContact CZ-O 3.35Å; C306-V313 WeakPolarHBondContact O-CA 3.43Å; C306-R314 PolarHBondContact N-O 2.63Å; C306-R314 PolarHBondContact O-N 3.4Å; C306-Y316 HydrophobicContact CB-CE2 4.19Å
307	T	97.3	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.8	-178.1	67.8	0	0	0	0	111	V18 L30 V288 A289 G290 I305 E312 V313	V18-T307 HydrophobicContact CG1-CG2 4.11Å; L30-T307 HydrophobicContact CD1-CG2 4.24Å; L30-T307 HydrophobicContact CD2-CG2 3.98Å; V288-T307 WeakPolarHBondContact CG1-O 2.99Å; A289-T307 PolarHBondContact N-O 2.74Å; G290-T307 PolarHBondContact N-O 3.37Å; G290-T307 PolarHBondContact N-OG1 3.41Å; G290-T307 PolarHBondContact O-N 3.41Å; G290-T307 PolarHBondContact O-OG1 3.33Å; I305-T307 HydrophobicContact CG2-CG2 4.47Å; T307-E312 CarbonylContact C-O 3.5Å; T307-E312 WeakPolarHBondContact CA-O 3.35Å; T307-V313 HydrophobicContact CG2-CB 4.43Å; T307-V313 HydrophobicContact CG2-CG1 4.06Å; T307-V313 HydrophobicContact CG2-CG2 3.87Å
308	S	97.3	Very high	93.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	159	175.5	90.8	0	0	0	0	111.9	S286 S287 E310 G311 E312	S286-S308 VanDerWaalsContact OG-CB 3.29Å; S286-S308 WeakPolarHBondContact OG-CB 3.32Å; S286-S308 PolarHBondContact OG-OG 2.95Å; S286-S308 VanDerWaalsContact OG-OG 3.12Å; S287-S308 WeakPolarHBondContact O-CA 3.41Å; S308-E310 PolarHBondContact O-N 3.4Å; S308-E310 PolarHBondContact OG-N 3.08Å; S308-G311 PolarHBondContact O-N 3.42Å; S308-E312 PolarHBondContact N-O 3.08Å; S308-E312 WeakPolarHBondContact OG-CB 3.2Å; S308-E312 PolarHBondContact OG-N 3.04Å; S308-E312 VanDerWaalsContact OG-N 3.11Å
309	I	96.5	Very high	92.9	Very high	45 Å²	45	27.5 Å²	27.5	23%	0.231	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-32.1	176.8	-65.3	-175.5	0	0	0	111.7	K12 I13 P15 S287 A289 G311	K12-I309 CarbonylContact C-O 3.52Å; K12-I309 VanDerWaalsContact CA-O 3.24Å; K12-I309 WeakPolarHBondContact CA-O 3.2Å; I13-I309 PolarHBondContact N-O 3.39Å; P15-I309 HydrophobicContact CG-CD1 3.73Å; P15-I309 HydrophobicContact CG-CG1 4.15Å; S287-I309 VanDerWaalsContact CB-CD1 3.48Å; S287-I309 PolarHBondContact O-N 2.81Å; S287-I309 WeakPolarHBondContact OG-CD1 3.48Å; A289-I309 HydrophobicContact CB-CG1 4.01Å; I309-G311 PolarHBondContact O-N 2.96Å
310	E	95.3	Very high	91.8	Very high	74 Å²	74	27 Å²	27	35%	0.346	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	6.8	178	-66.1	-62.6	147.2	0	0	112.8	K8 K12 S308	K8-E310 WeakPolarHBondContact CE-O 3.42Å; K8-E310 PolarHBondContact NZ-O 3.05Å; K12-E310 WeakPolarHBondContact CE-OE2 3.29Å; K12-E310 IonicContact NZ-OE1 2.72Å; K12-E310 PolarHBondContact NZ-OE1 2.73Å; K12-E310 IonicContact NZ-OE2 2.73Å; K12-E310 PolarHBondContact NZ-OE2 2.69Å; S308-E310 PolarHBondContact O-N 3.4Å; S308-E310 PolarHBondContact OG-N 3.08Å
311	G	92.8	Very high	90.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	83.4	13.4	177.3	0	0	0	0	0	114.8	L9 H11 S308 I309	L9-G311 PolarHBondContact N-O 3.07Å; H11-G311 WeakPolarHBondContact O-CA 3.22Å; S308-G311 PolarHBondContact O-N 3.42Å; I309-G311 PolarHBondContact O-N 2.96Å
312	E	95.8	Very high	88.5	Confident	27 Å²	27	33.6 Å²	33.6	13%	0.126	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	129.3	168.8	-170.9	-176.5	170.8	0	0	109	K8 F284 S285 T307 S308 R314	K8-E312 HydrophobicContact CD-CB 4.29Å; F284-E312 HydrophobicContact CD1-CB 4.1Å; F284-E312 HydrophobicContact CD1-CG 4.03Å; F284-E312 HydrophobicContact CE1-CB 4.09Å; F284-E312 HydrophobicContact CE1-CG 3.88Å; S285-E312 PolarHBondContact OG-OE2 2.52Å; T307-E312 CarbonylContact C-O 3.5Å; T307-E312 WeakPolarHBondContact CA-O 3.35Å; S308-E312 PolarHBondContact N-O 3.08Å; S308-E312 WeakPolarHBondContact OG-CB 3.2Å; S308-E312 PolarHBondContact OG-N 3.04Å; S308-E312 VanDerWaalsContact OG-N 3.11Å; E312-R314 IonicContact OE1-CZ 2.63Å; E312-R314 IonicContact OE1-NE 3.27Å; E312-R314 PolarHBondContact OE1-NE 3.01Å; E312-R314 IonicContact OE1-NH2 2.92Å; E312-R314 PolarHBondContact OE1-NH2 2.86Å; E312-R314 IonicContact OE2-NH2 3.01Å
313	V	95.9	Very high	86.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.3	179.8	-179	0	0	0	0	109.2	F5 T6 L7 L9 L30 I305 C306 T307	F5-V313 HydrophobicContact CE2-CG1 4.19Å; T6-V313 CarbonylContact C-O 3.58Å; T6-V313 WeakPolarHBondContact CA-O 3.16Å; L7-V313 HydrophobicContact CD1-CB 3.52Å; L7-V313 HydrophobicContact CD1-CG1 4.31Å; L7-V313 HydrophobicContact CD1-CG2 3.65Å; L7-V313 HydrophobicContact CG-CB 3.76Å; L7-V313 HydrophobicContact CG-CG1 4.29Å; L7-V313 HydrophobicContact CG-CG2 4.44Å; L7-V313 PolarHBondContact N-O 3.28Å; L7-V313 PolarHBondContact O-N 3.38Å; L9-V313 HydrophobicContact CD1-CG2 3.79Å; L9-V313 HydrophobicContact CG-CG2 4.14Å; L30-V313 HydrophobicContact CD2-CG1 4.04Å; L30-V313 HydrophobicContact CD2-CG2 3.92Å; I305-V313 HydrophobicContact CG2-CG1 3.61Å; C306-V313 WeakPolarHBondContact O-CA 3.43Å; T307-V313 HydrophobicContact CG2-CB 4.43Å; T307-V313 HydrophobicContact CG2-CG1 4.06Å; T307-V313 HydrophobicContact CG2-CG2 3.87Å
314	R	96.4	Very high	84.3	Confident	38 Å²	38	38.9 Å²	38.9	14%	0.143	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137.6	176.5	-59.9	-180	-172.3	173.6	4.8	109.9	P3 F5 T6 D282 N283 F284 C306 E312 Y316	P3-R314 HydrophobicContact CB-CB 4.07Å; P3-R314 HydrophobicContact CB-CG 4.42Å; F5-R314 WeakPolarHBondContact O-CA 3.19Å; T6-R314 HydrophobicContact CG2-CG 4.03Å; D282-R314 IonicContact OD1-NH1 3.69Å; D282-R314 PolarHBondContact OD1-NH1 3.13Å; D282-R314 IonicContact OD2-NH1 3.69Å; D282-R314 PolarHBondContact OD2-NH1 2.64Å; N283-R314 PolarHBondContact O-NH1 2.75Å; N283-R314 PolarHBondContact O-NH2 2.96Å; F284-R314 HydrophobicContact CE1-CB 4.47Å; F284-R314 HydrophobicContact CE1-CG 3.85Å; F284-R314 HydrophobicContact CE2-CB 4.43Å; F284-R314 HydrophobicContact CE2-CG 4.28Å; F284-R314 HydrophobicContact CZ-CB 3.72Å; F284-R314 VanDerWaalsContact CZ-CD 3.49Å; F284-R314 HydrophobicContact CZ-CG 3.51Å; C306-R314 PolarHBondContact N-O 2.63Å; C306-R314 PolarHBondContact O-N 3.4Å; E312-R314 IonicContact OE1-CZ 2.63Å; E312-R314 IonicContact OE1-NE 3.27Å; E312-R314 PolarHBondContact OE1-NE 3.01Å; E312-R314 IonicContact OE1-NH2 2.92Å; E312-R314 PolarHBondContact OE1-NH2 2.86Å; E312-R314 IonicContact OE2-NH2 3.01Å; R314-Y316 HydrophobicContact CB-CE2 3.82Å; R314-Y316 VanDerWaalsContact CD-OH 3.24Å; R314-Y316 WeakPolarHBondContact CD-OH 3.34Å
315	G	94.9	Very high	81.8	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	145.3	172.3	0	0	0	0	0	112.1	P3 I4 F5 L304	P3-G315 CarbonylContact C-O 3.6Å; P3-G315 WeakPolarHBondContact CA-O 3.46Å; I4-G315 VanDerWaalsContact CG1-C 3.45Å; I4-G315 WeakPolarHBondContact CG1-O 3.38Å; I4-G315 PolarHBondContact N-O 2.81Å; F5-G315 VanDerWaalsContact CE1-CA 3.46Å; F5-G315 VanDerWaalsContact CZ-CA 3.5Å; F5-G315 PolarHBondContact O-N 3.01Å; L304-G315 CarbonylContact O-C 3.57Å; L304-G315 VanDerWaalsContact O-CA 3.28Å; L304-G315 WeakPolarHBondContact O-CA 3.48Å
316	Y	94.1	Very high	79.1	Confident	1 Å²	1	49 Å²	49	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.1	176	-50.9	-96.7	0	0	0	109.5	P3 F280 D282 Q303 L304 C306 R314	P3-Y316 HydrophobicContact CB-CD1 4.4Å; P3-Y316 HydrophobicContact CB-CE1 3.95Å; F280-Y316 HydrophobicContact CE1-CE1 4.41Å; F280-Y316 HydrophobicContact CZ-CD1 4.06Å; F280-Y316 AromaticContact CZ-CE1 3.88Å; F280-Y316 HydrophobicContact CZ-CE1 3.88Å; D282-Y316 PolarHBondContact OD2-OH 2.78Å; Q303-Y316 CarbonylContact C-O 3.54Å; Q303-Y316 WeakPolarHBondContact CA-O 3.43Å; L304-Y316 HydrophobicContact CD2-CD2 4.41Å; L304-Y316 PolarHBondContact N-O 3.08Å; L304-Y316 PolarHBondContact O-N 3.17Å; C306-Y316 HydrophobicContact CB-CE2 4.19Å; R314-Y316 HydrophobicContact CB-CE2 3.82Å; R314-Y316 VanDerWaalsContact CD-OH 3.24Å; R314-Y316 WeakPolarHBondContact CD-OH 3.34Å
317	L	91.3	Very high	76.6	Confident	34 Å²	34	51.8 Å²	51.8	18%	0.178	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-94.8	154	166.7	-82.8	175.4	0	0	0	110.4	I4 Q301 Q303	I4-L317 HydrophobicContact CD1-CG 3.95Å; I4-L317 HydrophobicContact CG2-CB 4.26Å; I4-L317 HydrophobicContact CG2-CD1 4.21Å; I4-L317 HydrophobicContact CG2-CG 4.18Å; Q301-L317 HydrophobicContact CB-CD2 3.64Å; Q303-L317 HydrophobicContact CG-CD2 3.5Å; Q303-L317 VanDerWaalsContact CG-CD2 3.5Å; Q303-L317 HydrophobicContact CG-CG 4.14Å
318	P	86.1	Confident	74.1	Confident	39 Å²	39	57.6 Å²	57.6	25%	0.253	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-53.8	141.5	166	-22.4	32.9	0	0	0	111.1	F249 D250 L251 A253 S320	F249-P318 HydrophobicContact CE1-CG 3.87Å; F249-P318 HydrophobicContact CZ-CG 3.74Å; D250-P318 WeakPolarHBondContact O-CG 3.45Å; L251-P318 CarbonylContact O-C 3.49Å; L251-P318 VanDerWaalsContact O-CA 3.28Å; L251-P318 WeakPolarHBondContact O-CA 3.45Å; A253-P318 HydrophobicContact CB-CB 4.11Å; P318-S320 PolarHBondContact O-N 2.92Å
319	A	77	Confident	71.8	Confident	12 Å²	12	61.8 Å²	61.8	10%	0.099	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-60.2	121.9	175.5	0	0	0	0	0	110.3	M1 L251 A253 L327	M1-A319 HydrophobicContact CG-CB 4.41Å; M1-A319 HydrophobicContact SD-CB 3.93Å; L251-A319 PolarHBondContact O-N 2.86Å; A253-A319 WeakPolarHBondContact CB-O 3.44Å; A319-L327 HydrophobicContact CB-CD1 3.62Å
320	S	64.3	Low	69.6	Low	54 Å²	54	63.5 Å²	63.5	38%	0.378	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-68.3	150.9	176.4	70.1	0	0	0	0	111.3	P318 D322 L323 K324	P318-S320 PolarHBondContact O-N 2.92Å; S320-D322 PolarHBondContact O-N 2.7Å; S320-D322 VanDerWaalsContact O-N 3.15Å; S320-L323 PolarHBondContact O-N 2.84Å; S320-L323 WeakPolarHBondContact OG-CD1 3.48Å; S320-K324 PolarHBondContact O-N 2.9Å
321	K	55.7	Low	67.8	Low	159 Å²	159	64.3 Å²	64.3	69%	0.691	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-56.8	-29.4	179.7	-70.7	-177.6	-179.6	177.3	0	113.2	K324	K321-K324 VanDerWaalsContact O-CB 3.31Å; K321-K324 WeakPolarHBondContact O-CB 3.42Å; K321-K324 PolarHBondContact O-N 2.73Å
322	D	50.5	Low	66.1	Low	153 Å²	153	66.8 Å²	66.8	82%	0.818	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-75.3	-28.2	177.9	-62.8	-37.3	0	0	0	112.9	S320 K324	S320-D322 PolarHBondContact O-N 2.7Å; S320-D322 VanDerWaalsContact O-N 3.15Å; D322-K324 VanDerWaalsContact C-N 3.28Å
323	L	51.9	Low	64.4	Low	84 Å²	84	69.9 Å²	69.9	44%	0.44	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-77.4	-11.9	172.3	-95.2	139.6	0	0	0	111.9	S320 G325 N326 L327	S320-L323 PolarHBondContact O-N 2.84Å; S320-L323 WeakPolarHBondContact OG-CD1 3.48Å; L323-G325 PolarHBondContact O-N 2.89Å; L323-N326 CarbonylContact O-C 3.56Å; L323-N326 PolarHBondContact O-N 2.85Å; L323-L327 HydrophobicContact CB-CD1 3.49Å; L323-L327 VanDerWaalsContact CB-CD1 3.49Å; L323-L327 HydrophobicContact CB-CG 3.84Å; L323-L327 HydrophobicContact CD2-CD1 3.82Å; L323-L327 HydrophobicContact CD2-CD2 4.04Å; L323-L327 HydrophobicContact CD2-CG 3.58Å; L323-L327 HydrophobicContact CG-CD1 4.18Å; L323-L327 HydrophobicContact CG-CG 4.33Å; L323-L327 WeakPolarHBondContact O-CA 3.29Å; L323-L327 WeakPolarHBondContact O-CB 3.45Å; L323-L327 WeakPolarHBondContact O-CG 3.44Å; L323-L327 PolarHBondContact O-N 3.37Å
324	K	46.2	Very low	63	Low	96 Å²	96	75.6 Å²	75.6	42%	0.417	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-58.1	-28.3	173.8	-74.1	-174.4	172.2	-177.7	0	113.2	N252 S320 K321 D322	N252-K324 WeakPolarHBondContact O-CE 3.25Å; S320-K324 PolarHBondContact O-N 2.9Å; K321-K324 VanDerWaalsContact O-CB 3.31Å; K321-K324 WeakPolarHBondContact O-CB 3.42Å; K321-K324 PolarHBondContact O-N 2.73Å; D322-K324 VanDerWaalsContact C-N 3.28Å
325	G	43.7	Very low	61.8	Low	66 Å²	66	78 Å²	78	68%	0.68	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-76.8	-19	176	0	0	0	0	0	115	L323	L323-G325 PolarHBondContact O-N 2.89Å
326	N	41.5	Very low	60.7	Low	147 Å²	147	85 Å²	85	79%	0.786	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-5.5	-177.4	-82.4	-16.5	0	0	0	113.9	L323	L323-N326 CarbonylContact O-C 3.56Å; L323-N326 PolarHBondContact O-N 2.85Å
327	L	44.8	Very low	60.2	Low	59 Å²	59	90.2 Å²	90.2	31%	0.309	49%	0.485	S	S	.	.			trans	-105.1	-0.5	179	-78.2	177.9	0	0	0	113.9	M1 A319 L323 D329	M1-L327 HydrophobicContact CG-CD1 4.19Å; A319-L327 HydrophobicContact CB-CD1 3.62Å; L323-L327 HydrophobicContact CB-CD1 3.49Å; L323-L327 VanDerWaalsContact CB-CD1 3.49Å; L323-L327 HydrophobicContact CB-CG 3.84Å; L323-L327 HydrophobicContact CD2-CD1 3.82Å; L323-L327 HydrophobicContact CD2-CD2 4.04Å; L323-L327 HydrophobicContact CD2-CG 3.58Å; L323-L327 HydrophobicContact CG-CD1 4.18Å; L323-L327 HydrophobicContact CG-CG 4.33Å; L323-L327 WeakPolarHBondContact O-CA 3.29Å; L323-L327 WeakPolarHBondContact O-CB 3.45Å; L323-L327 WeakPolarHBondContact O-CG 3.44Å; L323-L327 PolarHBondContact O-N 3.37Å; L327-D329 PolarHBondContact O-N 3.39Å
328	M	44.4	Very low	59.9	Low	121 Å²	121	97.3 Å²	97.3	60%	0.596	51%	0.51	S	S	*	.	S	Bend	trans	-64.5	88.4	148.6	-81.7	176.5	164.9	0	0	105.1	S330 E333	M328-S330 PolarHBondContact O-N 3.3Å; M328-E333 HydrophobicContact CB-CG 4.2Å
329	D	49.4	Very low	59.9	Low	89 Å²	89	102.2 Å²	102.2	48%	0.476	53%	0.529	S	S	.	.			trans	-46.5	113.8	173.6	-166.2	-3.8	0	0	0	105.3	L327 N331 A332 E333	L327-D329 PolarHBondContact O-N 3.39Å; D329-N331 CarbonylContact O-C 3.36Å; D329-N331 PolarHBondContact O-N 3.48Å; D329-N331 PolarHBondContact OD1-ND2 2.86Å; D329-A332 HydrophobicContact CB-CB 4.1Å; D329-A332 PolarHBondContact O-N 2.83Å; D329-E333 PolarHBondContact O-N 3.08Å
330	S	50.1	Low	60.5	Low	81 Å²	81	107.3 Å²	107.3	57%	0.566	55%	0.554	S	S	*	*	H	α-helix	trans	-49.5	-25.7	178.6	-67.8	0	0	0	0	110.5	M328 Q334	M328-S330 PolarHBondContact O-N 3.3Å; S330-Q334 WeakPolarHBondContact O-CB 3.4Å; S330-Q334 WeakPolarHBondContact O-CG 3.21Å; S330-Q334 PolarHBondContact O-N 3.28Å
331	N	57.6	Low	61.8	Low	91 Å²	91	108.3 Å²	108.3	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-67.6	-42.7	171.6	-60.5	-45.1	0	0	0	114.4	D329 Q334 D335	D329-N331 CarbonylContact O-C 3.36Å; D329-N331 PolarHBondContact O-N 3.48Å; D329-N331 PolarHBondContact OD1-ND2 2.86Å; N331-Q334 PolarHBondContact O-N 2.75Å; N331-D335 WeakPolarHBondContact O-CB 3.4Å; N331-D335 PolarHBondContact O-N 3.23Å
332	A	56	Low	63.5	Low	51 Å²	51	105.8 Å²	105.8	42%	0.421	55%	0.552	S	S	.	*	H	α-helix	trans	-70.2	-38.5	179.7	0	0	0	0	0	112.1	D329 R336	D329-A332 HydrophobicContact CB-CB 4.1Å; D329-A332 PolarHBondContact O-N 2.83Å; A332-R336 WeakPolarHBondContact O-CB 3.46Å; A332-R336 PolarHBondContact O-N 3.22Å
333	E	60.9	Low	65.4	Low	93 Å²	93	106.7 Å²	106.7	44%	0.435	54%	0.543	S	S	.	.	H	α-helix	trans	-68.5	-42.5	170.8	-70.2	-161.1	143.2	0	0	111.6	M328 D329 D335 R336 I337	M328-E333 HydrophobicContact CB-CG 4.2Å; D329-E333 PolarHBondContact O-N 3.08Å; E333-D335 VanDerWaalsContact C-N 3.32Å; E333-D335 PolarHBondContact O-N 3.14Å; E333-R336 PolarHBondContact O-N 3.09Å; E333-I337 WeakPolarHBondContact O-CB 3.17Å; E333-I337 WeakPolarHBondContact O-CD1 3.49Å; E333-I337 WeakPolarHBondContact O-CG1 3.49Å; E333-I337 PolarHBondContact O-N 3.29Å
334	Q	66	Low	67.4	Low	119 Å²	119	111.2 Å²	111.2	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-62.3	-37.9	174	-80.9	177.1	2.2	0	0	112.5	S330 N331 I337 R338	S330-Q334 WeakPolarHBondContact O-CB 3.4Å; S330-Q334 WeakPolarHBondContact O-CG 3.21Å; S330-Q334 PolarHBondContact O-N 3.28Å; N331-Q334 PolarHBondContact O-N 2.75Å; Q334-I337 PolarHBondContact O-N 2.85Å; Q334-R338 WeakPolarHBondContact O-CB 3.29Å; Q334-R338 PolarHBondContact O-N 2.88Å
335	D	72.1	Confident	69.7	Low	90 Å²	90	110.6 Å²	110.6	48%	0.481	55%	0.553	S	S	.	*	H	α-helix	trans	-67.7	-43.1	176.6	-78.8	-22.7	0	0	0	110.6	N331 E333 R338 E339	N331-D335 WeakPolarHBondContact O-CB 3.4Å; N331-D335 PolarHBondContact O-N 3.23Å; E333-D335 VanDerWaalsContact C-N 3.32Å; E333-D335 PolarHBondContact O-N 3.14Å; D335-R338 CarbonylContact O-C 3.54Å; D335-R338 WeakPolarHBondContact O-CB 3.24Å; D335-R338 PolarHBondContact O-N 3.22Å; D335-E339 PolarHBondContact O-N 3.49Å
336	R	71.8	Confident	72.1	Confident	145 Å²	145	111.4 Å²	111.4	55%	0.547	54%	0.542	S	S	.	.	H	α-helix	trans	-61.1	-44.2	171.2	-84.5	-174.4	171	173.4	-1.2	112.1	E277 A332 E333 R338 E339 L340	E277-R336 IonicContact OE2-CZ 2.74Å; E277-R336 IonicContact OE2-NH2 3.9Å; E277-R336 PolarHBondContact OE2-NH2 2.86Å; A332-R336 WeakPolarHBondContact O-CB 3.46Å; A332-R336 PolarHBondContact O-N 3.22Å; E333-R336 PolarHBondContact O-N 3.09Å; R336-R338 VanDerWaalsContact C-N 3.28Å; R336-R338 PolarHBondContact O-N 2.94Å; R336-E339 PolarHBondContact O-N 3.13Å; R336-L340 WeakPolarHBondContact O-CB 3.5Å; R336-L340 VanDerWaalsContact O-CG 3.28Å; R336-L340 WeakPolarHBondContact O-CG 3.33Å; R336-L340 PolarHBondContact O-N 3.42Å
337	I	82.1	Confident	74.6	Confident	112 Å²	112	109 Å²	109	57%	0.574	53%	0.529	S	S	*	.	H	α-helix	trans	-61.4	-40.4	175.7	-70.4	163.9	0	0	0	110.1	E333 Q334 L340 S341	E333-I337 WeakPolarHBondContact O-CB 3.17Å; E333-I337 WeakPolarHBondContact O-CD1 3.49Å; E333-I337 WeakPolarHBondContact O-CG1 3.49Å; E333-I337 PolarHBondContact O-N 3.29Å; Q334-I337 PolarHBondContact O-N 2.85Å; I337-L340 PolarHBondContact O-N 3.09Å; I337-S341 VanDerWaalsContact O-CB 3.23Å; I337-S341 WeakPolarHBondContact O-CB 3.31Å; I337-S341 PolarHBondContact O-N 3.1Å
338	R	86.3	Confident	76.9	Confident	183 Å²	183	109.5 Å²	109.5	69%	0.691	53%	0.531	S	S	*	.	H	α-helix	trans	-66.8	-44.5	177.4	-175.2	-179.4	179.1	-175.6	0.3	111.7	Q334 D335 R336 S341 Q342	Q334-R338 WeakPolarHBondContact O-CB 3.29Å; Q334-R338 PolarHBondContact O-N 2.88Å; D335-R338 CarbonylContact O-C 3.54Å; D335-R338 WeakPolarHBondContact O-CB 3.24Å; D335-R338 PolarHBondContact O-N 3.22Å; R336-R338 VanDerWaalsContact C-N 3.28Å; R336-R338 PolarHBondContact O-N 2.94Å; R338-S341 PolarHBondContact O-N 3.42Å; R338-Q342 WeakPolarHBondContact O-CB 3.41Å; R338-Q342 PolarHBondContact O-N 2.78Å
339	E	85.2	Confident	79.2	Confident	142 Å²	142	107.2 Å²	107.2	66%	0.664	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-45.7	174.5	-80.6	-171.1	157.5	0	0	111.5	D335 R336 S341 Q342 R343	D335-E339 PolarHBondContact O-N 3.49Å; R336-E339 PolarHBondContact O-N 3.13Å; E339-S341 PolarHBondContact O-N 2.79Å; E339-Q342 PolarHBondContact O-N 2.83Å; E339-R343 WeakPolarHBondContact O-CB 3.24Å; E339-R343 PolarHBondContact O-N 2.83Å
340	L	89.4	Confident	81.3	Confident	118 Å²	118	107 Å²	107	62%	0.618	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-40.1	176.5	-72.2	171.8	0	0	0	111.8	R336 I337 R343 R344	R336-L340 WeakPolarHBondContact O-CB 3.5Å; R336-L340 VanDerWaalsContact O-CG 3.28Å; R336-L340 WeakPolarHBondContact O-CG 3.33Å; R336-L340 PolarHBondContact O-N 3.42Å; I337-L340 PolarHBondContact O-N 3.09Å; L340-R343 PolarHBondContact O-N 3.26Å; L340-R344 WeakPolarHBondContact O-CB 3.43Å; L340-R344 PolarHBondContact O-N 3Å
341	S	91.5	Very high	83.2	Confident	75 Å²	75	107.5 Å²	107.5	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-40.9	174.2	-174.1	0	0	0	0	111.6	I337 R338 E339 R344 Q345	I337-S341 VanDerWaalsContact O-CB 3.23Å; I337-S341 WeakPolarHBondContact O-CB 3.31Å; I337-S341 PolarHBondContact O-N 3.1Å; R338-S341 PolarHBondContact O-N 3.42Å; E339-S341 PolarHBondContact O-N 2.79Å; S341-R344 PolarHBondContact O-N 2.9Å; S341-Q345 WeakPolarHBondContact O-CB 3.32Å; S341-Q345 PolarHBondContact O-N 3.42Å
342	Q	92.3	Very high	84.8	Confident	106 Å²	106	109.6 Å²	109.6	50%	0.495	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-42.6	174.9	-172.4	63.8	42.7	0	0	110.9	R338 E339 Q345 N346	R338-Q342 WeakPolarHBondContact O-CB 3.41Å; R338-Q342 PolarHBondContact O-N 2.78Å; E339-Q342 PolarHBondContact O-N 2.83Å; Q342-Q345 PolarHBondContact O-N 3.24Å; Q342-N346 PolarHBondContact NE2-OD1 3.41Å; Q342-N346 VanDerWaalsContact NE2-OD1 3.16Å; Q342-N346 PolarHBondContact O-N 3.48Å; Q342-N346 PolarHBondContact O-OD1 3.02Å
343	R	91.3	Very high	86.3	Confident	172 Å²	172	111.4 Å²	111.4	65%	0.649	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-42.5	176.1	-169.2	170.7	-175.7	167.6	0.8	111.5	E339 L340 Q345 N346 L347	E339-R343 WeakPolarHBondContact O-CB 3.24Å; E339-R343 PolarHBondContact O-N 2.83Å; L340-R343 PolarHBondContact O-N 3.26Å; R343-Q345 VanDerWaalsContact C-N 3.34Å; R343-Q345 PolarHBondContact O-N 2.93Å; R343-N346 PolarHBondContact O-N 3.11Å; R343-L347 HydrophobicContact CG-CD1 4.45Å; R343-L347 WeakPolarHBondContact O-CG 3.22Å; R343-L347 PolarHBondContact O-N 3.34Å
344	R	93.4	Very high	87.5	Confident	179 Å²	179	114.1 Å²	114.1	68%	0.675	52%	0.524	S	S	*	.	H	α-helix	trans	-58.7	-45.4	172.2	178.9	-175.6	172.4	-175.2	-1.3	111.3	L340 S341 L347 L348	L340-R344 WeakPolarHBondContact O-CB 3.43Å; L340-R344 PolarHBondContact O-N 3Å; S341-R344 PolarHBondContact O-N 2.9Å; R344-L347 PolarHBondContact O-N 3.32Å; R344-L348 HydrophobicContact CG-CD1 4.14Å; R344-L348 WeakPolarHBondContact O-CG 3.44Å; R344-L348 PolarHBondContact O-N 2.92Å
345	Q	93.9	Very high	88.6	Confident	83 Å²	83	113 Å²	113	39%	0.388	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-41.3	178.3	-175.4	63.9	12.1	0	0	111.8	S341 Q342 R343 L348 L349	S341-Q345 WeakPolarHBondContact O-CB 3.32Å; S341-Q345 PolarHBondContact O-N 3.42Å; Q342-Q345 PolarHBondContact O-N 3.24Å; R343-Q345 VanDerWaalsContact C-N 3.34Å; R343-Q345 PolarHBondContact O-N 2.93Å; Q345-L348 PolarHBondContact O-N 3.48Å; Q345-L349 WeakPolarHBondContact O-CG 3.23Å; Q345-L349 PolarHBondContact O-N 3.31Å
346	N	93.5	Very high	89.1	Confident	84 Å²	84	115 Å²	115	45%	0.449	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-44.1	176.2	-66.7	-7.8	0	0	0	111.5	Q342 R343 L348 L349 E350	Q342-N346 PolarHBondContact NE2-OD1 3.41Å; Q342-N346 VanDerWaalsContact NE2-OD1 3.16Å; Q342-N346 PolarHBondContact O-N 3.48Å; Q342-N346 PolarHBondContact O-OD1 3.02Å; R343-N346 PolarHBondContact O-N 3.11Å; N346-L348 VanDerWaalsContact C-N 3.34Å; N346-L348 PolarHBondContact O-N 3.37Å; N346-L349 WeakPolarHBondContact O-CB 3.4Å; N346-L349 PolarHBondContact O-N 3.04Å; N346-E350 PolarHBondContact O-N 3.44Å
347	L	94.1	Very high	89.4	Confident	96 Å²	96	113.3 Å²	113.3	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-64.6	-36.9	176.3	-70.4	169.5	0	0	0	112.4	R343 R344 L349 E350 L351	R343-L347 HydrophobicContact CG-CD1 4.45Å; R343-L347 WeakPolarHBondContact O-CG 3.22Å; R343-L347 PolarHBondContact O-N 3.34Å; R344-L347 PolarHBondContact O-N 3.32Å; L347-L349 VanDerWaalsContact C-N 3.35Å; L347-E350 PolarHBondContact O-N 3.28Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 PolarHBondContact O-N 3.39Å
348	L	94	Very high	89.1	Confident	69 Å²	69	112.2 Å²	112.2	36%	0.361	54%	0.535	S	S	.	.	H	α-helix	trans	-66.6	-36.2	174.2	-75.5	169	0	0	0	112.2	R344 Q345 N346 R352	R344-L348 HydrophobicContact CG-CD1 4.14Å; R344-L348 WeakPolarHBondContact O-CG 3.44Å; R344-L348 PolarHBondContact O-N 2.92Å; Q345-L348 PolarHBondContact O-N 3.48Å; N346-L348 VanDerWaalsContact C-N 3.34Å; N346-L348 PolarHBondContact O-N 3.37Å; L348-R352 WeakPolarHBondContact O-CG 3.39Å; L348-R352 PolarHBondContact O-N 2.72Å; L348-R352 VanDerWaalsContact O-N 3.1Å
349	L	92.9	Very high	88.5	Confident	73 Å²	73	111.3 Å²	111.3	38%	0.382	54%	0.536	S	S	.	.	H	α-helix	trans	-67.4	-42.9	173.4	-72.3	168.8	0	0	0	111.3	Q345 N346 L347 L351 R352 N353	Q345-L349 WeakPolarHBondContact O-CG 3.23Å; Q345-L349 PolarHBondContact O-N 3.31Å; N346-L349 WeakPolarHBondContact O-CB 3.4Å; N346-L349 PolarHBondContact O-N 3.04Å; L347-L349 VanDerWaalsContact C-N 3.35Å; L349-L351 VanDerWaalsContact C-N 3.33Å; L349-L351 PolarHBondContact O-N 3.31Å; L349-R352 PolarHBondContact O-N 2.74Å; L349-N353 PolarHBondContact O-N 3.02Å; L349-N353 PolarHBondContact O-ND2 3.4Å; L349-N353 PolarHBondContact O-OD1 3.23Å
350	E	91.9	Very high	87.2	Confident	86 Å²	86	106.9 Å²	106.9	40%	0.402	53%	0.529	S	S	.	.	H	α-helix	trans	-59.7	-43.4	175.6	-173.1	177.1	-172.6	0	0	111.7	N346 L347 R352 N353 Y354	N346-E350 PolarHBondContact O-N 3.44Å; L347-E350 PolarHBondContact O-N 3.28Å; E350-R352 PolarHBondContact O-N 3.43Å; E350-N353 WeakPolarHBondContact O-CB 3.36Å; E350-N353 PolarHBondContact O-N 3.47Å; E350-Y354 HydrophobicContact CG-CD2 4.21Å; E350-Y354 HydrophobicContact CG-CE2 3.55Å; E350-Y354 VanDerWaalsContact O-CD2 3.32Å; E350-Y354 WeakPolarHBondContact O-CD2 3.47Å; E350-Y354 PolarHBondContact O-N 2.94Å; E350-Y354 PolarHBondContact OE1-OH 3.36Å
351	L	91.6	Very high	85.6	Confident	90 Å²	90	105.7 Å²	105.7	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-43.4	175.6	-168.4	151.8	0	0	0	112	L347 L349 N353 Y354 E355	L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 PolarHBondContact O-N 3.39Å; L349-L351 VanDerWaalsContact C-N 3.33Å; L349-L351 PolarHBondContact O-N 3.31Å; L351-N353 VanDerWaalsContact C-N 3.31Å; L351-N353 PolarHBondContact O-N 3.25Å; L351-Y354 PolarHBondContact O-N 3.3Å; L351-E355 HydrophobicContact CD2-CG 3.99Å; L351-E355 WeakPolarHBondContact CD2-OE1 3Å; L351-E355 WeakPolarHBondContact O-CG 3.42Å; L351-E355 PolarHBondContact O-N 2.9Å
352	R	91.1	Very high	83.6	Confident	135 Å²	135	106.5 Å²	106.5	51%	0.509	53%	0.531	S	S	.	.	H	α-helix	trans	-59.7	-41.7	173.8	-74.5	-176.5	-154	173.9	5	112	L348 L349 E350 Y354 E355 E356	L348-R352 WeakPolarHBondContact O-CG 3.39Å; L348-R352 PolarHBondContact O-N 2.72Å; L348-R352 VanDerWaalsContact O-N 3.1Å; L349-R352 PolarHBondContact O-N 2.74Å; E350-R352 PolarHBondContact O-N 3.43Å; R352-Y354 VanDerWaalsContact C-N 3.3Å; R352-Y354 PolarHBondContact O-N 3.33Å; R352-E355 PolarHBondContact O-N 3.46Å; R352-E356 WeakPolarHBondContact O-CG 3.35Å; R352-E356 PolarHBondContact O-N 3.37Å
353	N	87.1	Confident	81.5	Confident	89 Å²	89	110.7 Å²	110.7	48%	0.476	55%	0.551	S	S	.	*	H	α-helix	trans	-60.9	-41.1	177.8	-64	-15.9	0	0	0	111.1	L349 E350 L351 N357	L349-N353 PolarHBondContact O-N 3.02Å; L349-N353 PolarHBondContact O-ND2 3.4Å; L349-N353 PolarHBondContact O-OD1 3.23Å; E350-N353 WeakPolarHBondContact O-CB 3.36Å; E350-N353 PolarHBondContact O-N 3.47Å; L351-N353 VanDerWaalsContact C-N 3.31Å; L351-N353 PolarHBondContact O-N 3.25Å; N353-N357 WeakPolarHBondContact O-CB 3.31Å; N353-N357 PolarHBondContact O-N 2.92Å; N353-N357 PolarHBondContact O-ND2 2.7Å
354	Y	86.2	Confident	79.1	Confident	150 Å²	150	108.2 Å²	108.2	59%	0.588	56%	0.555	S	S	*	*	H	α-helix	trans	-67	-40.6	175.4	-65.5	-42.7	0	0	0	113	E350 L351 R352 N357 A358	E350-Y354 HydrophobicContact CG-CD2 4.21Å; E350-Y354 HydrophobicContact CG-CE2 3.55Å; E350-Y354 VanDerWaalsContact O-CD2 3.32Å; E350-Y354 WeakPolarHBondContact O-CD2 3.47Å; E350-Y354 PolarHBondContact O-N 2.94Å; E350-Y354 PolarHBondContact OE1-OH 3.36Å; L351-Y354 PolarHBondContact O-N 3.3Å; R352-Y354 VanDerWaalsContact C-N 3.3Å; R352-Y354 PolarHBondContact O-N 3.33Å; Y354-N357 PolarHBondContact O-N 2.96Å; Y354-A358 WeakPolarHBondContact O-CB 3.15Å; Y354-A358 PolarHBondContact O-N 3.1Å
355	E	88.4	Confident	76.9	Confident	97 Å²	97	104.7 Å²	104.7	45%	0.453	55%	0.55	S	S	.	.	H	α-helix	trans	-65.2	-39.6	176.3	-72.6	-176.6	170.9	0	0	112.8	L351 R352 A358 K359	L351-E355 HydrophobicContact CD2-CG 3.99Å; L351-E355 WeakPolarHBondContact CD2-OE1 3Å; L351-E355 WeakPolarHBondContact O-CG 3.42Å; L351-E355 PolarHBondContact O-N 2.9Å; R352-E355 PolarHBondContact O-N 3.46Å; E355-A358 PolarHBondContact O-N 3.12Å; E355-K359 WeakPolarHBondContact O-CG 3.38Å; E355-K359 PolarHBondContact O-N 3.01Å
356	E	83.1	Confident	74.6	Confident	132 Å²	132	106.4 Å²	106.4	62%	0.617	57%	0.571	S	S	*	*	H	α-helix	trans	-66.2	-42.5	175.5	-75.9	-174.6	174.8	0	0	111.6	R352 A358 K359	R352-E356 WeakPolarHBondContact O-CG 3.35Å; R352-E356 PolarHBondContact O-N 3.37Å; E356-A358 VanDerWaalsContact C-N 3.3Å; E356-A358 PolarHBondContact O-N 3.25Å; E356-K359 PolarHBondContact O-N 3.4Å
357	N	78.8	Confident	72.5	Confident	109 Å²	109	104.7 Å²	104.7	58%	0.583	57%	0.573	S	S	*	*	H	α-helix	trans	-62.9	-35.4	176.1	-72.6	-21.4	0	0	0	112.5	N353 Y354 G360	N353-N357 WeakPolarHBondContact O-CB 3.31Å; N353-N357 PolarHBondContact O-N 2.92Å; N353-N357 PolarHBondContact O-ND2 2.7Å; Y354-N357 PolarHBondContact O-N 2.96Å; N357-G360 PolarHBondContact O-N 3.5Å
358	A	75.8	Confident	70.9	Confident	89 Å²	89	104.5 Å²	104.5	74%	0.736	57%	0.571	S	S	*	*	H	α-helix	trans	-72.5	-26	178.4	0	0	0	0	0	113.8	Y354 E355 E356 G360	Y354-A358 WeakPolarHBondContact O-CB 3.15Å; Y354-A358 PolarHBondContact O-N 3.1Å; E355-A358 PolarHBondContact O-N 3.12Å; E356-A358 VanDerWaalsContact C-N 3.3Å; E356-A358 PolarHBondContact O-N 3.25Å; A358-G360 PolarHBondContact O-N 3.21Å
359	K	72.4	Confident	69.6	Low	164 Å²	164	101.6 Å²	101.6	71%	0.713	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-4.1	178.3	-73.5	169.2	-174.5	166.3	0	113.6	E355 E356	E355-K359 WeakPolarHBondContact O-CG 3.38Å; E355-K359 PolarHBondContact O-N 3.01Å; E356-K359 PolarHBondContact O-N 3.4Å
360	G	57.5	Low	69	Low	49 Å²	49	102.8 Å²	102.8	51%	0.505	57%	0.569	S	S	.	*			trans	82.9	126.6	178.6	0	0	0	0	0	112.2	N357 A358 S362	N357-G360 PolarHBondContact O-N 3.5Å; A358-G360 PolarHBondContact O-N 3.21Å; G360-S362 PolarHBondContact O-N 3.42Å
361	V	57.4	Low	68.6	Low	93 Å²	93	100 Å²	100	56%	0.564	56%	0.556	S	S	*	*			trans	-76.2	110.9	179.2	-177.1	0	0	0	0	109.4	Q363	V361-Q363 PolarHBondContact O-N 3.45Å
362	S	49.4	Very low	68.3	Low	91 Å²	91	98.6 Å²	98.6	64%	0.636	55%	0.553	S	S	*	*			trans	-60.6	126.3	167	-63.5	0	0	0	0	109.6	G360 T364	G360-S362 PolarHBondContact O-N 3.42Å; S362-T364 PolarHBondContact O-N 3.05Å
363	Q	46.6	Very low	68	Low	195 Å²	195	97.5 Å²	97.5	91%	0.911	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	9.5	-173.5	-72	-176.7	-12.5	0	0	116.3	V361	V361-Q363 PolarHBondContact O-N 3.45Å
364	T	42.5	Very low	68	Low	119 Å²	119	98.3 Å²	98.3	73%	0.73	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-6.6	-172.2	43.6	0	0	0	0	115.3	S362	S362-T364 PolarHBondContact O-N 3.05Å
365	N	46.6	Very low	68.1	Low	106 Å²	106	91.5 Å²	91.5	57%	0.567	55%	0.55	S	S	*	*			trans	-116.8	64.7	179.9	-81.8	-9.8	0	0	0	112.9	G367 I368	N365-G367 PolarHBondContact O-N 3.2Å; N365-I368 HydrophobicContact CB-CD1 3.71Å; N365-I368 HydrophobicContact CB-CG1 4.12Å; N365-I368 PolarHBondContact O-N 2.82Å
366	S	45.8	Very low	68.2	Low	119 Å²	119	93.1 Å²	93.1	83%	0.832	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	1.5	176.1	56.3	0	0	0	0	115.4
367	G	50.1	Low	68.5	Low	48 Å²	48	87.9 Å²	87.9	50%	0.495	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-9.8	173.5	0	0	0	0	0	114.5	N365	N365-G367 PolarHBondContact O-N 3.2Å
368	I	59	Low	69.2	Low	91 Å²	91	87.8 Å²	87.8	47%	0.467	53%	0.53	S	S	.	.	S	Bend	trans	-88.9	126.5	175.5	-57.9	175.1	0	0	0	106.6	N365 V370	N365-I368 HydrophobicContact CB-CD1 3.71Å; N365-I368 HydrophobicContact CB-CG1 4.12Å; N365-I368 PolarHBondContact O-N 2.82Å; I368-V370 HydrophobicContact CG2-CG2 4.46Å; I368-V370 PolarHBondContact O-N 3.13Å
369	G	67.3	Low	70	Confident	9 Å²	9	84.7 Å²	84.7	9%	0.093	50%	0.502	C	S	.	.			trans	-67.7	56	-170.3	0	0	0	0	0	116.1	I371 S460 H464	G369-I371 PolarHBondContact O-N 3.44Å; G369-S460 WeakPolarHBondContact CA-OG 3.28Å; G369-H464 PolarHBondContact O-CD2 2.95Å; G369-H464 PolarHBondContact O-NE2 3.39Å
370	V	80.3	Confident	71	Confident	98 Å²	98	82.2 Å²	82.2	59%	0.594	50%	0.495	S	S	*	.			trans	-68.3	126.9	177.2	-177.6	0	0	0	0	109.6	I368	I368-V370 HydrophobicContact CG2-CG2 4.46Å; I368-V370 PolarHBondContact O-N 3.13Å
371	I	84.5	Confident	72.6	Confident	27 Å²	27	81.9 Å²	81.9	14%	0.138	48%	0.481	C	S	.	.			trans	-114.4	156	173.9	63.2	172.5	0	0	0	110.8	G369 A373 T404 H464 F466	G369-I371 PolarHBondContact O-N 3.44Å; I371-A373 PolarHBondContact O-N 2.86Å; I371-T404 HydrophobicContact CB-CG2 4.37Å; I371-T404 HydrophobicContact CG2-CG2 4.26Å; I371-H464 HydrophobicContact CD1-CB 3.73Å; I371-H464 VanDerWaalsContact CD1-CG 3.49Å; I371-F466 HydrophobicContact CD1-CE2 3.62Å; I371-F466 HydrophobicContact CD1-CZ 3.77Å
372	P	85.2	Confident	74.2	Confident	61 Å²	61	78.5 Å²	78.5	40%	0.396	46%	0.461	S	S	.	.			trans	-58.9	133	171.2	-23.1	33.6	0	0	0	111.4	N374 T375	P372-N374 VanDerWaalsContact CB-OD1 3.26Å; P372-N374 WeakPolarHBondContact CB-OD1 3.17Å; P372-N374 PolarHBondContact O-N 2.94Å; P372-N374 VanDerWaalsContact O-N 3.16Å; P372-T375 VanDerWaalsContact O-CB 3.26Å; P372-T375 WeakPolarHBondContact O-CB 3.45Å; P372-T375 PolarHBondContact O-N 3.29Å; P372-T375 PolarHBondContact O-OG1 3.01Å
373	A	83.8	Confident	76.1	Confident	112 Å²	112	75 Å²	75	93%	0.926	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.8	-178.2	0	0	0	0	0	114.3	I371 T375	I371-A373 PolarHBondContact O-N 2.86Å; A373-T375 VanDerWaalsContact C-N 3.29Å
374	N	86.9	Confident	78.1	Confident	105 Å²	105	70.8 Å²	70.8	56%	0.561	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	7.5	175.5	70.1	-28.3	0	0	0	113.2	P372 Q376 N402	P372-N374 VanDerWaalsContact CB-OD1 3.26Å; P372-N374 WeakPolarHBondContact CB-OD1 3.17Å; P372-N374 PolarHBondContact O-N 2.94Å; P372-N374 VanDerWaalsContact O-N 3.16Å; N374-Q376 PolarHBondContact O-N 3.06Å; N374-N402 PolarHBondContact OD1-ND2 3.42Å
375	T	88.9	Confident	80	Confident	7 Å²	7	67.5 Å²	67.5	4%	0.043	40%	0.397	C	S	.	.			trans	-67.5	121.6	177.5	-54.1	0	0	0	0	109.1	P372 A373 T400 N402 T404 V455 F466	P372-T375 VanDerWaalsContact O-CB 3.26Å; P372-T375 WeakPolarHBondContact O-CB 3.45Å; P372-T375 PolarHBondContact O-N 3.29Å; P372-T375 PolarHBondContact O-OG1 3.01Å; A373-T375 VanDerWaalsContact C-N 3.29Å; T375-T400 HydrophobicContact CG2-CG2 4.23Å; T375-N402 PolarHBondContact OG1-ND2 2.84Å; T375-T404 HydrophobicContact CG2-CG2 4.23Å; T375-V455 HydrophobicContact CG2-CG1 4.13Å; T375-F466 HydrophobicContact CG2-CZ 4.42Å; T375-F466 WeakPolarHBondContact O-CE1 3.46Å
376	Q	89.8	Confident	81.6	Confident	131 Å²	131	65.9 Å²	65.9	61%	0.612	40%	0.398	S	S	*	.			trans	-123.3	151.4	177.3	-66.6	-178.4	-2.1	0	0	109.9	N374 P401	N374-Q376 PolarHBondContact O-N 3.06Å; Q376-P401 WeakPolarHBondContact O-CD 3.16Å
377	L	91	Very high	83.2	Confident	23 Å²	23	64.5 Å²	64.5	12%	0.12	39%	0.385	C	S	.	.			trans	-92.2	117.6	174.3	-154.8	96.3	0	0	0	109.2	T379 I398 A453 V455 F466 I468	L377-T379 HydrophobicContact CD2-CG2 3.81Å; L377-I398 HydrophobicContact CD1-CG2 3.67Å; L377-I398 HydrophobicContact CD2-CG2 3.57Å; L377-I398 HydrophobicContact CG-CG2 3.61Å; L377-A453 HydrophobicContact CD1-CB 3.54Å; L377-A453 HydrophobicContact CD2-CB 4.24Å; L377-V455 HydrophobicContact CD1-CG2 4.22Å; L377-F466 HydrophobicContact CD1-CB 4.33Å; L377-I468 HydrophobicContact CD2-CB 4.35Å; L377-I468 HydrophobicContact CD2-CG2 3.5Å; L377-I468 VanDerWaalsContact CD2-CG2 3.5Å
378	Q	92.6	Very high	84.3	Confident	106 Å²	106	72.5 Å²	72.5	50%	0.495	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.9	171.7	-67.5	-179.4	-11.6	0	0	108.9	I398 S399	Q378-I398 CarbonylContact O-C 3.59Å; Q378-I398 WeakPolarHBondContact O-CA 3.11Å; Q378-S399 PolarHBondContact N-O 3.48Å; Q378-S399 PolarHBondContact O-N 3.2Å
379	T	93.1	Very high	85	Confident	24 Å²	24	72.7 Å²	72.7	15%	0.147	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.7	-178	58.3	0	0	0	0	109.9	L377 S397 I398 I468 R470	L377-T379 HydrophobicContact CD2-CG2 3.81Å; T379-S397 CarbonylContact C-O 3.59Å; T379-S397 WeakPolarHBondContact CA-O 3.33Å; T379-I398 HydrophobicContact CG2-CG1 4.21Å; T379-I398 HydrophobicContact CG2-CG2 4.38Å; T379-I468 HydrophobicContact CG2-CD1 4.13Å; T379-I468 HydrophobicContact CG2-CG2 4.24Å; T379-R470 VanDerWaalsContact OG1-CZ 3.27Å; T379-R470 PolarHBondContact OG1-NE 2.81Å; T379-R470 PolarHBondContact OG1-NH2 2.78Å; T379-R470 VanDerWaalsContact OG1-NH2 3.09Å
380	M	92.3	Very high	85.5	Confident	112 Å²	112	77.4 Å²	77.4	55%	0.552	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.8	177.5	-172.3	176.1	75.2	0	0	109.4	S397	M380-S397 PolarHBondContact N-O 2.81Å; M380-S397 PolarHBondContact O-N 2.98Å
381	L	92.3	Very high	85.6	Confident	42 Å²	42	80.8 Å²	80.8	22%	0.22	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.7	173.6	-71.9	167.3	0	0	0	108.1	V394 E395 L396 L472 L512	L381-V394 HydrophobicContact CD2-CG1 4.04Å; L381-E395 WeakPolarHBondContact CA-O 3.43Å; L381-L396 HydrophobicContact CD2-CB 3.96Å; L381-L396 HydrophobicContact CD2-CD1 3.7Å; L381-L396 HydrophobicContact CD2-CG 4.38Å; L381-L396 HydrophobicContact CG-CD1 4.22Å; L381-L472 HydrophobicContact CD1-CD2 3.95Å; L381-L472 HydrophobicContact CD2-CD2 3.79Å; L381-L472 HydrophobicContact CG-CD2 4.48Å; L381-L512 HydrophobicContact CB-CD2 4.2Å
382	S	90.1	Very high	85.7	Confident	22 Å²	22	80 Å²	80	15%	0.154	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	145.6	176.3	56.4	0	0	0	0	110.7	E395	S382-E395 PolarHBondContact N-O 3.05Å; S382-E395 PolarHBondContact O-N 2.86Å
383	V	89.4	Confident	86	Confident	18 Å²	18	77.6 Å²	77.6	11%	0.109	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.7	174.7	170.7	0	0	0	0	110.1	E479 L512 L527	V383-E479 HydrophobicContact CG1-CB 3.78Å; V383-E479 HydrophobicContact CG1-CG 4.04Å; V383-L512 HydrophobicContact CG2-CB 3.92Å; V383-L512 HydrophobicContact CG2-CD1 4.19Å; V383-L527 HydrophobicContact CG1-CD1 3.31Å; V383-L527 HydrophobicContact CG1-CD2 4.23Å; V383-L527 HydrophobicContact CG1-CG 4.24Å
384	R	87.6	Confident	86.4	Confident	106 Å²	106	72.3 Å²	72.3	40%	0.4	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.2	175	-63.7	-63	-176.3	-148.5	-5.5	110.6	A392 H393 E395	R384-A392 WeakPolarHBondContact O-CA 3.49Å; R384-H393 PolarHBondContact N-O 3.01Å; R384-H393 PolarHBondContact O-N 2.91Å; R384-E395 HydrophobicContact CG-CB 3.69Å; R384-E395 IonicContact CZ-OE2 2.74Å; R384-E395 VanDerWaalsContact CZ-OE2 3.28Å; R384-E395 IonicContact NE-OE2 2.64Å; R384-E395 PolarHBondContact NE-OE2 2.79Å; R384-E395 IonicContact NH2-OE2 2.87Å; R384-E395 PolarHBondContact NH2-OE2 3.22Å
385	A	82.6	Confident	86.7	Confident	51 Å²	51	68.3 Å²	68.3	42%	0.421	37%	0.366	S	S	.	.			trans	-61.5	159	170.5	0	0	0	0	0	112.1
386	A	81.3	Confident	86.9	Confident	71 Å²	71	68 Å²	68	59%	0.587	36%	0.364	S	S	*	.			trans	-65.1	142	178.4	0	0	0	0	0	111.4	A392	A386-A392 HydrophobicContact CB-CB 4.06Å
387	T	80.1	Confident	87.1	Confident	90 Å²	90	62.6 Å²	62.6	55%	0.552	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-119.9	167.2	171.4	60.1	0	0	0	0	109.3	A389 Q390	T387-A389 PolarHBondContact O-N 2.97Å; T387-Q390 PolarHBondContact N-O 3.24Å; T387-Q390 PolarHBondContact O-N 3.03Å; T387-Q390 PolarHBondContact OG1-N 2.92Å; T387-Q390 PolarHBondContact OG1-O 2.82Å
388	E	72.5	Confident	87.3	Confident	216 Å²	216	61.5 Å²	61.5	100%	1.009	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.1	177.5	-68.2	-176.6	168	0	0	113.2
389	A	72.6	Confident	87.4	Confident	95 Å²	95	57.9 Å²	57.9	79%	0.785	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-21.8	-177.7	0	0	0	0	0	114.2	T387	T387-A389 PolarHBondContact O-N 2.97Å
390	Q	78.2	Confident	87.4	Confident	108 Å²	108	57.3 Å²	57.3	51%	0.505	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-144.8	136.6	-172.8	-75.5	-175.9	-20.9	0	0	112.2	T387	T387-Q390 PolarHBondContact N-O 3.24Å; T387-Q390 PolarHBondContact O-N 3.03Å; T387-Q390 PolarHBondContact OG1-N 2.92Å; T387-Q390 PolarHBondContact OG1-O 2.82Å
391	K	83.5	Confident	87.2	Confident	170 Å²	170	55.2 Å²	55.2	74%	0.739	31%	0.313	S	S	*	.			trans	-61	155.4	170.5	-64	-175.4	179.2	-177.1	0	110.6	H393 I440	K391-H393 PolarHBondContact O-ND1 2.9Å; K391-I440 HydrophobicContact CB-CD1 4.43Å
392	A	86.6	Confident	86.9	Confident	9 Å²	9	55.4 Å²	55.4	7%	0.074	31%	0.314	C	S	.	.			trans	-57.7	139.4	172.5	0	0	0	0	0	110.7	R384 A386 L527	R384-A392 WeakPolarHBondContact O-CA 3.49Å; A386-A392 HydrophobicContact CB-CB 4.06Å; A392-L527 HydrophobicContact CB-CB 3.72Å; A392-L527 HydrophobicContact CB-CD1 4.45Å; A392-L527 HydrophobicContact CB-CD2 3.9Å; A392-L527 HydrophobicContact CB-CG 4.2Å
393	H	90.6	Very high	86.6	Confident	12 Å²	12	64 Å²	64	6%	0.056	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	163.1	-172.7	60.5	-90.1	0	0	0	111.7	R384 K391 P438 I440	R384-H393 PolarHBondContact N-O 3.01Å; R384-H393 PolarHBondContact O-N 2.91Å; K391-H393 PolarHBondContact O-ND1 2.9Å; H393-P438 HydrophobicContact CB-CB 4.05Å; H393-P438 WeakPolarHBondContact CD2-CB 3.39Å; H393-I440 HydrophobicContact CB-CD1 4.28Å; H393-I440 HydrophobicContact CB-CG1 3.74Å
394	V	92	Very high	86.7	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.8	163.9	-178.1	0	0	0	0	108	L381 I439 L472 S476 M477 L512	L381-V394 HydrophobicContact CD2-CG1 4.04Å; V394-I439 PolarHBondContact N-O 3.18Å; V394-I439 PolarHBondContact O-N 2.83Å; V394-L472 HydrophobicContact CG1-CD2 3.91Å; V394-S476 VanDerWaalsContact CG2-O 3.28Å; V394-S476 WeakPolarHBondContact CG2-O 3.19Å; V394-M477 HydrophobicContact CG2-SD 3.78Å; V394-L512 HydrophobicContact CG1-CD1 3.65Å; V394-L512 HydrophobicContact CG2-CD1 4.1Å
395	E	93.1	Very high	86.9	Confident	22 Å²	22	59 Å²	59	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.1	176	-178.5	175.1	-114.5	0	0	109.7	L381 S382 R384 R436	L381-E395 WeakPolarHBondContact CA-O 3.43Å; S382-E395 PolarHBondContact N-O 3.05Å; S382-E395 PolarHBondContact O-N 2.86Å; R384-E395 HydrophobicContact CG-CB 3.69Å; R384-E395 IonicContact CZ-OE2 2.74Å; R384-E395 VanDerWaalsContact CZ-OE2 3.28Å; R384-E395 IonicContact NE-OE2 2.64Å; R384-E395 PolarHBondContact NE-OE2 2.79Å; R384-E395 IonicContact NH2-OE2 2.87Å; R384-E395 PolarHBondContact NH2-OE2 3.22Å; E395-R436 HydrophobicContact CG-CB 4.17Å; E395-R436 HydrophobicContact CG-CG 4.45Å; E395-R436 VanDerWaalsContact OE1-CD 3.31Å; E395-R436 WeakPolarHBondContact OE1-CD 3.47Å; E395-R436 IonicContact OE1-NE 2.74Å
396	L	94.4	Very high	87.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	107.8	166.6	173.4	65.7	0	0	0	108.7	L381 I398 I411 R436 V437 I439 L449 I451	L381-L396 HydrophobicContact CD2-CB 3.96Å; L381-L396 HydrophobicContact CD2-CD1 3.7Å; L381-L396 HydrophobicContact CD2-CG 4.38Å; L381-L396 HydrophobicContact CG-CD1 4.22Å; L396-I398 HydrophobicContact CD1-CG1 4.39Å; L396-I398 HydrophobicContact CD2-CD1 4.05Å; L396-I398 HydrophobicContact CD2-CG1 4.29Å; L396-I398 HydrophobicContact CG-CD1 4.27Å; L396-I398 HydrophobicContact CG-CG1 4Å; L396-I411 HydrophobicContact CD2-CD1 3.77Å; L396-R436 WeakPolarHBondContact O-CA 3.29Å; L396-V437 HydrophobicContact CB-CB 4.5Å; L396-V437 PolarHBondContact N-O 2.87Å; L396-V437 PolarHBondContact O-N 2.91Å; L396-I439 HydrophobicContact CB-CD1 3.82Å; L396-I439 HydrophobicContact CB-CG1 4.5Å; L396-I439 HydrophobicContact CD2-CD1 4.06Å; L396-L449 HydrophobicContact CD2-CD1 4.24Å; L396-I451 HydrophobicContact CD1-CD1 4.29Å; L396-I451 HydrophobicContact CD2-CD1 3.67Å; L396-I451 HydrophobicContact CD2-CG1 4.22Å
397	S	94.1	Very high	88	Confident	17 Å²	17	55.7 Å²	55.7	12%	0.119	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.9	173.2	-177.5	0	0	0	0	109.7	T379 M380	T379-S397 CarbonylContact C-O 3.59Å; T379-S397 WeakPolarHBondContact CA-O 3.33Å; M380-S397 PolarHBondContact N-O 2.81Å; M380-S397 PolarHBondContact O-N 2.98Å
398	I	94.9	Very high	88.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	120.2	177.3	-56.1	166	0	0	0	107.7	L377 Q378 T379 L396 I406 V409 C434 V435 I451	L377-I398 HydrophobicContact CD1-CG2 3.67Å; L377-I398 HydrophobicContact CD2-CG2 3.57Å; L377-I398 HydrophobicContact CG-CG2 3.61Å; Q378-I398 CarbonylContact O-C 3.59Å; Q378-I398 WeakPolarHBondContact O-CA 3.11Å; T379-I398 HydrophobicContact CG2-CG1 4.21Å; T379-I398 HydrophobicContact CG2-CG2 4.38Å; L396-I398 HydrophobicContact CD1-CG1 4.39Å; L396-I398 HydrophobicContact CD2-CD1 4.05Å; L396-I398 HydrophobicContact CD2-CG1 4.29Å; L396-I398 HydrophobicContact CG-CD1 4.27Å; L396-I398 HydrophobicContact CG-CG1 4Å; I398-I406 HydrophobicContact CB-CD1 4.38Å; I398-I406 HydrophobicContact CG2-CD1 3.9Å; I398-I406 WeakPolarHBondContact O-CD1 3.45Å; I398-V409 HydrophobicContact CD1-CB 4.39Å; I398-V409 HydrophobicContact CD1-CG1 3.49Å; I398-V409 VanDerWaalsContact CD1-CG1 3.49Å; I398-V409 HydrophobicContact CD1-CG2 4.05Å; I398-C434 CarbonylContact O-C 3.38Å; I398-C434 VanDerWaalsContact O-CA 3.29Å; I398-C434 WeakPolarHBondContact O-CA 3.07Å; I398-V435 PolarHBondContact N-O 3.25Å; I398-V435 PolarHBondContact O-N 2.84Å; I398-I451 HydrophobicContact CD1-CG2 3.76Å
399	S	94.4	Very high	89.7	Confident	30 Å²	30	41.5 Å²	41.5	21%	0.21	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	153.2	-177.3	57.8	0	0	0	0	113.2	Q378 G433	Q378-S399 PolarHBondContact N-O 3.48Å; Q378-S399 PolarHBondContact O-N 3.2Å; S399-G433 CarbonylContact C-O 3.53Å; S399-G433 VanDerWaalsContact CA-O 3.23Å; S399-G433 WeakPolarHBondContact CA-O 3.44Å
400	T	92.4	Very high	90.8	Very high	13 Å²	13	38.8 Å²	38.8	8%	0.08	19%	0.194	C	C	.	.			trans	-108.6	140.7	167.4	56.8	0	0	0	0	110	T375 N402 T404 I406 G433 V455	T375-T400 HydrophobicContact CG2-CG2 4.23Å; T400-N402 VanDerWaalsContact C-N 3.26Å; T400-N402 PolarHBondContact O-N 2.78Å; T400-T404 VanDerWaalsContact CB-OG1 3.26Å; T400-T404 WeakPolarHBondContact CB-OG1 3.35Å; T400-T404 PolarHBondContact OG1-O 2.9Å; T400-T404 VanDerWaalsContact OG1-O 3.12Å; T400-T404 PolarHBondContact OG1-OG1 3.34Å; T400-I406 HydrophobicContact CG2-CD1 4.44Å; T400-I406 HydrophobicContact CG2-CG1 4.16Å; T400-G433 PolarHBondContact N-O 3.5Å; T400-G433 PolarHBondContact OG1-O 3.47Å; T400-V455 HydrophobicContact CG2-CG1 3.99Å; T400-V455 HydrophobicContact CG2-CG2 4.2Å
401	P	87.8	Confident	91.6	Very high	68 Å²	68	33.6 Å²	33.6	44%	0.442	17%	0.17	S	C	.	.	S	Bend	trans	-74.7	-15.7	-177.5	28.6	-33.9	0	0	0	113.7	Q376	Q376-P401 WeakPolarHBondContact O-CD 3.16Å
402	N	86.6	Confident	92.1	Very high	45 Å²	45	28.4 Å²	28.4	24%	0.241	15%	0.148	C	C	.	.	S	Bend	trans	-107	178.4	-173.1	-58.1	1.6	0	0	0	110.8	N374 T375 T400 T404	N374-N402 PolarHBondContact OD1-ND2 3.42Å; T375-N402 PolarHBondContact OG1-ND2 2.84Å; T400-N402 VanDerWaalsContact C-N 3.26Å; T400-N402 PolarHBondContact O-N 2.78Å; N402-T404 PolarHBondContact O-N 2.91Å
403	E	84.4	Confident	92.2	Very high	203 Å²	203	28.1 Å²	28.1	95%	0.949	15%	0.145	S	C	*	.	S	Bend	trans	-68.2	8.1	176.6	-61.3	-168.1	165.5	0	0	115.1
404	T	90	Very high	91.7	Very high	11 Å²	11	31.3 Å²	31.3	7%	0.067	16%	0.16	C	C	.	.			trans	-67	150.3	173.8	49.5	0	0	0	0	111.2	I371 T375 T400 N402 G433 V455	I371-T404 HydrophobicContact CB-CG2 4.37Å; I371-T404 HydrophobicContact CG2-CG2 4.26Å; T375-T404 HydrophobicContact CG2-CG2 4.23Å; T400-T404 VanDerWaalsContact CB-OG1 3.26Å; T400-T404 WeakPolarHBondContact CB-OG1 3.35Å; T400-T404 PolarHBondContact OG1-O 2.9Å; T400-T404 VanDerWaalsContact OG1-O 3.12Å; T400-T404 PolarHBondContact OG1-OG1 3.34Å; N402-T404 PolarHBondContact O-N 2.91Å; T404-G433 VanDerWaalsContact O-CA 3.3Å; T404-G433 WeakPolarHBondContact O-CA 3.44Å; T404-V455 HydrophobicContact CG2-CG1 4.24Å
405	I	92.4	Very high	91	Very high	7 Å²	7	33.3 Å²	33.3	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	153.8	174.2	58.2	140.5	0	0	0	111	L431 V455 G456 R458	I405-L431 HydrophobicContact CD1-CB 4.31Å; I405-L431 HydrophobicContact CD1-CD1 4.11Å; I405-L431 HydrophobicContact CD1-CD2 3.82Å; I405-L431 HydrophobicContact CD1-CG 4.3Å; I405-V455 WeakPolarHBondContact O-CA 3.39Å; I405-G456 WeakPolarHBondContact CG1-O 3.43Å; I405-G456 PolarHBondContact N-O 3.09Å; I405-G456 PolarHBondContact O-N 3.08Å; I405-G456 VanDerWaalsContact O-N 3.09Å; I405-R458 HydrophobicContact CD1-CG 4.3Å; I405-R458 HydrophobicContact CG1-CG 4.38Å; I405-R458 HydrophobicContact CG2-CG 3.85Å
406	I	93.8	Very high	90.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110.8	168.1	-59.1	171.8	0	0	0	107.4	I398 T400 V409 S432 G433 V435 F454	I398-I406 HydrophobicContact CB-CD1 4.38Å; I398-I406 HydrophobicContact CG2-CD1 3.9Å; I398-I406 WeakPolarHBondContact O-CD1 3.45Å; T400-I406 HydrophobicContact CG2-CD1 4.44Å; T400-I406 HydrophobicContact CG2-CG1 4.16Å; I406-V409 HydrophobicContact CG2-CG2 3.53Å; I406-S432 PolarHBondContact N-O 3.07Å; I406-G433 WeakPolarHBondContact CD1-O 3.36Å; I406-V435 HydrophobicContact CB-CG2 3.81Å; I406-V435 HydrophobicContact CD1-CG2 4.4Å; I406-V435 HydrophobicContact CG2-CB 4.45Å; I406-V435 HydrophobicContact CG2-CG2 3.76Å; I406-F454 CarbonylContact C-O 3.54Å; I406-F454 WeakPolarHBondContact CA-O 3.31Å
407	R	92.9	Very high	90.2	Very high	54 Å²	54	34.7 Å²	34.7	20%	0.204	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-41	-177.4	179.8	62.9	-174.7	124.6	-6.4	112.5	H425 P426 F454 F463	R407-H425 PolarHBondContact NH1-CE1 3.02Å; R407-H425 PolarHBondContact NH1-NE2 3Å; R407-H425 PolarHBondContact NH2-CE1 2.78Å; R407-H425 PolarHBondContact NH2-NE2 2.85Å; R407-P426 PolarHBondContact NH1-O 2.87Å; R407-P426 VanDerWaalsContact NH1-O 3.08Å; R407-F454 HydrophobicContact CB-CB 4.34Å; R407-F454 PolarHBondContact N-O 3.2Å; R407-F463 HydrophobicContact CB-CD1 3.88Å; R407-F463 HydrophobicContact CB-CE1 3.69Å; R407-F463 HydrophobicContact CB-CG 4.41Å; R407-F463 HydrophobicContact CB-CZ 4.06Å; R407-F463 HydrophobicContact CG-CD1 4.39Å; R407-F463 HydrophobicContact CG-CD2 4.49Å; R407-F463 HydrophobicContact CG-CE1 3.93Å; R407-F463 HydrophobicContact CG-CE2 4.04Å; R407-F463 HydrophobicContact CG-CZ 3.74Å
408	A	94.3	Very high	89.6	Confident	7 Å²	7	43.7 Å²	43.7	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	153.6	-177.7	0	0	0	0	0	109.6	V424 F454	A408-V424 CarbonylContact C-O 3.57Å; A408-V424 WeakPolarHBondContact CA-O 3.11Å; A408-F454 HydrophobicContact CB-CB 4.2Å; A408-F454 HydrophobicContact CB-CD2 4.1Å; A408-F454 HydrophobicContact CB-CG 4.2Å; A408-F454 PolarHBondContact O-N 3.07Å
409	V	95.6	Very high	89	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.7	171.2	-177.3	0	0	0	0	107.8	I398 I406 I411 V423 V424 V435 I451 A453	I398-V409 HydrophobicContact CD1-CB 4.39Å; I398-V409 HydrophobicContact CD1-CG1 3.49Å; I398-V409 VanDerWaalsContact CD1-CG1 3.49Å; I398-V409 HydrophobicContact CD1-CG2 4.05Å; I406-V409 HydrophobicContact CG2-CG2 3.53Å; V409-I411 HydrophobicContact CG1-CD1 4.41Å; V409-I411 HydrophobicContact CG1-CG1 3.82Å; V409-V423 WeakPolarHBondContact O-CA 3.39Å; V409-V424 HydrophobicContact CB-CB 4.47Å; V409-V424 PolarHBondContact N-O 3.24Å; V409-V424 PolarHBondContact O-N 3.41Å; V409-V435 HydrophobicContact CG2-CB 4.33Å; V409-V435 HydrophobicContact CG2-CG1 4.18Å; V409-I451 HydrophobicContact CG1-CG2 3.77Å; V409-A453 HydrophobicContact CG2-CB 4.48Å
410	L	95.6	Very high	88.5	Confident	38 Å²	38	50 Å²	50	20%	0.199	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.5	166.8	-66.1	91.3	0	0	0	108.3	F412 V423 K452 F454	L410-F412 HydrophobicContact CB-CE2 3.97Å; L410-F412 HydrophobicContact CD2-CE2 4.46Å; L410-F412 HydrophobicContact CD2-CZ 4.29Å; L410-V423 HydrophobicContact CD2-CG2 3.93Å; L410-V423 HydrophobicContact CG-CG1 4.18Å; L410-V423 HydrophobicContact CG-CG2 3.9Å; L410-K452 HydrophobicContact CB-CB 4.37Å; L410-K452 PolarHBondContact N-O 3.17Å; L410-K452 PolarHBondContact O-N 2.93Å; L410-F454 HydrophobicContact CD1-CD1 4.26Å; L410-F454 HydrophobicContact CD1-CE1 3.57Å; L410-F454 HydrophobicContact CD1-CE2 4.3Å; L410-F454 HydrophobicContact CD1-CZ 3.6Å
411	I	94.8	Very high	88.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.8	176	-50.9	177.2	0	0	0	107.3	L396 V409 F417 S421 H422 V437 L449 I451	L396-I411 HydrophobicContact CD2-CD1 3.77Å; V409-I411 HydrophobicContact CG1-CD1 4.41Å; V409-I411 HydrophobicContact CG1-CG1 3.82Å; I411-F417 HydrophobicContact CB-CE2 4.05Å; I411-F417 HydrophobicContact CB-CZ 4.15Å; I411-F417 HydrophobicContact CG2-CE2 3.81Å; I411-F417 HydrophobicContact CG2-CZ 3.91Å; I411-S421 CarbonylContact O-C 3.52Å; I411-S421 WeakPolarHBondContact O-CA 3.46Å; I411-H422 PolarHBondContact N-O 3.34Å; I411-H422 PolarHBondContact O-N 3.46Å; I411-V437 HydrophobicContact CD1-CB 4.07Å; I411-V437 HydrophobicContact CD1-CG1 3.72Å; I411-V437 HydrophobicContact CD1-CG2 4.13Å; I411-L449 HydrophobicContact CG2-CB 4.11Å; I411-L449 HydrophobicContact CG2-CD2 4.19Å; I411-I451 HydrophobicContact CG1-CG1 4.4Å; I411-I451 HydrophobicContact CG2-CG1 4.27Å
412	F	92.6	Very high	88.6	Confident	61 Å²	61	51.5 Å²	51.5	27%	0.268	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.7	170.5	-62.2	-92.4	0	0	0	108.3	L410 E420 H450 K452	L410-F412 HydrophobicContact CB-CE2 3.97Å; L410-F412 HydrophobicContact CD2-CE2 4.46Å; L410-F412 HydrophobicContact CD2-CZ 4.29Å; F412-E420 WeakPolarHBondContact CA-O 3.43Å; F412-H450 HydrophobicContact CB-CB 4.23Å; F412-H450 PolarHBondContact N-O 3.4Å; F412-H450 PolarHBondContact O-N 2.72Å; F412-K452 HydrophobicContact CD2-CG 4.48Å; F412-K452 HydrophobicContact CE2-CD 4.07Å; F412-K452 HydrophobicContact CE2-CG 4.25Å
413	A	89.1	Confident	89	Confident	3 Å²	3	53 Å²	53	3%	0.025	28%	0.284	C	S	.	.			trans	-150.8	146	176.3	0	0	0	0	0	108.4	I416 F417 E420 V447 L449	A413-I416 HydrophobicContact CB-CB 4.44Å; A413-I416 HydrophobicContact CB-CD1 4.31Å; A413-F417 HydrophobicContact CB-CD2 3.96Å; A413-F417 HydrophobicContact CB-CE2 3.53Å; A413-F417 HydrophobicContact CB-CZ 4.37Å; A413-E420 PolarHBondContact N-O 2.91Å; A413-V447 HydrophobicContact CB-CG1 4.1Å; A413-L449 HydrophobicContact CB-CD2 3.47Å; A413-L449 VanDerWaalsContact CB-CD2 3.47Å
414	E	80.9	Confident	89.5	Confident	78 Å²	78	44.8 Å²	44.8	36%	0.364	25%	0.248	S	C	.	.	S	Bend	trans	-95.6	134.2	-176.1	-49.8	-171.6	122.7	0	0	110.1	N202 R236 I416	N202-E414 HydrophobicContact CB-CB 4.07Å; N202-E414 VanDerWaalsContact CG-CB 3.41Å; N202-E414 WeakPolarHBondContact ND2-CB 3.35Å; N202-E414 PolarHBondContact ND2-OE1 3.15Å; N202-E414 PolarHBondContact ND2-OE2 3.01Å; R236-E414 IonicContact CZ-OE1 3.14Å; R236-E414 IonicContact CZ-OE2 2.81Å; R236-E414 VanDerWaalsContact CZ-OE2 3.28Å; R236-E414 IonicContact NH1-OE1 3.76Å; R236-E414 PolarHBondContact NH1-OE1 3.4Å; R236-E414 IonicContact NH1-OE2 3.31Å; R236-E414 PolarHBondContact NH1-OE2 3.19Å; R236-E414 IonicContact NH2-OE1 2.71Å; R236-E414 PolarHBondContact NH2-OE1 2.65Å; R236-E414 IonicContact NH2-OE2 2.77Å; R236-E414 PolarHBondContact NH2-OE2 2.79Å; E414-I416 PolarHBondContact O-N 2.72Å; E414-I416 VanDerWaalsContact O-N 3.13Å
415	G	76.3	Confident	89.6	Confident	42 Å²	42	49.4 Å²	49.4	43%	0.433	27%	0.268	S	S	.	.	S	Bend	trans	71.9	0.7	174.9	0	0	0	0	0	116.6	P442	G415-P442 WeakPolarHBondContact O-CG 3.45Å
416	I	85.9	Confident	89.6	Confident	20 Å²	20	50.1 Å²	50.1	10%	0.103	27%	0.273	C	S	.	.	S	Bend	trans	-99.3	-37.8	178.7	-63.1	-178.8	0	0	0	112.7	A413 E414 I439 P441 V447 L449 L472	A413-I416 HydrophobicContact CB-CB 4.44Å; A413-I416 HydrophobicContact CB-CD1 4.31Å; E414-I416 PolarHBondContact O-N 2.72Å; E414-I416 VanDerWaalsContact O-N 3.13Å; I416-I439 HydrophobicContact CG2-CG2 3.62Å; I416-P441 HydrophobicContact CD1-CB 4.38Å; I416-P441 HydrophobicContact CD1-CG 4.23Å; I416-P441 HydrophobicContact CG1-CB 4.36Å; I416-V447 HydrophobicContact CD1-CB 3.59Å; I416-V447 HydrophobicContact CD1-CG1 3.46Å; I416-V447 VanDerWaalsContact CD1-CG1 3.46Å; I416-V447 HydrophobicContact CD1-CG2 3.76Å; I416-V447 HydrophobicContact CG1-CB 4.37Å; I416-V447 HydrophobicContact CG1-CG1 4.08Å; I416-V447 HydrophobicContact CG1-CG2 4.08Å; I416-L449 HydrophobicContact CD1-CD2 4.18Å; I416-L472 HydrophobicContact CD1-CD1 3.79Å
417	F	86.4	Confident	89.5	Confident	32 Å²	32	52.8 Å²	52.8	14%	0.14	29%	0.292	C	S	.	.	S	Bend	trans	-103.3	159.2	-174.1	-55.3	-54.5	0	0	0	111.8	I411 A413 G419 H422 I439	I411-F417 HydrophobicContact CB-CE2 4.05Å; I411-F417 HydrophobicContact CB-CZ 4.15Å; I411-F417 HydrophobicContact CG2-CE2 3.81Å; I411-F417 HydrophobicContact CG2-CZ 3.91Å; A413-F417 HydrophobicContact CB-CD2 3.96Å; A413-F417 HydrophobicContact CB-CE2 3.53Å; A413-F417 HydrophobicContact CB-CZ 4.37Å; F417-G419 VanDerWaalsContact C-N 3.31Å; F417-G419 PolarHBondContact O-N 3.22Å; F417-H422 HydrophobicContact CD1-CB 3.57Å; F417-H422 HydrophobicContact CD2-CB 3.81Å; F417-H422 HydrophobicContact CE1-CB 3.55Å; F417-H422 HydrophobicContact CE2-CB 3.79Å; F417-H422 HydrophobicContact CG-CB 3.71Å; F417-H422 HydrophobicContact CZ-CB 3.67Å; F417-I439 HydrophobicContact CE1-CG2 4.44Å
418	E	80.6	Confident	89.2	Confident	205 Å²	205	55.3 Å²	55.3	96%	0.958	31%	0.313	S	S	*	.	S	Bend	trans	-68.3	91.1	164.7	-68.6	-176.4	179.7	0	0	109.2
419	G	81.8	Confident	88.8	Confident	57 Å²	57	63.8 Å²	63.8	59%	0.588	35%	0.351	S	S	*	.	S	Bend	trans	107.1	-149.5	-172.2	0	0	0	0	0	112.3	F417	F417-G419 VanDerWaalsContact C-N 3.31Å; F417-G419 PolarHBondContact O-N 3.22Å
420	E	83.5	Confident	88.4	Confident	107 Å²	107	69.3 Å²	69.3	50%	0.5	38%	0.381	S	S	.	.	S	Bend	trans	-106.3	-15.5	-173.8	69.8	-172.1	-174.3	0	0	114.9	K238 F412 A413	K238-E420 IonicContact NZ-OE2 3.41Å; K238-E420 PolarHBondContact NZ-OE2 2.87Å; F412-E420 WeakPolarHBondContact CA-O 3.43Å; A413-E420 PolarHBondContact N-O 2.91Å
421	S	90.5	Very high	88.1	Confident	40 Å²	40	68 Å²	68	28%	0.28	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	144.1	-175.7	69.8	0	0	0	0	111.7	I411	I411-S421 CarbonylContact O-C 3.52Å; I411-S421 WeakPolarHBondContact O-CA 3.46Å
422	H	93.3	Very high	88	Confident	72 Å²	72	70.3 Å²	70.3	33%	0.333	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.6	167.8	-171.6	70.2	0	0	0	109.7	I411 F417	I411-H422 PolarHBondContact N-O 3.34Å; I411-H422 PolarHBondContact O-N 3.46Å; F417-H422 HydrophobicContact CD1-CB 3.57Å; F417-H422 HydrophobicContact CD2-CB 3.81Å; F417-H422 HydrophobicContact CE1-CB 3.55Å; F417-H422 HydrophobicContact CE2-CB 3.79Å; F417-H422 HydrophobicContact CG-CB 3.71Å; F417-H422 HydrophobicContact CZ-CB 3.67Å
423	V	94.6	Very high	87.9	Confident	77 Å²	77	68.5 Å²	68.5	47%	0.467	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.8	-177.1	-175.3	0	0	0	0	109.6	V409 L410	V409-V423 WeakPolarHBondContact O-CA 3.39Å; L410-V423 HydrophobicContact CD2-CG2 3.93Å; L410-V423 HydrophobicContact CG-CG1 4.18Å; L410-V423 HydrophobicContact CG-CG2 3.9Å
424	V	93.9	Very high	88	Confident	29 Å²	29	70.7 Å²	70.7	18%	0.176	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118	173.3	-177.5	0	0	0	0	108.7	A408 V409 V435 V437	A408-V424 CarbonylContact C-O 3.57Å; A408-V424 WeakPolarHBondContact CA-O 3.11Å; V409-V424 HydrophobicContact CB-CB 4.47Å; V409-V424 PolarHBondContact N-O 3.24Å; V409-V424 PolarHBondContact O-N 3.41Å; V424-V435 HydrophobicContact CB-CG1 4.5Å; V424-V435 HydrophobicContact CG1-CG1 3.76Å; V424-V437 HydrophobicContact CB-CG2 4.29Å; V424-V437 HydrophobicContact CG1-CG2 4.5Å; V424-V437 HydrophobicContact CG2-CB 4.31Å; V424-V437 HydrophobicContact CG2-CG1 3.69Å; V424-V437 HydrophobicContact CG2-CG2 3.72Å
425	H	94.1	Very high	88.7	Confident	109 Å²	109	67.5 Å²	67.5	51%	0.505	39%	0.389	S	S	.	.			trans	-129.4	90.7	-178.6	-177.8	-97.9	0	0	0	110	R407	R407-H425 PolarHBondContact NH1-CE1 3.02Å; R407-H425 PolarHBondContact NH1-NE2 3Å; R407-H425 PolarHBondContact NH2-CE1 2.78Å; R407-H425 PolarHBondContact NH2-NE2 2.85Å
426	P	92.3	Very high	89.5	Confident	22 Å²	22	73.2 Å²	73.2	14%	0.143	40%	0.398	C	S	.	.			trans	-56.3	144.1	178	-24.8	34.6	0	0	0	112.3	R407 V435	R407-P426 PolarHBondContact NH1-O 2.87Å; R407-P426 VanDerWaalsContact NH1-O 3.08Å; P426-V435 HydrophobicContact CG-CG2 3.99Å
427	S	90.6	Very high	89.8	Confident	56 Å²	56	72.2 Å²	72.2	39%	0.392	39%	0.393	S	S	.	.			trans	-63	157.4	171.2	71.8	0	0	0	0	110.1	Q429 N430 L431	S427-Q429 PolarHBondContact O-N 3.44Å; S427-Q429 VanDerWaalsContact O-N 3.07Å; S427-N430 CarbonylContact O-C 3.5Å; S427-N430 PolarHBondContact O-N 3.29Å; S427-N430 PolarHBondContact OG-ND2 2.85Å; S427-L431 PolarHBondContact O-N 2.87Å
428	V	86.1	Confident	90.1	Very high	106 Å²	106	73.4 Å²	73.4	64%	0.642	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-57.6	-29.9	-177.1	-179.5	0	0	0	0	112.3	L431	V428-L431 HydrophobicContact CB-CD1 4.34Å; V428-L431 HydrophobicContact CG1-CD1 4.17Å
429	Q	87	Confident	90.6	Very high	185 Å²	185	63.7 Å²	63.7	86%	0.864	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-74.3	-27.1	177.8	-64.9	172.2	-4.8	0	0	112.9	S427	S427-Q429 PolarHBondContact O-N 3.44Å; S427-Q429 VanDerWaalsContact O-N 3.07Å
430	N	87.6	Confident	91	Very high	116 Å²	116	64.9 Å²	64.9	62%	0.62	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-102.2	14.5	-176.2	-64.7	-15.5	0	0	0	112.8	S427 S432	S427-N430 CarbonylContact O-C 3.5Å; S427-N430 PolarHBondContact O-N 3.29Å; S427-N430 PolarHBondContact OG-ND2 2.85Å; N430-S432 PolarHBondContact O-N 3.39Å
431	L	89.4	Confident	91.3	Very high	11 Å²	11	60 Å²	60	6%	0.058	33%	0.328	C	S	.	.			trans	-68.3	122.5	177.1	-75.5	163.4	0	0	0	110.5	I405 S427 V428	I405-L431 HydrophobicContact CD1-CB 4.31Å; I405-L431 HydrophobicContact CD1-CD1 4.11Å; I405-L431 HydrophobicContact CD1-CD2 3.82Å; I405-L431 HydrophobicContact CD1-CG 4.3Å; S427-L431 PolarHBondContact O-N 2.87Å; V428-L431 HydrophobicContact CB-CD1 4.34Å; V428-L431 HydrophobicContact CG1-CD1 4.17Å
432	S	91.9	Very high	91.1	Very high	49 Å²	49	62 Å²	62	34%	0.343	34%	0.34	S	S	.	.			trans	-142	164.9	-179.3	114.9	0	0	0	0	110.3	I406 N430 C434	I406-S432 PolarHBondContact N-O 3.07Å; N430-S432 PolarHBondContact O-N 3.39Å; S432-C434 PolarHBondContact O-N 2.63Å; S432-C434 PolarHBondContact OG-N 3.37Å; S432-C434 PolarHBondContact OG-O 2.81Å
433	G	89.9	Confident	90.7	Very high	23 Å²	23	62.8 Å²	62.8	24%	0.237	34%	0.342	C	S	.	.	S	Bend	trans	-72.5	-0.9	171.7	0	0	0	0	0	113.5	S399 T400 T404 I406	S399-G433 CarbonylContact C-O 3.53Å; S399-G433 VanDerWaalsContact CA-O 3.23Å; S399-G433 WeakPolarHBondContact CA-O 3.44Å; T400-G433 PolarHBondContact N-O 3.5Å; T400-G433 PolarHBondContact OG1-O 3.47Å; T404-G433 VanDerWaalsContact O-CA 3.3Å; T404-G433 WeakPolarHBondContact O-CA 3.44Å; I406-G433 WeakPolarHBondContact CD1-O 3.36Å
434	C	92.6	Very high	90.5	Very high	49 Å²	49	60 Å²	60	33%	0.331	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	132	178.2	-176.6	0	0	0	0	111.2	I398 S432	I398-C434 CarbonylContact O-C 3.38Å; I398-C434 VanDerWaalsContact O-CA 3.29Å; I398-C434 WeakPolarHBondContact O-CA 3.07Å; S432-C434 PolarHBondContact O-N 2.63Å; S432-C434 PolarHBondContact OG-N 3.37Å; S432-C434 PolarHBondContact OG-O 2.81Å
435	V	94.1	Very high	90.1	Very high	10 Å²	10	60.8 Å²	60.8	6%	0.061	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.1	174.4	175	0	0	0	0	108.2	I398 I406 V409 V424 P426 V437	I398-V435 PolarHBondContact N-O 3.25Å; I398-V435 PolarHBondContact O-N 2.84Å; I406-V435 HydrophobicContact CB-CG2 3.81Å; I406-V435 HydrophobicContact CD1-CG2 4.4Å; I406-V435 HydrophobicContact CG2-CB 4.45Å; I406-V435 HydrophobicContact CG2-CG2 3.76Å; V409-V435 HydrophobicContact CG2-CB 4.33Å; V409-V435 HydrophobicContact CG2-CG1 4.18Å; V424-V435 HydrophobicContact CB-CG1 4.5Å; V424-V435 HydrophobicContact CG1-CG1 3.76Å; P426-V435 HydrophobicContact CG-CG2 3.99Å; V435-V437 HydrophobicContact CG1-CG2 4.05Å
436	R	93	Very high	89.9	Confident	162 Å²	162	58.5 Å²	58.5	61%	0.611	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.6	178.8	-66.2	-178.7	-71.2	-167.2	-6	108.8	E395 L396	E395-R436 HydrophobicContact CG-CB 4.17Å; E395-R436 HydrophobicContact CG-CG 4.45Å; E395-R436 VanDerWaalsContact OE1-CD 3.31Å; E395-R436 WeakPolarHBondContact OE1-CD 3.47Å; E395-R436 IonicContact OE1-NE 2.74Å; L396-R436 WeakPolarHBondContact O-CA 3.29Å
437	V	92.6	Very high	89.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120	-174.8	-171.8	0	0	0	0	109.3	L396 I411 V424 V435	L396-V437 HydrophobicContact CB-CB 4.5Å; L396-V437 PolarHBondContact N-O 2.87Å; L396-V437 PolarHBondContact O-N 2.91Å; I411-V437 HydrophobicContact CD1-CB 4.07Å; I411-V437 HydrophobicContact CD1-CG1 3.72Å; I411-V437 HydrophobicContact CD1-CG2 4.13Å; V424-V437 HydrophobicContact CB-CG2 4.29Å; V424-V437 HydrophobicContact CG1-CG2 4.5Å; V424-V437 HydrophobicContact CG2-CB 4.31Å; V424-V437 HydrophobicContact CG2-CG1 3.69Å; V424-V437 HydrophobicContact CG2-CG2 3.72Å; V435-V437 HydrophobicContact CG1-CG2 4.05Å
438	P	92.2	Very high	89.8	Confident	56 Å²	56	59.3 Å²	59.3	36%	0.364	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130	174.2	31.2	-33.1	0	0	0	110.5	H393	H393-P438 HydrophobicContact CB-CB 4.05Å; H393-P438 WeakPolarHBondContact CD2-CB 3.39Å
439	I	91.8	Very high	90.1	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.7	178.7	-52.2	179.1	0	0	0	108.6	V394 L396 I416 F417 P441 L449 L472	V394-I439 PolarHBondContact N-O 3.18Å; V394-I439 PolarHBondContact O-N 2.83Å; L396-I439 HydrophobicContact CB-CD1 3.82Å; L396-I439 HydrophobicContact CB-CG1 4.5Å; L396-I439 HydrophobicContact CD2-CD1 4.06Å; I416-I439 HydrophobicContact CG2-CG2 3.62Å; F417-I439 HydrophobicContact CE1-CG2 4.44Å; I439-P441 HydrophobicContact CG2-CG 4.24Å; I439-L449 HydrophobicContact CD1-CD1 3.54Å; I439-L449 HydrophobicContact CD1-CD2 4.49Å; I439-L472 HydrophobicContact CG2-CD1 4.06Å
440	I	90.4	Very high	90.5	Very high	82 Å²	82	49.6 Å²	49.6	42%	0.421	27%	0.269	S	S	.	.			trans	-127.9	86.9	-179	-55.4	176.7	0	0	0	108.2	K391 H393 M477	K391-I440 HydrophobicContact CB-CD1 4.43Å; H393-I440 HydrophobicContact CB-CD1 4.28Å; H393-I440 HydrophobicContact CB-CG1 3.74Å; I440-M477 HydrophobicContact CG2-CE 3.88Å
441	P	89.3	Confident	90.8	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.032	24%	0.24	C	C	.	.			trans	-64.8	130	176.9	-22.5	35.7	0	0	0	111.4	I416 I439 L472 R528	I416-P441 HydrophobicContact CD1-CB 4.38Å; I416-P441 HydrophobicContact CD1-CG 4.23Å; I416-P441 HydrophobicContact CG1-CB 4.36Å; I439-P441 HydrophobicContact CG2-CG 4.24Å; P441-L472 HydrophobicContact CG-CD1 4.11Å; P441-R528 PolarHBondContact O-NE 3.49Å; P441-R528 PolarHBondContact O-NH2 3.08Å
442	P	86.4	Confident	91.2	Very high	83 Å²	83	47 Å²	47	54%	0.539	25%	0.252	S	S	.	.	S	Bend	trans	-75.1	-28.1	-175.9	28.4	-34.3	0	0	0	113.5	G415	G415-P442 WeakPolarHBondContact O-CG 3.45Å
443	K	85.7	Confident	91.3	Very high	88 Å²	88	44.7 Å²	44.7	38%	0.383	24%	0.236	S	C	.	.	S	Bend	trans	-127.4	160.2	-179.4	-66.3	-178.2	176.4	179.4	0	110.6	D184 M445 R528	D184-K443 PolarHBondContact O-NZ 3.15Å; K443-M445 HydrophobicContact CB-CE 4.15Å; K443-M445 HydrophobicContact CD-CE 3.84Å; K443-M445 PolarHBondContact O-N 3.15Å; K443-M445 VanDerWaalsContact O-N 3.16Å; K443-R528 PolarHBondContact O-NH2 3.27Å
444	D	89.1	Confident	91.6	Very high	18 Å²	18	46.8 Å²	46.8	10%	0.096	24%	0.238	C	C	.	.	S	Bend	trans	-85.9	78.5	176.3	-64.3	-49.1	0	0	0	111.2	R474 F475 Y478 R528	D444-R474 CarbonylContact C-O 3.59Å; D444-R474 VanDerWaalsContact CA-O 3.25Å; D444-R474 WeakPolarHBondContact CA-O 3.38Å; D444-R474 HydrophobicContact CB-CG 4.38Å; D444-R474 WeakPolarHBondContact CB-O 3.21Å; D444-R474 WeakPolarHBondContact O-CG 3.48Å; D444-F475 HydrophobicContact CB-CD1 3.85Å; D444-F475 HydrophobicContact CB-CE1 3.99Å; D444-Y478 WeakPolarHBondContact OD1-CE2 3.35Å; D444-Y478 PolarHBondContact OD2-OH 2.69Å; D444-R528 IonicContact OD1-CZ 2.73Å; D444-R528 IonicContact OD1-NH1 2.64Å; D444-R528 PolarHBondContact OD1-NH1 2.57Å; D444-R528 IonicContact OD1-NH2 2.63Å; D444-R528 PolarHBondContact OD1-NH2 2.84Å; D444-R528 IonicContact OD2-CZ 3.07Å; D444-R528 IonicContact OD2-NH1 3.79Å; D444-R528 PolarHBondContact OD2-NH1 2.73Å
445	M	86.6	Confident	91.6	Very high	45 Å²	45	44.4 Å²	44.4	22%	0.222	22%	0.222	C	C	.	.			trans	-131.7	144.9	175.5	-72.8	-165.4	-82	0	0	110.3	N200 K443 V447	N200-M445 HydrophobicContact CB-SD 3.99Å; N200-M445 PolarHBondContact ND2-SD 3.31Å; K443-M445 HydrophobicContact CB-CE 4.15Å; K443-M445 HydrophobicContact CD-CE 3.84Å; K443-M445 PolarHBondContact O-N 3.15Å; K443-M445 VanDerWaalsContact O-N 3.16Å; M445-V447 PolarHBondContact O-N 3.36Å
446	P	89.4	Confident	91.5	Very high	61 Å²	61	44 Å²	44	40%	0.396	22%	0.22	S	C	.	.			trans	-67	133.8	171.8	29.5	-33	0	0	0	109.3	L472	P446-L472 VanDerWaalsContact CA-O 3.28Å; P446-L472 WeakPolarHBondContact CA-O 3.4Å
447	V	89.9	Confident	91.2	Very high	22 Å²	22	37.9 Å²	37.9	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.2	-178.1	-177.1	0	0	0	0	111	A413 I416 M445 L472	A413-V447 HydrophobicContact CB-CG1 4.1Å; I416-V447 HydrophobicContact CD1-CB 3.59Å; I416-V447 HydrophobicContact CD1-CG1 3.46Å; I416-V447 VanDerWaalsContact CD1-CG1 3.46Å; I416-V447 HydrophobicContact CD1-CG2 3.76Å; I416-V447 HydrophobicContact CG1-CB 4.37Å; I416-V447 HydrophobicContact CG1-CG1 4.08Å; I416-V447 HydrophobicContact CG1-CG2 4.08Å; M445-V447 PolarHBondContact O-N 3.36Å; V447-L472 PolarHBondContact N-O 2.75Å; V447-L472 VanDerWaalsContact N-O 3.09Å; V447-L472 PolarHBondContact O-N 3.25Å
448	D	91.2	Very high	90.8	Very high	74 Å²	74	46.6 Å²	46.6	40%	0.396	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.4	173.8	-63.9	-27.4	0	0	0	110.6	T469 Q471	D448-T469 HydrophobicContact CB-CG2 4.25Å; D448-Q471 WeakPolarHBondContact OD1-CB 3.29Å; D448-Q471 VanDerWaalsContact OD1-CG 3.32Å; D448-Q471 WeakPolarHBondContact OD1-CG 3.03Å; D448-Q471 PolarHBondContact OD1-NE2 2.86Å
449	L	93	Very high	90.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	109.3	173.6	-53.6	-179.8	0	0	0	108.9	L396 I411 A413 I416 I439 I451 T469 R470 L472	L396-L449 HydrophobicContact CD2-CD1 4.24Å; I411-L449 HydrophobicContact CG2-CB 4.11Å; I411-L449 HydrophobicContact CG2-CD2 4.19Å; A413-L449 HydrophobicContact CB-CD2 3.47Å; A413-L449 VanDerWaalsContact CB-CD2 3.47Å; I416-L449 HydrophobicContact CD1-CD2 4.18Å; I439-L449 HydrophobicContact CD1-CD1 3.54Å; I439-L449 HydrophobicContact CD1-CD2 4.49Å; L449-I451 HydrophobicContact CB-CD1 4.46Å; L449-I451 HydrophobicContact CB-CG1 4.3Å; L449-T469 WeakPolarHBondContact O-CA 3.47Å; L449-R470 WeakPolarHBondContact CA-O 3.36Å; L449-R470 VanDerWaalsContact CB-O 3.3Å; L449-R470 WeakPolarHBondContact CB-O 3.2Å; L449-R470 PolarHBondContact N-O 3.31Å; L449-R470 PolarHBondContact O-N 3.47Å; L449-L472 HydrophobicContact CD1-CD1 3.87Å; L449-L472 HydrophobicContact CD1-CD2 4.41Å; L449-L472 HydrophobicContact CD1-CG 3.83Å; L449-L472 HydrophobicContact CD2-CD1 3.91Å; L449-L472 HydrophobicContact CD2-CG 4.48Å; L449-L472 HydrophobicContact CG-CD1 4.07Å; L449-L472 HydrophobicContact CG-CG 4.11Å
450	H	94.4	Very high	90	Very high	87 Å²	87	51.2 Å²	51.2	40%	0.403	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.1	171.1	-56.7	-69.1	0	0	0	109.4	F412 T469	F412-H450 HydrophobicContact CB-CB 4.23Å; F412-H450 PolarHBondContact N-O 3.4Å; F412-H450 PolarHBondContact O-N 2.72Å; H450-T469 WeakPolarHBondContact ND1-CG2 3.45Å; H450-T469 PolarHBondContact ND1-OG1 3.43Å
451	I	94.9	Very high	89.7	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.9	-172.1	-58.6	157.2	0	0	0	108.6	L396 I398 V409 I411 L449 E467 I468 R470	L396-I451 HydrophobicContact CD1-CD1 4.29Å; L396-I451 HydrophobicContact CD2-CD1 3.67Å; L396-I451 HydrophobicContact CD2-CG1 4.22Å; I398-I451 HydrophobicContact CD1-CG2 3.76Å; V409-I451 HydrophobicContact CG1-CG2 3.77Å; I411-I451 HydrophobicContact CG1-CG1 4.4Å; I411-I451 HydrophobicContact CG2-CG1 4.27Å; L449-I451 HydrophobicContact CB-CD1 4.46Å; L449-I451 HydrophobicContact CB-CG1 4.3Å; I451-E467 WeakPolarHBondContact O-CA 3.23Å; I451-I468 HydrophobicContact CB-CG2 3.72Å; I451-I468 HydrophobicContact CD1-CG2 4.02Å; I451-I468 HydrophobicContact CG1-CG2 4.44Å; I451-I468 HydrophobicContact CG2-CG2 4.16Å; I451-I468 PolarHBondContact N-O 3.35Å; I451-I468 PolarHBondContact O-N 3.01Å; I451-R470 HydrophobicContact CD1-CB 4.34Å; I451-R470 HydrophobicContact CD1-CG 4.24Å
452	K	96.4	Very high	89.6	Confident	71 Å²	71	58.5 Å²	58.5	31%	0.309	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	103.3	170.5	-55.2	-161.9	-177.7	-146.4	0	109	L410 F412 V465 F466 E467	L410-K452 HydrophobicContact CB-CB 4.37Å; L410-K452 PolarHBondContact N-O 3.17Å; L410-K452 PolarHBondContact O-N 2.93Å; F412-K452 HydrophobicContact CD2-CG 4.48Å; F412-K452 HydrophobicContact CE2-CD 4.07Å; F412-K452 HydrophobicContact CE2-CG 4.25Å; K452-V465 HydrophobicContact CB-CG1 3.96Å; K452-V465 HydrophobicContact CD-CG1 4.48Å; K452-F466 WeakPolarHBondContact CA-O 3.37Å; K452-E467 HydrophobicContact CD-CG 4.44Å; K452-E467 WeakPolarHBondContact CE-OE1 3.38Å; K452-E467 HydrophobicContact CG-CG 4.25Å; K452-E467 IonicContact NZ-OE1 3.75Å; K452-E467 PolarHBondContact NZ-OE1 2.88Å
453	A	95.3	Very high	89.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.4	-178	0	0	0	0	0	110.9	L377 V409 V465 F466	L377-A453 HydrophobicContact CD1-CB 3.54Å; L377-A453 HydrophobicContact CD2-CB 4.24Å; V409-A453 HydrophobicContact CG2-CB 4.48Å; A453-V465 WeakPolarHBondContact O-CA 3.33Å; A453-F466 PolarHBondContact N-O 3.07Å; A453-F466 PolarHBondContact O-N 2.9Å
454	F	94.9	Very high	90	Very high	66 Å²	66	57.2 Å²	57.2	29%	0.289	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	109.3	-178.4	-69.7	17.7	0	0	0	108.4	I406 R407 A408 L410 F463 H464 V465	I406-F454 CarbonylContact C-O 3.54Å; I406-F454 WeakPolarHBondContact CA-O 3.31Å; R407-F454 HydrophobicContact CB-CB 4.34Å; R407-F454 PolarHBondContact N-O 3.2Å; A408-F454 HydrophobicContact CB-CB 4.2Å; A408-F454 HydrophobicContact CB-CD2 4.1Å; A408-F454 HydrophobicContact CB-CG 4.2Å; A408-F454 PolarHBondContact O-N 3.07Å; L410-F454 HydrophobicContact CD1-CD1 4.26Å; L410-F454 HydrophobicContact CD1-CE1 3.57Å; L410-F454 HydrophobicContact CD1-CE2 4.3Å; L410-F454 HydrophobicContact CD1-CZ 3.6Å; F454-F463 HydrophobicContact CB-CB 4.18Å; F454-H464 CarbonylContact C-O 3.5Å; F454-H464 WeakPolarHBondContact CA-O 3.36Å; F454-V465 HydrophobicContact CD1-CB 4.41Å; F454-V465 HydrophobicContact CD1-CG1 4.11Å; F454-V465 HydrophobicContact CD1-CG2 3.81Å; F454-V465 HydrophobicContact CE1-CB 4.42Å; F454-V465 HydrophobicContact CE1-CG1 3.92Å; F454-V465 HydrophobicContact CE1-CG2 3.7Å; F454-V465 HydrophobicContact CZ-CG2 4.3Å
455	V	93.6	Very high	90.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.8	-171.9	-176.6	0	0	0	0	110.4	T375 L377 T400 T404 I405 H464 F466	T375-V455 HydrophobicContact CG2-CG1 4.13Å; L377-V455 HydrophobicContact CD1-CG2 4.22Å; T400-V455 HydrophobicContact CG2-CG1 3.99Å; T400-V455 HydrophobicContact CG2-CG2 4.2Å; T404-V455 HydrophobicContact CG2-CG1 4.24Å; I405-V455 WeakPolarHBondContact O-CA 3.39Å; V455-H464 PolarHBondContact N-O 3.39Å; V455-H464 PolarHBondContact O-N 3.49Å; V455-F466 HydrophobicContact CB-CD2 3.93Å; V455-F466 HydrophobicContact CB-CE2 3.97Å; V455-F466 HydrophobicContact CG1-CE2 4.44Å; V455-F466 HydrophobicContact CG2-CD2 3.71Å; V455-F466 HydrophobicContact CG2-CE2 4.18Å
456	G	91.3	Very high	90.7	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	-162.7	178	0	0	0	0	0	114	I405	I405-G456 WeakPolarHBondContact CG1-O 3.43Å; I405-G456 PolarHBondContact N-O 3.09Å; I405-G456 PolarHBondContact O-N 3.08Å; I405-G456 VanDerWaalsContact O-N 3.09Å
457	G	87.6	Confident	91	Very high	34 Å²	34	63.7 Å²	63.7	35%	0.351	32%	0.324	S	S	.	.			trans	-87.4	159.6	171.8	0	0	0	0	0	112.6	T459 S460	G457-T459 VanDerWaalsContact C-N 3.29Å; G457-T459 PolarHBondContact O-N 3.3Å; G457-S460 WeakPolarHBondContact O-CB 3.49Å; G457-S460 PolarHBondContact O-N 3.41Å
458	R	83.8	Confident	91.2	Very high	183 Å²	183	64.4 Å²	64.4	69%	0.691	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-35.3	-177	-70.8	-175.5	178.8	-150.4	-1.9	114.5	I405	I405-R458 HydrophobicContact CD1-CG 4.3Å; I405-R458 HydrophobicContact CG1-CG 4.38Å; I405-R458 HydrophobicContact CG2-CG 3.85Å
459	T	82.8	Confident	91.3	Very high	133 Å²	133	64.6 Å²	64.6	82%	0.816	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	8.7	-177.5	51.9	0	0	0	0	112.9	G457	G457-T459 VanDerWaalsContact C-N 3.29Å; G457-T459 PolarHBondContact O-N 3.3Å
460	S	83.4	Confident	91.3	Very high	20 Å²	20	69.5 Å²	69.5	14%	0.14	35%	0.349	C	S	.	.			trans	-74.9	146.4	-175.8	-160	0	0	0	0	112.1	G369 G457 Q462 F463	G369-S460 WeakPolarHBondContact CA-OG 3.28Å; G457-S460 WeakPolarHBondContact O-CB 3.49Å; G457-S460 PolarHBondContact O-N 3.41Å; S460-Q462 PolarHBondContact OG-N 2.82Å; S460-Q462 PolarHBondContact OG-O 2.97Å; S460-F463 WeakPolarHBondContact O-CE2 3.38Å; S460-F463 WeakPolarHBondContact O-CZ 3.45Å
461	T	84.9	Confident	91.2	Very high	117 Å²	117	71 Å²	71	72%	0.718	36%	0.356	S	S	*	.	S	Bend	trans	-98.1	-17.3	172.2	54.8	0	0	0	0	112.3
462	Q	86.6	Confident	91.1	Very high	123 Å²	123	71 Å²	71	58%	0.575	36%	0.356	S	S	*	.	S	Bend	trans	-121.7	132.4	178.7	-66.7	-177.6	-5.4	0	0	109.5	S460	S460-Q462 PolarHBondContact OG-N 2.82Å; S460-Q462 PolarHBondContact OG-O 2.97Å
463	F	90.1	Very high	90.9	Very high	57 Å²	57	68.4 Å²	68.4	25%	0.25	35%	0.346	C	S	.	.			trans	-122.2	149	-177.5	-60.6	-87.2	0	0	0	110	R407 F454 S460	R407-F463 HydrophobicContact CB-CD1 3.88Å; R407-F463 HydrophobicContact CB-CE1 3.69Å; R407-F463 HydrophobicContact CB-CG 4.41Å; R407-F463 HydrophobicContact CB-CZ 4.06Å; R407-F463 HydrophobicContact CG-CD1 4.39Å; R407-F463 HydrophobicContact CG-CD2 4.49Å; R407-F463 HydrophobicContact CG-CE1 3.93Å; R407-F463 HydrophobicContact CG-CE2 4.04Å; R407-F463 HydrophobicContact CG-CZ 3.74Å; F454-F463 HydrophobicContact CB-CB 4.18Å; S460-F463 WeakPolarHBondContact O-CE2 3.38Å; S460-F463 WeakPolarHBondContact O-CZ 3.45Å
464	H	91.4	Very high	90.7	Very high	87 Å²	87	71.5 Å²	71.5	40%	0.403	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	135.5	169.9	-73.2	-98.4	0	0	0	109.6	G369 I371 F454 V455 F466	G369-H464 PolarHBondContact O-CD2 2.95Å; G369-H464 PolarHBondContact O-NE2 3.39Å; I371-H464 HydrophobicContact CD1-CB 3.73Å; I371-H464 VanDerWaalsContact CD1-CG 3.49Å; F454-H464 CarbonylContact C-O 3.5Å; F454-H464 WeakPolarHBondContact CA-O 3.36Å; V455-H464 PolarHBondContact N-O 3.39Å; V455-H464 PolarHBondContact O-N 3.49Å; H464-F466 HydrophobicContact CB-CD2 4.24Å; H464-F466 HydrophobicContact CB-CE2 3.83Å
465	V	94.9	Very high	90.7	Very high	73 Å²	73	68.4 Å²	68.4	44%	0.442	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	109.2	175.7	-175.2	0	0	0	0	108.3	K452 A453 F454 E467	K452-V465 HydrophobicContact CB-CG1 3.96Å; K452-V465 HydrophobicContact CD-CG1 4.48Å; A453-V465 WeakPolarHBondContact O-CA 3.33Å; F454-V465 HydrophobicContact CD1-CB 4.41Å; F454-V465 HydrophobicContact CD1-CG1 4.11Å; F454-V465 HydrophobicContact CD1-CG2 3.81Å; F454-V465 HydrophobicContact CE1-CB 4.42Å; F454-V465 HydrophobicContact CE1-CG1 3.92Å; F454-V465 HydrophobicContact CE1-CG2 3.7Å; F454-V465 HydrophobicContact CZ-CG2 4.3Å; V465-E467 HydrophobicContact CG1-CG 4.38Å
466	F	94.6	Very high	90.6	Very high	53 Å²	53	68.5 Å²	68.5	23%	0.232	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.3	172.1	-76.2	-101.7	0	0	0	109.1	I371 T375 L377 K452 A453 V455 H464	I371-F466 HydrophobicContact CD1-CE2 3.62Å; I371-F466 HydrophobicContact CD1-CZ 3.77Å; T375-F466 HydrophobicContact CG2-CZ 4.42Å; T375-F466 WeakPolarHBondContact O-CE1 3.46Å; L377-F466 HydrophobicContact CD1-CB 4.33Å; K452-F466 WeakPolarHBondContact CA-O 3.37Å; A453-F466 PolarHBondContact N-O 3.07Å; A453-F466 PolarHBondContact O-N 2.9Å; V455-F466 HydrophobicContact CB-CD2 3.93Å; V455-F466 HydrophobicContact CB-CE2 3.97Å; V455-F466 HydrophobicContact CG1-CE2 4.44Å; V455-F466 HydrophobicContact CG2-CD2 3.71Å; V455-F466 HydrophobicContact CG2-CE2 4.18Å; H464-F466 HydrophobicContact CB-CD2 4.24Å; H464-F466 HydrophobicContact CB-CE2 3.83Å
467	E	94.9	Very high	90.6	Very high	135 Å²	135	68.5 Å²	68.5	63%	0.631	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.3	176.5	-55.5	-165.4	163.5	0	0	109.4	I451 K452 V465	I451-E467 WeakPolarHBondContact O-CA 3.23Å; K452-E467 HydrophobicContact CD-CG 4.44Å; K452-E467 WeakPolarHBondContact CE-OE1 3.38Å; K452-E467 HydrophobicContact CG-CG 4.25Å; K452-E467 IonicContact NZ-OE1 3.75Å; K452-E467 PolarHBondContact NZ-OE1 2.88Å; V465-E467 HydrophobicContact CG1-CG 4.38Å
468	I	94.5	Very high	90.8	Very high	37 Å²	37	67.1 Å²	67.1	19%	0.19	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.9	174.5	-168.8	170.5	0	0	0	109.3	L377 T379 I451	L377-I468 HydrophobicContact CD2-CB 4.35Å; L377-I468 HydrophobicContact CD2-CG2 3.5Å; L377-I468 VanDerWaalsContact CD2-CG2 3.5Å; T379-I468 HydrophobicContact CG2-CD1 4.13Å; T379-I468 HydrophobicContact CG2-CG2 4.24Å; I451-I468 HydrophobicContact CB-CG2 3.72Å; I451-I468 HydrophobicContact CD1-CG2 4.02Å; I451-I468 HydrophobicContact CG1-CG2 4.44Å; I451-I468 HydrophobicContact CG2-CG2 4.16Å; I451-I468 PolarHBondContact N-O 3.35Å; I451-I468 PolarHBondContact O-N 3.01Å
469	T	93.7	Very high	91.1	Very high	77 Å²	77	61.4 Å²	61.4	47%	0.472	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.7	173.6	-57.5	0	0	0	0	109.6	D448 L449 H450	D448-T469 HydrophobicContact CB-CG2 4.25Å; L449-T469 WeakPolarHBondContact O-CA 3.47Å; H450-T469 WeakPolarHBondContact ND1-CG2 3.45Å; H450-T469 PolarHBondContact ND1-OG1 3.43Å
470	R	93.1	Very high	91.3	Very high	104 Å²	104	57.8 Å²	57.8	39%	0.392	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.2	174.8	-72.1	-60.8	-175.8	-179.7	3.2	110.3	T379 L449 I451	T379-R470 VanDerWaalsContact OG1-CZ 3.27Å; T379-R470 PolarHBondContact OG1-NE 2.81Å; T379-R470 PolarHBondContact OG1-NH2 2.78Å; T379-R470 VanDerWaalsContact OG1-NH2 3.09Å; L449-R470 WeakPolarHBondContact CA-O 3.36Å; L449-R470 VanDerWaalsContact CB-O 3.3Å; L449-R470 WeakPolarHBondContact CB-O 3.2Å; L449-R470 PolarHBondContact N-O 3.31Å; L449-R470 PolarHBondContact O-N 3.47Å; I451-R470 HydrophobicContact CD1-CB 4.34Å; I451-R470 HydrophobicContact CD1-CG 4.24Å
471	Q	92.1	Very high	91.4	Very high	118 Å²	118	58.8 Å²	58.8	55%	0.551	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.9	177.7	-174.8	167.2	75.3	0	0	110.2	D448	D448-Q471 WeakPolarHBondContact OD1-CB 3.29Å; D448-Q471 VanDerWaalsContact OD1-CG 3.32Å; D448-Q471 WeakPolarHBondContact OD1-CG 3.03Å; D448-Q471 PolarHBondContact OD1-NE2 2.86Å
472	L	92.6	Very high	90.8	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	128	162.6	-74.9	171.4	0	0	0	108.3	L381 V394 I416 I439 P441 P446 V447 L449	L381-L472 HydrophobicContact CD1-CD2 3.95Å; L381-L472 HydrophobicContact CD2-CD2 3.79Å; L381-L472 HydrophobicContact CG-CD2 4.48Å; V394-L472 HydrophobicContact CG1-CD2 3.91Å; I416-L472 HydrophobicContact CD1-CD1 3.79Å; I439-L472 HydrophobicContact CG2-CD1 4.06Å; P441-L472 HydrophobicContact CG-CD1 4.11Å; P446-L472 VanDerWaalsContact CA-O 3.28Å; P446-L472 WeakPolarHBondContact CA-O 3.4Å; V447-L472 PolarHBondContact N-O 2.75Å; V447-L472 VanDerWaalsContact N-O 3.09Å; V447-L472 PolarHBondContact O-N 3.25Å; L449-L472 HydrophobicContact CD1-CD1 3.87Å; L449-L472 HydrophobicContact CD1-CD2 4.41Å; L449-L472 HydrophobicContact CD1-CG 3.83Å; L449-L472 HydrophobicContact CD2-CD1 3.91Å; L449-L472 HydrophobicContact CD2-CG 4.48Å; L449-L472 HydrophobicContact CG-CD1 4.07Å; L449-L472 HydrophobicContact CG-CG 4.11Å
473	P	92.9	Very high	89.7	Confident	17 Å²	17	63 Å²	63	11%	0.11	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-71.2	162.9	176.4	33.4	-36.6	0	0	0	110.6	F475 S476 L512	P473-F475 PolarHBondContact O-N 3.3Å; P473-S476 WeakPolarHBondContact O-CB 3.39Å; P473-S476 PolarHBondContact O-N 3.13Å; P473-L512 HydrophobicContact CG-CD2 3.65Å; P473-L512 HydrophobicContact CG-CG 3.65Å
474	R	92.1	Very high	88.2	Confident	66 Å²	66	64.9 Å²	64.9	25%	0.249	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-46.9	-172.5	-172.8	179	-71	-147.6	-2.4	113.3	D444 S476	D444-R474 CarbonylContact C-O 3.59Å; D444-R474 VanDerWaalsContact CA-O 3.25Å; D444-R474 WeakPolarHBondContact CA-O 3.38Å; D444-R474 HydrophobicContact CB-CG 4.38Å; D444-R474 WeakPolarHBondContact CB-O 3.21Å; D444-R474 WeakPolarHBondContact O-CG 3.48Å; R474-S476 PolarHBondContact O-N 3.33Å
475	F	93.6	Very high	86.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-104.5	59.4	-176.5	-54.7	-66.9	0	0	0	110.2	D444 P473 Y478 W506 N510 F511 L552 D555 L556 S559	D444-F475 HydrophobicContact CB-CD1 3.85Å; D444-F475 HydrophobicContact CB-CE1 3.99Å; P473-F475 PolarHBondContact O-N 3.3Å; F475-Y478 HydrophobicContact CB-CD2 3.62Å; F475-Y478 HydrophobicContact CB-CE2 3.9Å; F475-Y478 AromaticContact CD1-CE2 3.99Å; F475-Y478 HydrophobicContact CD1-CE2 3.99Å; F475-Y478 HydrophobicContact CG-CE2 4.43Å; F475-W506 HydrophobicContact CE2-CH2 4.4Å; F475-W506 AromaticContact CE2-CZ2 3.94Å; F475-W506 HydrophobicContact CE2-CZ2 3.94Å; F475-N510 WeakPolarHBondContact CA-O 3.19Å; F475-N510 WeakPolarHBondContact CB-O 3.32Å; F475-N510 HydrophobicContact CD2-CB 3.9Å; F475-N510 HydrophobicContact CE2-CB 4.35Å; F475-N510 PolarHBondContact N-O 2.95Å; F475-F511 HydrophobicContact CB-CD1 3.63Å; F475-F511 HydrophobicContact CB-CD2 4.28Å; F475-F511 HydrophobicContact CB-CE1 3.39Å; F475-F511 HydrophobicContact CB-CE2 4.07Å; F475-F511 HydrophobicContact CB-CG 4.08Å; F475-F511 HydrophobicContact CB-CZ 3.62Å; F475-F511 HydrophobicContact CD2-CD2 4.24Å; F475-F511 HydrophobicContact CD2-CE1 4.35Å; F475-F511 AromaticContact CD2-CE2 3.61Å; F475-F511 HydrophobicContact CD2-CE2 3.61Å; F475-F511 AromaticContact CD2-CZ 3.68Å; F475-F511 HydrophobicContact CD2-CZ 3.68Å; F475-F511 HydrophobicContact CE2-CE2 4.42Å; F475-F511 HydrophobicContact CG-CE1 4.02Å; F475-F511 HydrophobicContact CG-CE2 4.11Å; F475-F511 AromaticContact CG-CZ 3.74Å; F475-F511 HydrophobicContact CG-CZ 3.74Å; F475-L552 HydrophobicContact CD1-CD1 4.27Å; F475-L552 HydrophobicContact CE1-CD1 4.19Å; F475-D555 HydrophobicContact CE1-CB 4.05Å; F475-D555 HydrophobicContact CZ-CB 4.26Å; F475-L556 HydrophobicContact CD1-CD2 4.37Å; F475-L556 HydrophobicContact CD2-CD2 4.17Å; F475-L556 HydrophobicContact CE1-CD2 4.01Å; F475-L556 HydrophobicContact CE1-CG 4.39Å; F475-L556 HydrophobicContact CE2-CD2 3.81Å; F475-L556 HydrophobicContact CG-CD2 4.45Å; F475-L556 HydrophobicContact CZ-CD2 3.72Å; F475-L556 HydrophobicContact CZ-CG 4.23Å; F475-S559 WeakPolarHBondContact CE2-OG 3.22Å
476	S	91.9	Very high	85.6	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.021	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-17.5	-176.4	69	0	0	0	0	114.4	V394 P473 R474 Y478	V394-S476 VanDerWaalsContact CG2-O 3.28Å; V394-S476 WeakPolarHBondContact CG2-O 3.19Å; P473-S476 WeakPolarHBondContact O-CB 3.39Å; P473-S476 PolarHBondContact O-N 3.13Å; R474-S476 PolarHBondContact O-N 3.33Å; S476-Y478 VanDerWaalsContact C-N 3.34Å; S476-Y478 PolarHBondContact O-N 2.87Å
477	M	91.4	Very high	84.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	28	-173.7	-69.6	-64.1	-74.4	0	0	113.5	V394 I440 L527 R528	V394-M477 HydrophobicContact CG2-SD 3.78Å; I440-M477 HydrophobicContact CG2-CE 3.88Å; M477-L527 HydrophobicContact CE-CB 3.87Å; M477-L527 HydrophobicContact CE-CD1 4.43Å; M477-L527 WeakPolarHBondContact O-CB 3.49Å; M477-L527 VanDerWaalsContact O-CG 3.26Å; M477-L527 WeakPolarHBondContact O-CG 3.45Å; M477-L527 PolarHBondContact O-N 2.82Å; M477-L527 HydrophobicContact SD-CD1 4.37Å; M477-R528 HydrophobicContact CB-CG 4.28Å; M477-R528 HydrophobicContact CE-CG 4.05Å; M477-R528 HydrophobicContact CG-CG 4.48Å
478	Y	91	Very high	84.1	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.016	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.7	-176.4	-62	-83.7	0	0	0	109.9	D444 F475 S476 F511 N525 L552	D444-Y478 WeakPolarHBondContact OD1-CE2 3.35Å; D444-Y478 PolarHBondContact OD2-OH 2.69Å; F475-Y478 HydrophobicContact CB-CD2 3.62Å; F475-Y478 HydrophobicContact CB-CE2 3.9Å; F475-Y478 AromaticContact CD1-CE2 3.99Å; F475-Y478 HydrophobicContact CD1-CE2 3.99Å; F475-Y478 HydrophobicContact CG-CE2 4.43Å; S476-Y478 VanDerWaalsContact C-N 3.34Å; S476-Y478 PolarHBondContact O-N 2.87Å; Y478-F511 HydrophobicContact CD2-CE1 4.12Å; Y478-F511 HydrophobicContact CG-CE1 4.09Å; Y478-N525 WeakPolarHBondContact CA-O 3.23Å; Y478-L552 HydrophobicContact CE1-CD1 4.12Å; Y478-L552 HydrophobicContact CE1-CD2 3.61Å; Y478-L552 HydrophobicContact CE2-CD1 4.31Å; Y478-L552 WeakPolarHBondContact OH-CD1 3.42Å
479	E	89.6	Confident	83.7	Confident	64 Å²	64	60.8 Å²	60.8	30%	0.299	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.7	178.3	-171.4	169.8	-153	0	0	109.8	V383 F524 N525 L527	V383-E479 HydrophobicContact CG1-CB 3.78Å; V383-E479 HydrophobicContact CG1-CG 4.04Å; E479-F524 CarbonylContact O-C 3.49Å; E479-F524 VanDerWaalsContact O-CA 3.24Å; E479-F524 WeakPolarHBondContact O-CA 3.17Å; E479-N525 PolarHBondContact N-O 2.83Å; E479-N525 PolarHBondContact O-N 3.24Å; E479-L527 HydrophobicContact CB-CD2 4.07Å
480	I	88.6	Confident	83.6	Confident	57 Å²	57	57.2 Å²	57.2	29%	0.292	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	133.5	175.3	-165.3	167.5	0	0	0	109.7	L513 P514 V517 V522 F524	I480-L513 HydrophobicContact CD1-CD2 4.35Å; I480-P514 HydrophobicContact CG2-CG 4.06Å; I480-V517 HydrophobicContact CD1-CG2 3.77Å; I480-V522 HydrophobicContact CD1-CB 4.47Å; I480-V522 HydrophobicContact CD1-CG1 4.09Å; I480-F524 HydrophobicContact CB-CD1 4.09Å; I480-F524 HydrophobicContact CB-CE1 3.98Å; I480-F524 HydrophobicContact CG1-CD1 4.49Å; I480-F524 HydrophobicContact CG1-CE1 4.25Å
481	T	83.8	Confident	83.6	Confident	40 Å²	40	54.5 Å²	54.5	25%	0.245	32%	0.32	C	S	.	.			trans	-131.7	137.4	179.2	-178.1	0	0	0	0	110.3	D483 T523 N525 L532	T481-D483 PolarHBondContact OG1-N 2.9Å; T481-D483 PolarHBondContact OG1-O 2.73Å; T481-T523 HydrophobicContact CG2-CG2 3.93Å; T481-T523 PolarHBondContact N-O 3Å; T481-N525 HydrophobicContact CG2-CB 4.44Å; T481-L532 HydrophobicContact CG2-CD2 4.32Å
482	E	73.8	Confident	83.8	Confident	199 Å²	199	48.9 Å²	48.9	93%	0.93	29%	0.294	S	S	*	.	S	Bend	trans	-88.3	-23.5	172.4	-63.9	-173	170.3	0	0	111.8	S484	E482-S484 PolarHBondContact O-N 2.98Å
483	D	63.2	Low	83.8	Confident	131 Å²	131	50 Å²	50	70%	0.701	30%	0.302	S	S	*	.			trans	-71.9	124.1	174.8	-78.4	-30.6	0	0	0	109.2	T481 P485	T481-D483 PolarHBondContact OG1-N 2.9Å; T481-D483 PolarHBondContact OG1-O 2.73Å; D483-P485 WeakPolarHBondContact O-CD 3.41Å
484	S	58.2	Low	83.8	Confident	96 Å²	96	49.7 Å²	49.7	67%	0.671	30%	0.299	S	S	*	.			trans	-101.9	93.6	175.1	-178.3	0	0	0	0	109.2	E482	E482-S484 PolarHBondContact O-N 2.98Å
485	P	64	Low	83.8	Confident	72 Å²	72	50.3 Å²	50.3	47%	0.468	31%	0.313	S	S	.	.			trans	-59.1	179.6	159.4	-17.4	29.8	0	0	0	110.7	D483 A487 L532	D483-P485 WeakPolarHBondContact O-CD 3.41Å; P485-A487 PolarHBondContact O-N 2.93Å; P485-L532 HydrophobicContact CB-CD1 3.58Å; P485-L532 HydrophobicContact CG-CD1 3.56Å; P485-L532 HydrophobicContact CG-CD2 4.27Å; P485-L532 HydrophobicContact CG-CG 4.48Å
486	A	68.4	Low	83.6	Confident	95 Å²	95	50.8 Å²	50.8	79%	0.785	32%	0.315	S	S	*	.	S	Bend	trans	-48.6	127.5	173.4	0	0	0	0	0	110.5
487	A	73.7	Confident	83.3	Confident	56 Å²	56	58.6 Å²	58.6	46%	0.463	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-61.9	140.5	-177.9	0	0	0	0	0	110.4	P485	P485-A487 PolarHBondContact O-N 2.93Å
488	P	83.9	Confident	83	Confident	13 Å²	13	61.5 Å²	61.5	8%	0.084	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-52.2	148.8	172.8	-25.2	33.1	0	0	0	111.8	L532 R546	P488-L532 HydrophobicContact CG-CB 3.93Å; P488-L532 WeakPolarHBondContact CG-O 3.36Å; P488-R546 HydrophobicContact CB-CB 4.38Å; P488-R546 HydrophobicContact CG-CB 4.46Å
489	A	87.1	Confident	82.8	Confident	63 Å²	63	70.6 Å²	70.6	52%	0.521	41%	0.405	S	S	.	.	S	Bend	trans	-78.6	-32.9	177.9	0	0	0	0	0	111.3	D548	A489-D548 PolarHBondContact N-OD1 3.48Å
490	G	90.6	Very high	82.8	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.01	41%	0.41	C	S	.	.			trans	-67.8	131	177.2	0	0	0	0	0	112.2	R546 T547 D548 D574	G490-R546 CarbonylContact O-C 3.52Å; G490-R546 VanDerWaalsContact O-CA 3.24Å; G490-R546 WeakPolarHBondContact O-CA 3.36Å; G490-T547 CarbonylContact C-O 3.6Å; G490-T547 VanDerWaalsContact CA-O 3.22Å; G490-T547 WeakPolarHBondContact CA-O 3.47Å; G490-T547 PolarHBondContact O-N 3.33Å; G490-D548 PolarHBondContact N-OD1 3.38Å; G490-D574 CarbonylContact C-O 3.58Å; G490-D574 VanDerWaalsContact CA-O 3.3Å; G490-D574 WeakPolarHBondContact CA-O 3.45Å
491	T	93.8	Very high	82.8	Confident	47 Å²	47	74.1 Å²	74.1	29%	0.288	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142	-178.8	62.9	0	0	0	0	111.6	L545 R546 A573 D574	T491-L545 CarbonylContact C-O 3.58Å; T491-L545 WeakPolarHBondContact CA-O 2.93Å; T491-R546 HydrophobicContact CG2-CG 4.14Å; T491-A573 CarbonylContact O-C 3.51Å; T491-A573 VanDerWaalsContact O-CA 3.31Å; T491-A573 WeakPolarHBondContact O-CA 3.25Å; T491-D574 PolarHBondContact N-O 2.87Å; T491-D574 PolarHBondContact O-N 3.14Å
492	V	94.7	Very high	83.1	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.006	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	124.3	177.1	-178.3	0	0	0	0	107.7	F494 T544 L545 A553 V557 V571 E572 A573 F575 L674	V492-F494 HydrophobicContact CG1-CD1 4.44Å; V492-T544 WeakPolarHBondContact O-CA 3.46Å; V492-L545 HydrophobicContact CB-CB 4.24Å; V492-L545 PolarHBondContact N-O 3.2Å; V492-L545 PolarHBondContact O-N 2.91Å; V492-A553 HydrophobicContact CG2-CB 3.96Å; V492-V557 HydrophobicContact CG1-CG2 4.4Å; V492-V571 HydrophobicContact CB-CG1 4.49Å; V492-V571 HydrophobicContact CG1-CG1 3.15Å; V492-E572 CarbonylContact C-O 3.57Å; V492-E572 WeakPolarHBondContact CA-O 3.49Å; V492-A573 HydrophobicContact CG2-CB 4.04Å; V492-F575 HydrophobicContact CG2-CE1 4.45Å; V492-F575 HydrophobicContact CG2-CE2 3.59Å; V492-F575 HydrophobicContact CG2-CZ 3.37Å; V492-L674 HydrophobicContact CG1-CD2 4.49Å; V492-L674 HydrophobicContact CG2-CD2 4.26Å
493	S	93.4	Very high	83.9	Confident	25 Å²	25	66.9 Å²	66.9	18%	0.175	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138	-178	73.6	0	0	0	0	112.1	I543 E572	S493-I543 VanDerWaalsContact CA-O 3.31Å; S493-I543 WeakPolarHBondContact CA-O 3.05Å; S493-E572 PolarHBondContact N-O 2.86Å; S493-E572 PolarHBondContact O-N 3.4Å
494	F	93.4	Very high	85.3	Confident	9 Å²	9	61 Å²	61	4%	0.039	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	161.9	178	58.3	-86.4	0	0	0	109.8	V492 I496 I543 L545 V557 L560 L569 V571	V492-F494 HydrophobicContact CG1-CD1 4.44Å; F494-I496 HydrophobicContact CD2-CG2 3.79Å; F494-I496 HydrophobicContact CE2-CG2 3.75Å; F494-I543 HydrophobicContact CD2-CB 4.41Å; F494-I543 HydrophobicContact CE1-CB 4.27Å; F494-I543 HydrophobicContact CE1-CG2 3.98Å; F494-I543 HydrophobicContact CE2-CB 3.98Å; F494-I543 HydrophobicContact CE2-CD1 3.81Å; F494-I543 HydrophobicContact CE2-CG1 4.41Å; F494-I543 HydrophobicContact CE2-CG2 4.31Å; F494-I543 HydrophobicContact CZ-CB 3.89Å; F494-I543 HydrophobicContact CZ-CD1 4.09Å; F494-I543 HydrophobicContact CZ-CG2 3.72Å; F494-I543 PolarHBondContact N-O 3.34Å; F494-I543 VanDerWaalsContact N-O 3.08Å; F494-I543 PolarHBondContact O-N 3.44Å; F494-L545 HydrophobicContact CE1-CD1 3.95Å; F494-L545 HydrophobicContact CE1-CG 4.24Å; F494-V557 HydrophobicContact CD1-CG2 4.38Å; F494-V557 HydrophobicContact CE1-CG2 3.77Å; F494-V557 HydrophobicContact CZ-CG2 4.32Å; F494-L560 HydrophobicContact CE2-CD2 4.03Å; F494-L560 HydrophobicContact CZ-CD2 3.92Å; F494-L569 HydrophobicContact CB-CD1 4.18Å; F494-L569 HydrophobicContact CD2-CD1 3.94Å; F494-L569 HydrophobicContact CD2-CD2 3.93Å; F494-L569 HydrophobicContact CD2-CG 4.46Å; F494-L569 HydrophobicContact CE2-CD2 4.21Å; F494-L569 HydrophobicContact CG-CD1 4.36Å; F494-L569 HydrophobicContact CG-CD2 4.29Å; F494-V571 HydrophobicContact CB-CG2 3.97Å; F494-V571 HydrophobicContact CD1-CG1 4.39Å; F494-V571 HydrophobicContact CD1-CG2 4.3Å; F494-V571 HydrophobicContact CG-CG2 4.31Å
495	S	90.6	Very high	86.9	Confident	80 Å²	80	60.6 Å²	60.6	56%	0.559	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.5	-179.2	-61.2	0	0	0	0	110.4
496	I	89.8	Confident	88.4	Confident	9 Å²	9	57.2 Å²	57.2	5%	0.046	32%	0.321	C	S	.	.			trans	-119.6	144	174.6	62.6	166.9	0	0	0	110.3	F494 E498 V503 M537 G541 I543 L564 M566	F494-I496 HydrophobicContact CD2-CG2 3.79Å; F494-I496 HydrophobicContact CE2-CG2 3.75Å; I496-E498 VanDerWaalsContact C-N 3.35Å; I496-E498 HydrophobicContact CD1-CB 4.1Å; I496-E498 PolarHBondContact O-N 3.37Å; I496-V503 HydrophobicContact CD1-CG2 3.75Å; I496-M537 HydrophobicContact CD1-CE 4.01Å; I496-M537 HydrophobicContact CG1-CE 4.11Å; I496-G541 WeakPolarHBondContact CG1-O 3.19Å; I496-G541 PolarHBondContact N-O 2.96Å; I496-I543 HydrophobicContact CD1-CD1 3.35Å; I496-I543 HydrophobicContact CD1-CG1 4.28Å; I496-I543 HydrophobicContact CG1-CD1 3.76Å; I496-I543 HydrophobicContact CG1-CG1 4.28Å; I496-I543 HydrophobicContact CG2-CD1 4.33Å; I496-L564 HydrophobicContact CD1-CD1 4.03Å; I496-M566 HydrophobicContact CG2-CE 4.28Å; I496-M566 HydrophobicContact CG2-SD 4.04Å
497	N	86.8	Confident	89.5	Confident	167 Å²	167	52.8 Å²	52.8	89%	0.893	28%	0.283	S	S	*	.			trans	-97.8	59.5	175.1	-170.7	21.6	0	0	0	110.6
498	E	85.3	Confident	90.4	Very high	62 Å²	62	52.4 Å²	52.4	29%	0.29	27%	0.274	S	S	.	.	S	Bend	trans	-138.1	159.5	-174.7	-90.5	-67.1	-171.7	0	0	112.8	I496 R502 L564	I496-E498 VanDerWaalsContact C-N 3.35Å; I496-E498 HydrophobicContact CD1-CB 4.1Å; I496-E498 PolarHBondContact O-N 3.37Å; E498-R502 IonicContact OE1-CZ 3.43Å; E498-R502 IonicContact OE1-NH1 2.74Å; E498-R502 PolarHBondContact OE1-NH1 3.31Å; E498-R502 VanDerWaalsContact OE2-CD 3.29Å; E498-R502 WeakPolarHBondContact OE2-CD 3.39Å; E498-R502 IonicContact OE2-NH1 3.09Å; E498-L564 HydrophobicContact CB-CD1 4.46Å; E498-L564 HydrophobicContact CG-CD1 4.36Å; E498-L564 HydrophobicContact CG-CD2 4.19Å
499	R	87.1	Confident	90.8	Very high	195 Å²	195	57 Å²	57	74%	0.736	29%	0.294	S	S	*	.			trans	-73.2	135.1	-178.2	-62.8	-178.1	-177.1	176.3	1.7	110.4	Q501 R502	R499-Q501 PolarHBondContact O-N 3.4Å; R499-R502 PolarHBondContact O-N 2.8Å
500	P	87.9	Confident	91.1	Very high	63 Å²	63	55.4 Å²	55.4	41%	0.409	28%	0.277	S	S	.	.	H	α-helix	trans	-53	-33.8	176.4	-28.3	34.3	0	0	0	114	R502 V503 V504 P520 M537	P500-R502 VanDerWaalsContact C-N 3.28Å; P500-R502 PolarHBondContact O-N 2.88Å; P500-V503 WeakPolarHBondContact O-CB 3.37Å; P500-V503 PolarHBondContact O-N 3Å; P500-V504 WeakPolarHBondContact O-CG2 3.46Å; P500-V504 PolarHBondContact O-N 3.46Å; P500-P520 HydrophobicContact CB-CG 4.4Å; P500-M537 HydrophobicContact CB-CE 4.41Å; P500-M537 HydrophobicContact CB-SD 3.97Å; P500-M537 HydrophobicContact CG-CE 3.95Å; P500-M537 HydrophobicContact CG-SD 4.08Å
501	Q	89.7	Confident	91.2	Very high	132 Å²	132	55.7 Å²	55.7	62%	0.617	28%	0.278	S	S	*	.	H	α-helix	trans	-61.3	-31	177.4	-69.8	-63.9	-26.1	0	0	113.6	R499 V504 M505	R499-Q501 PolarHBondContact O-N 3.4Å; Q501-V504 PolarHBondContact O-N 3.26Å; Q501-M505 PolarHBondContact O-N 3.4Å
502	R	90.7	Very high	91	Very high	88 Å²	88	55 Å²	55	33%	0.332	27%	0.272	S	S	.	.	H	α-helix	trans	-69.7	-36.5	173.6	-71.6	-167.5	70.4	179.9	-1.1	111.6	E498 R499 P500 M505 W506 L564	E498-R502 IonicContact OE1-CZ 3.43Å; E498-R502 IonicContact OE1-NH1 2.74Å; E498-R502 PolarHBondContact OE1-NH1 3.31Å; E498-R502 VanDerWaalsContact OE2-CD 3.29Å; E498-R502 WeakPolarHBondContact OE2-CD 3.39Å; E498-R502 IonicContact OE2-NH1 3.09Å; R499-R502 PolarHBondContact O-N 2.8Å; P500-R502 VanDerWaalsContact C-N 3.28Å; P500-R502 PolarHBondContact O-N 2.88Å; R502-M505 WeakPolarHBondContact O-CB 3.38Å; R502-M505 PolarHBondContact O-N 3.41Å; R502-W506 PolarHBondContact O-N 2.87Å; R502-L564 HydrophobicContact CB-CD2 4.24Å
503	V	90.4	Very high	90.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-41	175.7	-177.5	0	0	0	0	110.4	I496 P500 M505 W506 L507 P520 F535 M537	I496-V503 HydrophobicContact CD1-CG2 3.75Å; P500-V503 WeakPolarHBondContact O-CB 3.37Å; P500-V503 PolarHBondContact O-N 3Å; V503-M505 VanDerWaalsContact C-N 3.32Å; V503-M505 PolarHBondContact O-N 3.16Å; V503-W506 WeakPolarHBondContact O-CB 3.24Å; V503-W506 PolarHBondContact O-N 3.22Å; V503-L507 PolarHBondContact O-N 2.86Å; V503-P520 HydrophobicContact CG1-CB 4.37Å; V503-F535 HydrophobicContact CG1-CE1 3.66Å; V503-F535 HydrophobicContact CG1-CZ 3.56Å; V503-M537 HydrophobicContact CB-SD 4.33Å; V503-M537 HydrophobicContact CG2-CE 4.47Å; V503-M537 HydrophobicContact CG2-SD 3.87Å
504	V	91.9	Very high	90.2	Very high	6 Å²	6	60.6 Å²	60.6	4%	0.036	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-41.4	172.5	172.7	0	0	0	0	111.4	P500 Q501 W506 L507 N508 V517 P520	P500-V504 WeakPolarHBondContact O-CG2 3.46Å; P500-V504 PolarHBondContact O-N 3.46Å; Q501-V504 PolarHBondContact O-N 3.26Å; V504-W506 VanDerWaalsContact C-N 3.33Å; V504-W506 PolarHBondContact O-N 2.99Å; V504-L507 PolarHBondContact O-N 2.97Å; V504-N508 WeakPolarHBondContact CG1-ND2 3.47Å; V504-N508 PolarHBondContact O-N 3.28Å; V504-N508 PolarHBondContact O-ND2 3.48Å; V504-V517 WeakPolarHBondContact CG1-O 3.47Å; V504-P520 HydrophobicContact CG2-CB 4.23Å
505	M	92.4	Very high	89.7	Confident	89 Å²	89	68 Å²	68	44%	0.438	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-41.8	173.9	-173.3	172.1	79.2	0	0	111.9	Q501 R502 V503 N508 Q509 F563	Q501-M505 PolarHBondContact O-N 3.4Å; R502-M505 WeakPolarHBondContact O-CB 3.38Å; R502-M505 PolarHBondContact O-N 3.41Å; V503-M505 VanDerWaalsContact C-N 3.32Å; V503-M505 PolarHBondContact O-N 3.16Å; M505-N508 PolarHBondContact O-N 3.31Å; M505-Q509 WeakPolarHBondContact O-CG 3.45Å; M505-Q509 PolarHBondContact O-N 2.91Å; M505-Q509 VanDerWaalsContact O-N 3.14Å; M505-F563 HydrophobicContact CE-CE1 4.14Å; M505-F563 HydrophobicContact CE-CE2 4.35Å; M505-F563 HydrophobicContact CE-CZ 3.44Å; M505-F563 VanDerWaalsContact CE-CZ 3.44Å; M505-F563 HydrophobicContact CG-CZ 4.37Å
506	W	94.2	Very high	89.4	Confident	1 Å²	1	69.8 Å²	69.8	0%	0.004	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-44.1	175.4	173.5	83.7	0	0	0	112.4	F475 R502 V503 V504 N508 Q509 N510 F511 F535 L556 S559 L560 F563	F475-W506 HydrophobicContact CE2-CH2 4.4Å; F475-W506 AromaticContact CE2-CZ2 3.94Å; F475-W506 HydrophobicContact CE2-CZ2 3.94Å; R502-W506 PolarHBondContact O-N 2.87Å; V503-W506 WeakPolarHBondContact O-CB 3.24Å; V503-W506 PolarHBondContact O-N 3.22Å; V504-W506 VanDerWaalsContact C-N 3.33Å; V504-W506 PolarHBondContact O-N 2.99Å; W506-N508 PolarHBondContact O-N 3.47Å; W506-Q509 PolarHBondContact O-N 3.22Å; W506-N510 PolarHBondContact NE1-ND2 2.67Å; W506-N510 PolarHBondContact O-N 2.85Å; W506-N510 VanDerWaalsContact O-N 3.09Å; W506-N510 PolarHBondContact O-ND2 3.24Å; W506-F511 HydrophobicContact CH2-CE2 4.07Å; W506-F511 HydrophobicContact CZ3-CE2 4.21Å; W506-F535 HydrophobicContact CH2-CE2 4.45Å; W506-F535 HydrophobicContact CZ3-CD2 4.36Å; W506-F535 AromaticContact CZ3-CE2 3.86Å; W506-F535 HydrophobicContact CZ3-CE2 3.86Å; W506-L556 HydrophobicContact CH2-CD2 3.75Å; W506-L556 HydrophobicContact CZ2-CD2 4.4Å; W506-S559 WeakPolarHBondContact CZ2-OG 3.49Å; W506-L560 HydrophobicContact CB-CD1 4.35Å; W506-L560 HydrophobicContact CD2-CD1 3.77Å; W506-L560 HydrophobicContact CE3-CD1 4.03Å; W506-L560 HydrophobicContact CG-CD1 3.9Å; W506-L560 HydrophobicContact CZ2-CB 4.21Å; W506-F563 HydrophobicContact CB-CD1 3.7Å; W506-F563 HydrophobicContact CB-CE1 3.62Å; W506-F563 HydrophobicContact CB-CG 4.23Å; W506-F563 HydrophobicContact CB-CZ 4.06Å; W506-F563 AromaticContact CD1-CD1 3.8Å; W506-F563 AromaticContact CD1-CD2 3.99Å; W506-F563 AromaticContact CD1-CG 3.5Å; W506-F563 HydrophobicContact CG-CB 4.49Å; W506-F563 HydrophobicContact CG-CD1 4.07Å; W506-F563 HydrophobicContact CG-CE1 4.43Å; W506-F563 HydrophobicContact CG-CG 4.21Å
507	L	92.4	Very high	89.3	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-58.1	-48.6	175.7	-76.1	168.4	0	0	0	111	V503 V504 Q509 N510 F511 V522 F524	V503-L507 PolarHBondContact O-N 2.86Å; V504-L507 PolarHBondContact O-N 2.97Å; L507-Q509 VanDerWaalsContact C-N 3.25Å; L507-Q509 PolarHBondContact O-N 2.89Å; L507-N510 PolarHBondContact O-N 2.99Å; L507-F511 HydrophobicContact CD2-CD2 4.09Å; L507-F511 HydrophobicContact CD2-CE2 3.91Å; L507-F511 WeakPolarHBondContact O-CB 3.46Å; L507-F511 WeakPolarHBondContact O-CD2 3.42Å; L507-F511 PolarHBondContact O-N 3.31Å; L507-F511 VanDerWaalsContact O-N 3.16Å; L507-V522 HydrophobicContact CD1-CG2 3.96Å; L507-V522 HydrophobicContact CD2-CG2 4.11Å; L507-F524 HydrophobicContact CD2-CE2 4.26Å; L507-F524 HydrophobicContact CD2-CZ 4.43Å
508	N	92.1	Very high	89.3	Confident	48 Å²	48	70.3 Å²	70.3	26%	0.257	35%	0.346	S	S	.	.	H	α-helix	trans	-65.7	-23.7	-179.4	-74.5	-64.8	0	0	0	114	V504 M505 W506 L513 V516 V517	V504-N508 WeakPolarHBondContact CG1-ND2 3.47Å; V504-N508 PolarHBondContact O-N 3.28Å; V504-N508 PolarHBondContact O-ND2 3.48Å; M505-N508 PolarHBondContact O-N 3.31Å; W506-N508 PolarHBondContact O-N 3.47Å; N508-L513 HydrophobicContact CB-CD1 4.44Å; N508-L513 VanDerWaalsContact OD1-CD1 3.26Å; N508-L513 WeakPolarHBondContact OD1-CD1 3.37Å; N508-V516 WeakPolarHBondContact OD1-CA 3.2Å; N508-V517 PolarHBondContact ND2-O 3.19Å; N508-V517 VanDerWaalsContact ND2-O 3.07Å; N508-V517 PolarHBondContact OD1-N 3.29Å
509	Q	91.9	Very high	89.3	Confident	110 Å²	110	70.1 Å²	70.1	51%	0.514	35%	0.351	S	S	.	.	H	α-helix	trans	-88.1	-30.4	178.2	-72.8	179	3.5	0	0	113.5	M505 W506 L507 F563	M505-Q509 WeakPolarHBondContact O-CG 3.45Å; M505-Q509 PolarHBondContact O-N 2.91Å; M505-Q509 VanDerWaalsContact O-N 3.14Å; W506-Q509 PolarHBondContact O-N 3.22Å; L507-Q509 VanDerWaalsContact C-N 3.25Å; L507-Q509 PolarHBondContact O-N 2.89Å; Q509-F563 VanDerWaalsContact OE1-CE2 3.24Å
510	N	93.5	Very high	89.1	Confident	30 Å²	30	61.7 Å²	61.7	16%	0.16	32%	0.322	C	S	.	.	H	α-helix	trans	-103.2	-9.2	-170.6	-68	-78.1	0	0	0	114.4	F475 W506 L507	F475-N510 WeakPolarHBondContact CA-O 3.19Å; F475-N510 WeakPolarHBondContact CB-O 3.32Å; F475-N510 HydrophobicContact CD2-CB 3.9Å; F475-N510 HydrophobicContact CE2-CB 4.35Å; F475-N510 PolarHBondContact N-O 2.95Å; W506-N510 PolarHBondContact NE1-ND2 2.67Å; W506-N510 PolarHBondContact O-N 2.85Å; W506-N510 VanDerWaalsContact O-N 3.09Å; W506-N510 PolarHBondContact O-ND2 3.24Å; L507-N510 PolarHBondContact O-N 2.99Å
511	F	92.9	Very high	89.1	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.031	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-119.5	154.4	178.2	-70	-97.6	0	0	0	111.8	F475 Y478 W506 L507 L513 F524 M533 L556	F475-F511 HydrophobicContact CB-CD1 3.63Å; F475-F511 HydrophobicContact CB-CD2 4.28Å; F475-F511 HydrophobicContact CB-CE1 3.39Å; F475-F511 HydrophobicContact CB-CE2 4.07Å; F475-F511 HydrophobicContact CB-CG 4.08Å; F475-F511 HydrophobicContact CB-CZ 3.62Å; F475-F511 HydrophobicContact CD2-CD2 4.24Å; F475-F511 HydrophobicContact CD2-CE1 4.35Å; F475-F511 AromaticContact CD2-CE2 3.61Å; F475-F511 HydrophobicContact CD2-CE2 3.61Å; F475-F511 AromaticContact CD2-CZ 3.68Å; F475-F511 HydrophobicContact CD2-CZ 3.68Å; F475-F511 HydrophobicContact CE2-CE2 4.42Å; F475-F511 HydrophobicContact CG-CE1 4.02Å; F475-F511 HydrophobicContact CG-CE2 4.11Å; F475-F511 AromaticContact CG-CZ 3.74Å; F475-F511 HydrophobicContact CG-CZ 3.74Å; Y478-F511 HydrophobicContact CD2-CE1 4.12Å; Y478-F511 HydrophobicContact CG-CE1 4.09Å; W506-F511 HydrophobicContact CH2-CE2 4.07Å; W506-F511 HydrophobicContact CZ3-CE2 4.21Å; L507-F511 HydrophobicContact CD2-CD2 4.09Å; L507-F511 HydrophobicContact CD2-CE2 3.91Å; L507-F511 WeakPolarHBondContact O-CB 3.46Å; L507-F511 WeakPolarHBondContact O-CD2 3.42Å; L507-F511 PolarHBondContact O-N 3.31Å; L507-F511 VanDerWaalsContact O-N 3.16Å; F511-L513 HydrophobicContact CB-CD2 3.95Å; F511-L513 HydrophobicContact CB-CG 4.01Å; F511-L513 PolarHBondContact O-N 2.79Å; F511-F524 HydrophobicContact CD1-CD1 4.23Å; F511-F524 AromaticContact CD1-CE1 3.87Å; F511-F524 HydrophobicContact CD1-CE1 3.87Å; F511-F524 HydrophobicContact CD1-CE2 4.16Å; F511-F524 AromaticContact CD1-CZ 3.83Å; F511-F524 HydrophobicContact CD1-CZ 3.83Å; F511-F524 HydrophobicContact CD2-CZ 4.48Å; F511-F524 HydrophobicContact CE1-CD1 4.46Å; F511-F524 HydrophobicContact CE1-CD2 4.07Å; F511-F524 HydrophobicContact CE1-CE1 4.35Å; F511-F524 AromaticContact CE1-CE2 3.93Å; F511-F524 HydrophobicContact CE1-CE2 3.93Å; F511-F524 HydrophobicContact CE1-CG 4.33Å; F511-F524 HydrophobicContact CE1-CZ 4.09Å; F511-F524 HydrophobicContact CG-CE1 4.31Å; F511-F524 HydrophobicContact CG-CZ 4.04Å; F511-F524 HydrophobicContact CZ-CE2 4.16Å; F511-M533 HydrophobicContact CZ-CE 4.26Å; F511-M533 HydrophobicContact CZ-SD 4.38Å; F511-L556 HydrophobicContact CE2-CD2 4.36Å; F511-L556 HydrophobicContact CZ-CD2 3.81Å
512	L	90.4	Very high	89.1	Confident	31 Å²	31	56.5 Å²	56.5	16%	0.162	30%	0.296	C	S	.	.			trans	-88.9	90.8	170.8	-70.8	177	0	0	0	109.8	L381 V383 V394 P473	L381-L512 HydrophobicContact CB-CD2 4.2Å; V383-L512 HydrophobicContact CG2-CB 3.92Å; V383-L512 HydrophobicContact CG2-CD1 4.19Å; V394-L512 HydrophobicContact CG1-CD1 3.65Å; V394-L512 HydrophobicContact CG2-CD1 4.1Å; P473-L512 HydrophobicContact CG-CD2 3.65Å; P473-L512 HydrophobicContact CG-CG 3.65Å
513	L	87.6	Confident	89.1	Confident	35 Å²	35	54.1 Å²	54.1	18%	0.183	29%	0.291	C	S	.	.			trans	-96.2	135.9	-177	-56.3	171.3	0	0	0	111	I480 N508 F511 E515 V517 F524	I480-L513 HydrophobicContact CD1-CD2 4.35Å; N508-L513 HydrophobicContact CB-CD1 4.44Å; N508-L513 VanDerWaalsContact OD1-CD1 3.26Å; N508-L513 WeakPolarHBondContact OD1-CD1 3.37Å; F511-L513 HydrophobicContact CB-CD2 3.95Å; F511-L513 HydrophobicContact CB-CG 4.01Å; F511-L513 PolarHBondContact O-N 2.79Å; L513-E515 VanDerWaalsContact C-N 3.32Å; L513-E515 WeakPolarHBondContact CB-O 3.46Å; L513-V517 HydrophobicContact CD1-CB 4.16Å; L513-V517 HydrophobicContact CD1-CG2 3.75Å; L513-V517 HydrophobicContact CD2-CG2 4.25Å; L513-V517 HydrophobicContact CG-CG2 4.48Å; L513-F524 HydrophobicContact CD2-CE1 3.65Å; L513-F524 HydrophobicContact CD2-CZ 4.03Å
514	P	82.1	Confident	89.1	Confident	110 Å²	110	54.1 Å²	54.1	71%	0.714	29%	0.291	S	S	*	.	S	Bend	trans	-62.6	-39	175.2	-21	32	0	0	0	112.9	I480	I480-P514 HydrophobicContact CG2-CG 4.06Å
515	E	83.6	Confident	89	Confident	164 Å²	164	56.5 Å²	56.5	77%	0.766	30%	0.303	S	S	*	.	S	Bend	trans	-133	157	176.4	-65.8	-171.9	173.6	0	0	109.7	L513 V517	L513-E515 VanDerWaalsContact C-N 3.32Å; L513-E515 WeakPolarHBondContact CB-O 3.46Å; E515-V517 PolarHBondContact O-N 3Å
516	V	84.7	Confident	88.9	Confident	117 Å²	117	53.2 Å²	53.2	71%	0.709	29%	0.289	S	S	*	.			trans	-65.8	121.3	178.4	179.9	0	0	0	0	108.5	N508	N508-V516 WeakPolarHBondContact OD1-CA 3.2Å
517	V	86.6	Confident	88.5	Confident	19 Å²	19	54.2 Å²	54.2	12%	0.115	29%	0.294	C	S	.	.			trans	-75.9	134.1	176.8	168.3	0	0	0	0	109	I480 V504 N508 L513 E515 S519 V522	I480-V517 HydrophobicContact CD1-CG2 3.77Å; V504-V517 WeakPolarHBondContact CG1-O 3.47Å; N508-V517 PolarHBondContact ND2-O 3.19Å; N508-V517 VanDerWaalsContact ND2-O 3.07Å; N508-V517 PolarHBondContact OD1-N 3.29Å; L513-V517 HydrophobicContact CD1-CB 4.16Å; L513-V517 HydrophobicContact CD1-CG2 3.75Å; L513-V517 HydrophobicContact CD2-CG2 4.25Å; L513-V517 HydrophobicContact CG-CG2 4.48Å; E515-V517 PolarHBondContact O-N 3Å; V517-S519 WeakPolarHBondContact CG1-O 3.35Å; V517-V522 HydrophobicContact CG1-CG1 3.64Å; V517-V522 HydrophobicContact CG2-CG1 4.22Å
518	E	87	Confident	88.2	Confident	169 Å²	169	58.3 Å²	58.3	79%	0.79	31%	0.31	S	S	*	.			trans	-100.4	-17.1	178.7	-62	-171.7	164.7	0	0	113.6
519	S	85.7	Confident	87.3	Confident	57 Å²	57	59.5 Å²	59.5	40%	0.399	33%	0.333	S	S	.	.	S	Bend	trans	-121.4	144	-176.5	99.5	0	0	0	0	111.5	V517 N521	V517-S519 WeakPolarHBondContact CG1-O 3.35Å; S519-N521 PolarHBondContact O-N 2.93Å; S519-N521 PolarHBondContact OG-N 2.89Å
520	P	83.1	Confident	86.4	Confident	18 Å²	18	56.9 Å²	56.9	12%	0.117	34%	0.335	C	S	.	.	S	Bend	trans	-73.3	-4.8	179.1	32.1	-36.9	0	0	0	113.2	P500 V503 V504 V522 F535 M537	P500-P520 HydrophobicContact CB-CG 4.4Å; V503-P520 HydrophobicContact CG1-CB 4.37Å; V504-P520 HydrophobicContact CG2-CB 4.23Å; P520-V522 PolarHBondContact O-N 3.12Å; P520-F535 WeakPolarHBondContact O-CD1 3.49Å; P520-M537 HydrophobicContact CB-CB 3.86Å; P520-M537 HydrophobicContact CG-CB 3.78Å; P520-M537 HydrophobicContact CG-SD 4.48Å
521	N	88.8	Confident	85.8	Confident	76 Å²	76	57.1 Å²	57.1	41%	0.406	35%	0.345	S	S	.	.			trans	-92.2	99.1	-176.6	-65.5	-21	0	0	0	109.5	S519 F535 H536 M537	S519-N521 PolarHBondContact O-N 2.93Å; S519-N521 PolarHBondContact OG-N 2.89Å; N521-F535 VanDerWaalsContact CA-O 3.31Å; N521-F535 WeakPolarHBondContact CA-O 3.48Å; N521-H536 VanDerWaalsContact CG-CD2 3.5Å; N521-H536 WeakPolarHBondContact OD1-CA 3.28Å; N521-H536 PolarHBondContact OD1-CD2 2.68Å; N521-M537 PolarHBondContact OD1-N 3.46Å
522	V	89.9	Confident	85.6	Confident	11 Å²	11	58.2 Å²	58.2	7%	0.067	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147	-174.1	-69.3	0	0	0	0	111.4	I480 L507 V517 P520 F524 F535	I480-V522 HydrophobicContact CD1-CB 4.47Å; I480-V522 HydrophobicContact CD1-CG1 4.09Å; L507-V522 HydrophobicContact CD1-CG2 3.96Å; L507-V522 HydrophobicContact CD2-CG2 4.11Å; V517-V522 HydrophobicContact CG1-CG1 3.64Å; V517-V522 HydrophobicContact CG2-CG1 4.22Å; P520-V522 PolarHBondContact O-N 3.12Å; V522-F524 HydrophobicContact CB-CE2 4.03Å; V522-F524 HydrophobicContact CB-CZ 4.15Å; V522-F524 HydrophobicContact CG2-CD2 4.22Å; V522-F524 HydrophobicContact CG2-CE2 3.35Å; V522-F524 HydrophobicContact CG2-CZ 3.75Å; V522-F535 HydrophobicContact CG2-CB 3.96Å; V522-F535 PolarHBondContact N-O 3.38Å; V522-F535 PolarHBondContact O-N 3.25Å
523	T	90.6	Very high	85.6	Confident	38 Å²	38	56.8 Å²	56.8	23%	0.233	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	133.3	173.7	-54.7	0	0	0	0	108.9	T481 L532 M533	T481-T523 HydrophobicContact CG2-CG2 3.93Å; T481-T523 PolarHBondContact N-O 3Å; T523-L532 HydrophobicContact CG2-CD2 4.24Å; T523-M533 CarbonylContact C-O 3.53Å; T523-M533 WeakPolarHBondContact CA-O 3.23Å
524	F	90.6	Very high	85.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147	178.9	-61.8	-76.4	0	0	0	110.9	E479 I480 L507 F511 L513 V522 L532 M533	E479-F524 CarbonylContact O-C 3.49Å; E479-F524 VanDerWaalsContact O-CA 3.24Å; E479-F524 WeakPolarHBondContact O-CA 3.17Å; I480-F524 HydrophobicContact CB-CD1 4.09Å; I480-F524 HydrophobicContact CB-CE1 3.98Å; I480-F524 HydrophobicContact CG1-CD1 4.49Å; I480-F524 HydrophobicContact CG1-CE1 4.25Å; L507-F524 HydrophobicContact CD2-CE2 4.26Å; L507-F524 HydrophobicContact CD2-CZ 4.43Å; F511-F524 HydrophobicContact CD1-CD1 4.23Å; F511-F524 AromaticContact CD1-CE1 3.87Å; F511-F524 HydrophobicContact CD1-CE1 3.87Å; F511-F524 HydrophobicContact CD1-CE2 4.16Å; F511-F524 AromaticContact CD1-CZ 3.83Å; F511-F524 HydrophobicContact CD1-CZ 3.83Å; F511-F524 HydrophobicContact CD2-CZ 4.48Å; F511-F524 HydrophobicContact CE1-CD1 4.46Å; F511-F524 HydrophobicContact CE1-CD2 4.07Å; F511-F524 HydrophobicContact CE1-CE1 4.35Å; F511-F524 AromaticContact CE1-CE2 3.93Å; F511-F524 HydrophobicContact CE1-CE2 3.93Å; F511-F524 HydrophobicContact CE1-CG 4.33Å; F511-F524 HydrophobicContact CE1-CZ 4.09Å; F511-F524 HydrophobicContact CG-CE1 4.31Å; F511-F524 HydrophobicContact CG-CZ 4.04Å; F511-F524 HydrophobicContact CZ-CE2 4.16Å; L513-F524 HydrophobicContact CD2-CE1 3.65Å; L513-F524 HydrophobicContact CD2-CZ 4.03Å; V522-F524 HydrophobicContact CB-CE2 4.03Å; V522-F524 HydrophobicContact CB-CZ 4.15Å; V522-F524 HydrophobicContact CG2-CD2 4.22Å; V522-F524 HydrophobicContact CG2-CE2 3.35Å; V522-F524 HydrophobicContact CG2-CZ 3.75Å; F524-L532 WeakPolarHBondContact O-CA 3.4Å; F524-M533 HydrophobicContact CB-CB 4.39Å; F524-M533 HydrophobicContact CB-SD 4.47Å; F524-M533 HydrophobicContact CD2-CE 4Å; F524-M533 HydrophobicContact CD2-SD 3.81Å; F524-M533 HydrophobicContact CE2-CE 4.3Å; F524-M533 PolarHBondContact N-O 3.24Å; F524-M533 PolarHBondContact O-N 3.49Å
525	N	89.7	Confident	86.1	Confident	56 Å²	56	51.2 Å²	51.2	30%	0.299	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.5	168	-171.1	20.5	0	0	0	109.9	Y478 E479 T481 L527	Y478-N525 WeakPolarHBondContact CA-O 3.23Å; E479-N525 PolarHBondContact N-O 2.83Å; E479-N525 PolarHBondContact O-N 3.24Å; T481-N525 HydrophobicContact CG2-CB 4.44Å; N525-L527 PolarHBondContact O-N 3.05Å
526	S	89.5	Confident	86.5	Confident	19 Å²	19	47.6 Å²	47.6	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122.3	175.7	176.2	0	0	0	0	110.5	R528 G530 G531	S526-R528 VanDerWaalsContact C-N 3.28Å; S526-R528 PolarHBondContact O-N 3.17Å; S526-G530 VanDerWaalsContact O-CA 3.32Å; S526-G530 WeakPolarHBondContact O-CA 3.42Å; S526-G530 PolarHBondContact O-N 2.63Å; S526-G531 VanDerWaalsContact CB-O 3.23Å; S526-G531 WeakPolarHBondContact CB-O 3.5Å; S526-G531 PolarHBondContact N-O 2.76Å
527	L	86.1	Confident	86.8	Confident	23 Å²	23	42.6 Å²	42.6	12%	0.12	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-14.8	179.6	-59.7	177.4	0	0	0	113.5	V383 A392 M477 E479 N525	V383-L527 HydrophobicContact CG1-CD1 3.31Å; V383-L527 HydrophobicContact CG1-CD2 4.23Å; V383-L527 HydrophobicContact CG1-CG 4.24Å; A392-L527 HydrophobicContact CB-CB 3.72Å; A392-L527 HydrophobicContact CB-CD1 4.45Å; A392-L527 HydrophobicContact CB-CD2 3.9Å; A392-L527 HydrophobicContact CB-CG 4.2Å; M477-L527 HydrophobicContact CE-CB 3.87Å; M477-L527 HydrophobicContact CE-CD1 4.43Å; M477-L527 WeakPolarHBondContact O-CB 3.49Å; M477-L527 VanDerWaalsContact O-CG 3.26Å; M477-L527 WeakPolarHBondContact O-CG 3.45Å; M477-L527 PolarHBondContact O-N 2.82Å; M477-L527 HydrophobicContact SD-CD1 4.37Å; E479-L527 HydrophobicContact CB-CD2 4.07Å; N525-L527 PolarHBondContact O-N 3.05Å
528	R	84.9	Confident	86.9	Confident	87 Å²	87	43 Å²	43	33%	0.328	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-44.4	-179.5	-61	-170.6	-169.1	100.8	-0.5	112.2	P441 K443 D444 M477 S526	P441-R528 PolarHBondContact O-NE 3.49Å; P441-R528 PolarHBondContact O-NH2 3.08Å; K443-R528 PolarHBondContact O-NH2 3.27Å; D444-R528 IonicContact OD1-CZ 2.73Å; D444-R528 IonicContact OD1-NH1 2.64Å; D444-R528 PolarHBondContact OD1-NH1 2.57Å; D444-R528 IonicContact OD1-NH2 2.63Å; D444-R528 PolarHBondContact OD1-NH2 2.84Å; D444-R528 IonicContact OD2-CZ 3.07Å; D444-R528 IonicContact OD2-NH1 3.79Å; D444-R528 PolarHBondContact OD2-NH1 2.73Å; M477-R528 HydrophobicContact CB-CG 4.28Å; M477-R528 HydrophobicContact CE-CG 4.05Å; M477-R528 HydrophobicContact CG-CG 4.48Å; S526-R528 VanDerWaalsContact C-N 3.28Å; S526-R528 PolarHBondContact O-N 3.17Å
529	G	74.7	Confident	86.7	Confident	72 Å²	72	41.4 Å²	41.4	74%	0.742	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.7	-2.2	-170.1	0	0	0	0	0	115.6	G531	G529-G531 VanDerWaalsContact C-N 3.27Å; G529-G531 PolarHBondContact O-N 2.88Å
530	G	72	Confident	86.6	Confident	55 Å²	55	44 Å²	44	57%	0.567	28%	0.284	S	S	*	.			trans	73.4	13.9	-179.4	0	0	0	0	0	115	S526	S526-G530 VanDerWaalsContact O-CA 3.32Å; S526-G530 WeakPolarHBondContact O-CA 3.42Å; S526-G530 PolarHBondContact O-N 2.63Å
531	G	81.9	Confident	86.6	Confident	35 Å²	35	43.5 Å²	43.5	36%	0.361	28%	0.282	S	S	.	.			trans	-80.4	143.6	176.7	0	0	0	0	0	112.3	S526 G529	S526-G531 VanDerWaalsContact CB-O 3.23Å; S526-G531 WeakPolarHBondContact CB-O 3.5Å; S526-G531 PolarHBondContact N-O 2.76Å; G529-G531 VanDerWaalsContact C-N 3.27Å; G529-G531 PolarHBondContact O-N 2.88Å
532	L	87.8	Confident	86.8	Confident	31 Å²	31	43.3 Å²	43.3	16%	0.162	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	145.3	174.4	-70.3	157.9	0	0	0	111	T481 P485 P488 T523 F524	T481-L532 HydrophobicContact CG2-CD2 4.32Å; P485-L532 HydrophobicContact CB-CD1 3.58Å; P485-L532 HydrophobicContact CG-CD1 3.56Å; P485-L532 HydrophobicContact CG-CD2 4.27Å; P485-L532 HydrophobicContact CG-CG 4.48Å; P488-L532 HydrophobicContact CG-CB 3.93Å; P488-L532 WeakPolarHBondContact CG-O 3.36Å; T523-L532 HydrophobicContact CG2-CD2 4.24Å; F524-L532 WeakPolarHBondContact O-CA 3.4Å
533	M	90.1	Very high	87	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.6	170	173.7	-151.8	155.3	0	0	107.8	F511 T523 F524 F535 R546 L552 L556	F511-M533 HydrophobicContact CZ-CE 4.26Å; F511-M533 HydrophobicContact CZ-SD 4.38Å; T523-M533 CarbonylContact C-O 3.53Å; T523-M533 WeakPolarHBondContact CA-O 3.23Å; F524-M533 HydrophobicContact CB-CB 4.39Å; F524-M533 HydrophobicContact CB-SD 4.47Å; F524-M533 HydrophobicContact CD2-CE 4Å; F524-M533 HydrophobicContact CD2-SD 3.81Å; F524-M533 HydrophobicContact CE2-CE 4.3Å; F524-M533 PolarHBondContact N-O 3.24Å; F524-M533 PolarHBondContact O-N 3.49Å; M533-F535 HydrophobicContact CE-CB 4.08Å; M533-F535 HydrophobicContact CE-CD2 4.13Å; M533-R546 CarbonylContact C-O 3.59Å; M533-R546 WeakPolarHBondContact CA-O 3.26Å; M533-L552 HydrophobicContact CB-CD2 4.33Å; M533-L552 HydrophobicContact CG-CD2 4.47Å; M533-L556 HydrophobicContact CE-CD1 3.44Å; M533-L556 VanDerWaalsContact CE-CD1 3.44Å; M533-L556 HydrophobicContact CE-CD2 3.82Å; M533-L556 HydrophobicContact CE-CG 4.29Å; M533-L556 HydrophobicContact CG-CD1 4.22Å; M533-L556 HydrophobicContact SD-CD1 3.68Å; M533-L556 HydrophobicContact SD-CD2 4.29Å
534	S	90.1	Very high	87.1	Confident	24 Å²	24	42.4 Å²	42.4	17%	0.168	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.6	169.7	62.7	0	0	0	0	110.3	L545 R546	S534-L545 CarbonylContact O-C 3.53Å; S534-L545 WeakPolarHBondContact O-CA 3.49Å; S534-R546 PolarHBondContact N-O 3.47Å; S534-R546 PolarHBondContact O-N 3.41Å; S534-R546 VanDerWaalsContact OG-CB 3.26Å; S534-R546 WeakPolarHBondContact OG-CB 3.43Å; S534-R546 WeakPolarHBondContact OG-CG 3.47Å
535	F	91.1	Very high	87.2	Confident	3 Å²	3	42.5 Å²	42.5	1%	0.013	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.7	174.6	-168	-67.8	0	0	0	107.4	V503 W506 P520 N521 V522 M533 M537 I543 L545 L560	V503-F535 HydrophobicContact CG1-CE1 3.66Å; V503-F535 HydrophobicContact CG1-CZ 3.56Å; W506-F535 HydrophobicContact CH2-CE2 4.45Å; W506-F535 HydrophobicContact CZ3-CD2 4.36Å; W506-F535 AromaticContact CZ3-CE2 3.86Å; W506-F535 HydrophobicContact CZ3-CE2 3.86Å; P520-F535 WeakPolarHBondContact O-CD1 3.49Å; N521-F535 VanDerWaalsContact CA-O 3.31Å; N521-F535 WeakPolarHBondContact CA-O 3.48Å; V522-F535 HydrophobicContact CG2-CB 3.96Å; V522-F535 PolarHBondContact N-O 3.38Å; V522-F535 PolarHBondContact O-N 3.25Å; M533-F535 HydrophobicContact CE-CB 4.08Å; M533-F535 HydrophobicContact CE-CD2 4.13Å; F535-M537 HydrophobicContact CE1-CB 4.49Å; F535-I543 HydrophobicContact CE1-CD1 4.38Å; F535-I543 HydrophobicContact CE1-CG1 4.43Å; F535-I543 HydrophobicContact CE1-CG2 3.95Å; F535-I543 HydrophobicContact CE2-CG2 4.2Å; F535-I543 HydrophobicContact CZ-CD1 3.95Å; F535-I543 HydrophobicContact CZ-CG1 4.41Å; F535-I543 HydrophobicContact CZ-CG2 3.75Å; F535-L545 HydrophobicContact CB-CD2 4.26Å; F535-L545 HydrophobicContact CD2-CD2 3.1Å; F535-L545 HydrophobicContact CE2-CD2 3.45Å; F535-L545 VanDerWaalsContact CE2-CD2 3.45Å; F535-L545 HydrophobicContact CG-CD2 3.76Å; F535-L545 HydrophobicContact CZ-CD2 4.34Å; F535-L560 HydrophobicContact CZ-CD2 4.35Å
536	H	91.2	Very high	87.4	Confident	88 Å²	88	45 Å²	45	41%	0.407	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.1	176.7	176.1	-84	0	0	0	110.6	N521 I543 T544	N521-H536 VanDerWaalsContact CG-CD2 3.5Å; N521-H536 WeakPolarHBondContact OD1-CA 3.28Å; N521-H536 PolarHBondContact OD1-CD2 2.68Å; H536-I543 CarbonylContact O-C 3.54Å; H536-I543 WeakPolarHBondContact O-CA 3.43Å; H536-T544 PolarHBondContact N-O 2.87Å; H536-T544 PolarHBondContact O-N 3.26Å
537	M	90.9	Very high	87.5	Confident	13 Å²	13	44.3 Å²	44.3	6%	0.064	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.8	173.5	-174.4	-179.4	-179.4	0	0	110	I496 P500 V503 P520 N521 F535 Q542 I543	I496-M537 HydrophobicContact CD1-CE 4.01Å; I496-M537 HydrophobicContact CG1-CE 4.11Å; P500-M537 HydrophobicContact CB-CE 4.41Å; P500-M537 HydrophobicContact CB-SD 3.97Å; P500-M537 HydrophobicContact CG-CE 3.95Å; P500-M537 HydrophobicContact CG-SD 4.08Å; V503-M537 HydrophobicContact CB-SD 4.33Å; V503-M537 HydrophobicContact CG2-CE 4.47Å; V503-M537 HydrophobicContact CG2-SD 3.87Å; P520-M537 HydrophobicContact CB-CB 3.86Å; P520-M537 HydrophobicContact CG-CB 3.78Å; P520-M537 HydrophobicContact CG-SD 4.48Å; N521-M537 PolarHBondContact OD1-N 3.46Å; F535-M537 HydrophobicContact CE1-CB 4.49Å; M537-Q542 WeakPolarHBondContact CA-O 3.26Å; M537-I543 HydrophobicContact CB-CG1 4.17Å; M537-I543 HydrophobicContact CG-CG1 3.92Å; M537-I543 HydrophobicContact SD-CG1 4.49Å
538	A	88.5	Confident	87.7	Confident	27 Å²	27	47 Å²	47	22%	0.223	29%	0.289	C	S	.	.			trans	-77.1	159.8	174.5	0	0	0	0	0	111.7	N540 G541 Q542	A538-N540 WeakPolarHBondContact CB-OD1 3.33Å; A538-N540 PolarHBondContact O-N 2.94Å; A538-G541 PolarHBondContact O-N 3.48Å; A538-Q542 HydrophobicContact CB-CB 4.37Å; A538-Q542 PolarHBondContact N-O 2.87Å
539	S	82.8	Confident	88	Confident	136 Å²	136	46.4 Å²	46.4	95%	0.951	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.9	-178.4	54	0	0	0	0	114.3	G541	S539-G541 PolarHBondContact O-N 3.44Å
540	N	84.1	Confident	88.8	Confident	110 Å²	110	43.4 Å²	43.4	59%	0.588	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	2.1	174.1	66.5	-8	0	0	0	113.5	A538 Q542	A538-N540 WeakPolarHBondContact CB-OD1 3.33Å; A538-N540 PolarHBondContact O-N 2.94Å; N540-Q542 WeakPolarHBondContact OD1-CB 3.34Å; N540-Q542 PolarHBondContact OD1-N 3.3Å
541	G	84.5	Confident	89.7	Confident	9 Å²	9	43.5 Å²	43.5	9%	0.093	25%	0.247	C	C	.	.	S	Bend	trans	85.4	4.3	-177.6	0	0	0	0	0	114.6	I496 A538 S539	I496-G541 WeakPolarHBondContact CG1-O 3.19Å; I496-G541 PolarHBondContact N-O 2.96Å; A538-G541 PolarHBondContact O-N 3.48Å; S539-G541 PolarHBondContact O-N 3.44Å
542	Q	91.9	Very high	90.1	Very high	71 Å²	71	42.2 Å²	42.2	33%	0.332	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	123.6	174.7	-170	176.8	21.8	0	0	110.5	M537 A538 N540	M537-Q542 WeakPolarHBondContact CA-O 3.26Å; A538-Q542 HydrophobicContact CB-CB 4.37Å; A538-Q542 PolarHBondContact N-O 2.87Å; N540-Q542 WeakPolarHBondContact OD1-CB 3.34Å; N540-Q542 PolarHBondContact OD1-N 3.3Å
543	I	93.4	Very high	90.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.8	172.5	-66.3	173	0	0	0	108.7	S493 F494 I496 F535 H536 M537 L545 L560	S493-I543 VanDerWaalsContact CA-O 3.31Å; S493-I543 WeakPolarHBondContact CA-O 3.05Å; F494-I543 HydrophobicContact CD2-CB 4.41Å; F494-I543 HydrophobicContact CE1-CB 4.27Å; F494-I543 HydrophobicContact CE1-CG2 3.98Å; F494-I543 HydrophobicContact CE2-CB 3.98Å; F494-I543 HydrophobicContact CE2-CD1 3.81Å; F494-I543 HydrophobicContact CE2-CG1 4.41Å; F494-I543 HydrophobicContact CE2-CG2 4.31Å; F494-I543 HydrophobicContact CZ-CB 3.89Å; F494-I543 HydrophobicContact CZ-CD1 4.09Å; F494-I543 HydrophobicContact CZ-CG2 3.72Å; F494-I543 PolarHBondContact N-O 3.34Å; F494-I543 VanDerWaalsContact N-O 3.08Å; F494-I543 PolarHBondContact O-N 3.44Å; I496-I543 HydrophobicContact CD1-CD1 3.35Å; I496-I543 HydrophobicContact CD1-CG1 4.28Å; I496-I543 HydrophobicContact CG1-CD1 3.76Å; I496-I543 HydrophobicContact CG1-CG1 4.28Å; I496-I543 HydrophobicContact CG2-CD1 4.33Å; F535-I543 HydrophobicContact CE1-CD1 4.38Å; F535-I543 HydrophobicContact CE1-CG1 4.43Å; F535-I543 HydrophobicContact CE1-CG2 3.95Å; F535-I543 HydrophobicContact CE2-CG2 4.2Å; F535-I543 HydrophobicContact CZ-CD1 3.95Å; F535-I543 HydrophobicContact CZ-CG1 4.41Å; F535-I543 HydrophobicContact CZ-CG2 3.75Å; H536-I543 CarbonylContact O-C 3.54Å; H536-I543 WeakPolarHBondContact O-CA 3.43Å; M537-I543 HydrophobicContact CB-CG1 4.17Å; M537-I543 HydrophobicContact CG-CG1 3.92Å; M537-I543 HydrophobicContact SD-CG1 4.49Å; I543-L545 HydrophobicContact CG2-CD2 3.97Å; I543-L545 HydrophobicContact CG2-CG 4.19Å; I543-L560 HydrophobicContact CD1-CD2 3.76Å
544	T	93.2	Very high	90.5	Very high	31 Å²	31	40.7 Å²	40.7	19%	0.19	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	114	172.3	-52.4	0	0	0	0	108.5	V492 H536 R546	V492-T544 WeakPolarHBondContact O-CA 3.46Å; H536-T544 PolarHBondContact N-O 2.87Å; H536-T544 PolarHBondContact O-N 3.26Å; T544-R546 HydrophobicContact CG2-CG 4.3Å
545	L	93.4	Very high	90.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132.7	169.8	-52.6	175.7	0	0	0	108.2	T491 V492 F494 S534 F535 I543 L556 V557	T491-L545 CarbonylContact C-O 3.58Å; T491-L545 WeakPolarHBondContact CA-O 2.93Å; V492-L545 HydrophobicContact CB-CB 4.24Å; V492-L545 PolarHBondContact N-O 3.2Å; V492-L545 PolarHBondContact O-N 2.91Å; F494-L545 HydrophobicContact CE1-CD1 3.95Å; F494-L545 HydrophobicContact CE1-CG 4.24Å; S534-L545 CarbonylContact O-C 3.53Å; S534-L545 WeakPolarHBondContact O-CA 3.49Å; F535-L545 HydrophobicContact CB-CD2 4.26Å; F535-L545 HydrophobicContact CD2-CD2 3.1Å; F535-L545 HydrophobicContact CE2-CD2 3.45Å; F535-L545 VanDerWaalsContact CE2-CD2 3.45Å; F535-L545 HydrophobicContact CG-CD2 3.76Å; F535-L545 HydrophobicContact CZ-CD2 4.34Å; I543-L545 HydrophobicContact CG2-CD2 3.97Å; I543-L545 HydrophobicContact CG2-CG 4.19Å; L545-L556 HydrophobicContact CD1-CB 4.19Å; L545-V557 HydrophobicContact CD1-CG2 3.84Å
546	R	92.7	Very high	90.7	Very high	107 Å²	107	40.5 Å²	40.5	40%	0.404	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.7	169.1	-41.8	-177.2	167.8	-166	-4	110.1	P488 G490 T491 M533 S534 T544	P488-R546 HydrophobicContact CB-CB 4.38Å; P488-R546 HydrophobicContact CG-CB 4.46Å; G490-R546 CarbonylContact O-C 3.52Å; G490-R546 VanDerWaalsContact O-CA 3.24Å; G490-R546 WeakPolarHBondContact O-CA 3.36Å; T491-R546 HydrophobicContact CG2-CG 4.14Å; M533-R546 CarbonylContact C-O 3.59Å; M533-R546 WeakPolarHBondContact CA-O 3.26Å; S534-R546 PolarHBondContact N-O 3.47Å; S534-R546 PolarHBondContact O-N 3.41Å; S534-R546 VanDerWaalsContact OG-CB 3.26Å; S534-R546 WeakPolarHBondContact OG-CB 3.43Å; S534-R546 WeakPolarHBondContact OG-CG 3.47Å; T544-R546 HydrophobicContact CG2-CG 4.3Å
547	T	91.9	Very high	90.8	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.031	20%	0.202	C	C	.	.			trans	-163.2	147	177.3	-177.2	0	0	0	0	107.8	G490 D549 A553 F575	G490-T547 CarbonylContact C-O 3.6Å; G490-T547 VanDerWaalsContact CA-O 3.22Å; G490-T547 WeakPolarHBondContact CA-O 3.47Å; G490-T547 PolarHBondContact O-N 3.33Å; T547-D549 VanDerWaalsContact C-N 3.28Å; T547-D549 WeakPolarHBondContact CG2-O 3.29Å; T547-D549 PolarHBondContact OG1-N 2.81Å; T547-A553 HydrophobicContact CG2-CB 3.81Å; T547-F575 VanDerWaalsContact O-CE1 3.28Å; T547-F575 WeakPolarHBondContact O-CE1 3.04Å
548	D	90.6	Very high	90.8	Very high	81 Å²	81	37.8 Å²	37.8	43%	0.433	21%	0.208	S	C	.	.	S	Bend	trans	-84.1	-8.3	174.8	-60.6	-40.2	0	0	0	112.1	A489 G490	A489-D548 PolarHBondContact N-OD1 3.48Å; G490-D548 PolarHBondContact N-OD1 3.38Å
549	D	90.8	Very high	91	Very high	73 Å²	73	36.9 Å²	36.9	39%	0.39	20%	0.2	S	C	.	.			trans	-94.8	109.5	178.7	-172.2	-22.1	0	0	0	111	T547 D551 L552 A553	T547-D549 VanDerWaalsContact C-N 3.28Å; T547-D549 WeakPolarHBondContact CG2-O 3.29Å; T547-D549 PolarHBondContact OG1-N 2.81Å; D549-D551 WeakPolarHBondContact OD1-CB 3.39Å; D549-D551 PolarHBondContact OD1-N 2.83Å; D549-L552 HydrophobicContact CB-CB 3.92Å; D549-L552 PolarHBondContact OD1-N 2.99Å; D549-L552 VanDerWaalsContact OD1-N 3.15Å; D549-A553 PolarHBondContact O-N 2.82Å; D549-A553 VanDerWaalsContact O-N 3.14Å
550	I	91.8	Very high	91.5	Very high	10 Å²	10	30.6 Å²	30.6	5%	0.051	16%	0.156	C	C	.	.	H	α-helix	trans	-68.3	-32.4	179.8	-169.6	169.4	0	0	0	112.9	A553 G554 F575 Y578 R670 L674	I550-A553 PolarHBondContact O-N 3.48Å; I550-G554 PolarHBondContact O-N 2.76Å; I550-F575 HydrophobicContact CB-CD1 4.4Å; I550-F575 HydrophobicContact CB-CE1 4.18Å; I550-F575 HydrophobicContact CB-CE2 4.35Å; I550-F575 HydrophobicContact CB-CZ 4.15Å; I550-F575 HydrophobicContact CD1-CD2 4.12Å; I550-F575 HydrophobicContact CD1-CE2 4.21Å; I550-F575 HydrophobicContact CG1-CD2 4.21Å; I550-F575 HydrophobicContact CG1-CE2 3.88Å; I550-F575 HydrophobicContact CG1-CZ 4.08Å; I550-Y578 HydrophobicContact CD1-CD1 3.91Å; I550-Y578 HydrophobicContact CD1-CE1 3.74Å; I550-Y578 HydrophobicContact CG2-CE1 4.35Å; I550-Y578 HydrophobicContact CG2-CE2 4.5Å; I550-R670 HydrophobicContact CD1-CB 3.99Å; I550-R670 HydrophobicContact CG1-CB 4.3Å; I550-R670 HydrophobicContact CG2-CG 4.42Å; I550-L674 HydrophobicContact CD1-CD1 4.06Å; I550-L674 HydrophobicContact CG1-CD1 3.98Å; I550-L674 HydrophobicContact CG1-CG 4.41Å
551	D	90.3	Very high	91.9	Very high	57 Å²	57	25.4 Å²	25.4	31%	0.305	13%	0.129	S	C	.	.	H	α-helix	trans	-70.3	-45.3	-179.7	-69.9	-50.5	0	0	0	109.5	D549 A553 G554 D555 R670	D549-D551 WeakPolarHBondContact OD1-CB 3.39Å; D549-D551 PolarHBondContact OD1-N 2.83Å; D551-A553 VanDerWaalsContact C-N 3.35Å; D551-A553 PolarHBondContact O-N 2.87Å; D551-G554 WeakPolarHBondContact O-CA 3.11Å; D551-G554 PolarHBondContact O-N 3.16Å; D551-G554 VanDerWaalsContact O-N 3.14Å; D551-D555 PolarHBondContact O-N 2.82Å; D551-R670 VanDerWaalsContact CG-NE 3.34Å; D551-R670 WeakPolarHBondContact OD1-CG 3.19Å; D551-R670 IonicContact OD1-CZ 2.74Å; D551-R670 IonicContact OD1-NE 2.83Å; D551-R670 PolarHBondContact OD1-NE 3Å; D551-R670 IonicContact OD1-NH2 3.86Å; D551-R670 IonicContact OD2-CZ 3.21Å; D551-R670 IonicContact OD2-NE 3.28Å; D551-R670 PolarHBondContact OD2-NE 3.3Å; D551-R670 VanDerWaalsContact OD2-NE 3.14Å; D551-R670 IonicContact OD2-NH2 2.83Å; D551-R670 PolarHBondContact OD2-NH2 3.04Å
552	L	91.8	Very high	92.2	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-45.9	173.9	177.8	56.5	0	0	0	111.8	F475 Y478 M533 D549 G554 D555 L556	F475-L552 HydrophobicContact CD1-CD1 4.27Å; F475-L552 HydrophobicContact CE1-CD1 4.19Å; Y478-L552 HydrophobicContact CE1-CD1 4.12Å; Y478-L552 HydrophobicContact CE1-CD2 3.61Å; Y478-L552 HydrophobicContact CE2-CD1 4.31Å; Y478-L552 WeakPolarHBondContact OH-CD1 3.42Å; M533-L552 HydrophobicContact CB-CD2 4.33Å; M533-L552 HydrophobicContact CG-CD2 4.47Å; D549-L552 HydrophobicContact CB-CB 3.92Å; D549-L552 PolarHBondContact OD1-N 2.99Å; D549-L552 VanDerWaalsContact OD1-N 3.15Å; L552-G554 VanDerWaalsContact C-N 3.29Å; L552-G554 PolarHBondContact O-N 3.41Å; L552-D555 PolarHBondContact O-N 3.38Å; L552-L556 HydrophobicContact CD1-CD1 4.06Å; L552-L556 HydrophobicContact CD1-CG 4.08Å; L552-L556 HydrophobicContact CG-CD1 3.94Å; L552-L556 HydrophobicContact CG-CG 4.44Å; L552-L556 WeakPolarHBondContact O-CD1 3.45Å; L552-L556 VanDerWaalsContact O-CG 3.23Å; L552-L556 WeakPolarHBondContact O-CG 3.18Å; L552-L556 PolarHBondContact O-N 2.89Å
553	A	93.3	Very high	92.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59	-42.1	176.4	0	0	0	0	0	111.7	V492 T547 D549 I550 D551 V557 F575 L674	V492-A553 HydrophobicContact CG2-CB 3.96Å; T547-A553 HydrophobicContact CG2-CB 3.81Å; D549-A553 PolarHBondContact O-N 2.82Å; D549-A553 VanDerWaalsContact O-N 3.14Å; I550-A553 PolarHBondContact O-N 3.48Å; D551-A553 VanDerWaalsContact C-N 3.35Å; D551-A553 PolarHBondContact O-N 2.87Å; A553-V557 VanDerWaalsContact O-CG2 3.26Å; A553-V557 WeakPolarHBondContact O-CG2 3.44Å; A553-V557 PolarHBondContact O-N 3.36Å; A553-F575 HydrophobicContact CB-CZ 3.89Å; A553-L674 HydrophobicContact CB-CD2 3.81Å
554	G	92.2	Very high	92.1	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-59	-48.6	173.8	0	0	0	0	0	112.4	I550 D551 L552 L556 V557 Q558	I550-G554 PolarHBondContact O-N 2.76Å; D551-G554 WeakPolarHBondContact O-CA 3.11Å; D551-G554 PolarHBondContact O-N 3.16Å; D551-G554 VanDerWaalsContact O-N 3.14Å; L552-G554 VanDerWaalsContact C-N 3.29Å; L552-G554 PolarHBondContact O-N 3.41Å; G554-L556 VanDerWaalsContact C-N 3.35Å; G554-L556 PolarHBondContact O-N 3.49Å; G554-V557 PolarHBondContact O-N 3.43Å; G554-Q558 WeakPolarHBondContact O-CB 3.35Å; G554-Q558 VanDerWaalsContact O-CG 3.25Å; G554-Q558 WeakPolarHBondContact O-CG 3.3Å; G554-Q558 PolarHBondContact O-N 3.21Å
555	D	91.5	Very high	91.9	Very high	22 Å²	22	31.9 Å²	31.9	12%	0.118	18%	0.179	C	C	.	.	H	α-helix	trans	-64.7	-37.4	-178.5	-73.4	-14.2	0	0	0	113	F475 D551 L552 S559 R673	F475-D555 HydrophobicContact CE1-CB 4.05Å; F475-D555 HydrophobicContact CZ-CB 4.26Å; D551-D555 PolarHBondContact O-N 2.82Å; L552-D555 PolarHBondContact O-N 3.38Å; D555-S559 VanDerWaalsContact O-CB 3.23Å; D555-S559 WeakPolarHBondContact O-CB 3.33Å; D555-S559 PolarHBondContact O-N 3.34Å; D555-S559 PolarHBondContact O-OG 2.83Å; D555-R673 IonicContact OD1-CZ 3.45Å; D555-R673 VanDerWaalsContact OD1-CZ 3.25Å; D555-R673 IonicContact OD1-NE 3.16Å; D555-R673 PolarHBondContact OD1-NE 3.22Å; D555-R673 IonicContact OD1-NH2 3.2Å; D555-R673 PolarHBondContact OD1-NH2 3.13Å
556	L	93.3	Very high	91.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-64.9	-46.7	174.1	-67.4	165.1	0	0	0	111.3	F475 W506 F511 M533 L545 L552 G554 S559 L560	F475-L556 HydrophobicContact CD1-CD2 4.37Å; F475-L556 HydrophobicContact CD2-CD2 4.17Å; F475-L556 HydrophobicContact CE1-CD2 4.01Å; F475-L556 HydrophobicContact CE1-CG 4.39Å; F475-L556 HydrophobicContact CE2-CD2 3.81Å; F475-L556 HydrophobicContact CG-CD2 4.45Å; F475-L556 HydrophobicContact CZ-CD2 3.72Å; F475-L556 HydrophobicContact CZ-CG 4.23Å; W506-L556 HydrophobicContact CH2-CD2 3.75Å; W506-L556 HydrophobicContact CZ2-CD2 4.4Å; F511-L556 HydrophobicContact CE2-CD2 4.36Å; F511-L556 HydrophobicContact CZ-CD2 3.81Å; M533-L556 HydrophobicContact CE-CD1 3.44Å; M533-L556 VanDerWaalsContact CE-CD1 3.44Å; M533-L556 HydrophobicContact CE-CD2 3.82Å; M533-L556 HydrophobicContact CE-CG 4.29Å; M533-L556 HydrophobicContact CG-CD1 4.22Å; M533-L556 HydrophobicContact SD-CD1 3.68Å; M533-L556 HydrophobicContact SD-CD2 4.29Å; L545-L556 HydrophobicContact CD1-CB 4.19Å; L552-L556 HydrophobicContact CD1-CD1 4.06Å; L552-L556 HydrophobicContact CD1-CG 4.08Å; L552-L556 HydrophobicContact CG-CD1 3.94Å; L552-L556 HydrophobicContact CG-CG 4.44Å; L552-L556 WeakPolarHBondContact O-CD1 3.45Å; L552-L556 VanDerWaalsContact O-CG 3.23Å; L552-L556 WeakPolarHBondContact O-CG 3.18Å; L552-L556 PolarHBondContact O-N 2.89Å; G554-L556 VanDerWaalsContact C-N 3.35Å; G554-L556 PolarHBondContact O-N 3.49Å; L556-S559 PolarHBondContact O-OG 3.5Å; L556-L560 VanDerWaalsContact O-CB 3.22Å; L556-L560 WeakPolarHBondContact O-CB 3.37Å; L556-L560 PolarHBondContact O-N 2.82Å
557	V	93.8	Very high	91.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-47.8	178.7	173.1	0	0	0	0	111	V492 F494 L545 A553 G554 L560 A561 L569 V571 V676	V492-V557 HydrophobicContact CG1-CG2 4.4Å; F494-V557 HydrophobicContact CD1-CG2 4.38Å; F494-V557 HydrophobicContact CE1-CG2 3.77Å; F494-V557 HydrophobicContact CZ-CG2 4.32Å; L545-V557 HydrophobicContact CD1-CG2 3.84Å; A553-V557 VanDerWaalsContact O-CG2 3.26Å; A553-V557 WeakPolarHBondContact O-CG2 3.44Å; A553-V557 PolarHBondContact O-N 3.36Å; G554-V557 PolarHBondContact O-N 3.43Å; V557-L560 PolarHBondContact O-N 2.97Å; V557-A561 VanDerWaalsContact O-CB 3.27Å; V557-A561 WeakPolarHBondContact O-CB 3.26Å; V557-A561 PolarHBondContact O-N 2.79Å; V557-L569 HydrophobicContact CG1-CD2 3.65Å; V557-V571 HydrophobicContact CG1-CG2 4.41Å; V557-V676 HydrophobicContact CG1-CG2 4.41Å
558	Q	91.6	Very high	91.2	Very high	44 Å²	44	40.8 Å²	40.8	21%	0.206	23%	0.228	C	C	.	.	H	α-helix	trans	-63.7	-44.6	-180	-68.5	-63.1	-30.8	0	0	112.1	G554 A561 S562 R673 R675	G554-Q558 WeakPolarHBondContact O-CB 3.35Å; G554-Q558 VanDerWaalsContact O-CG 3.25Å; G554-Q558 WeakPolarHBondContact O-CG 3.3Å; G554-Q558 PolarHBondContact O-N 3.21Å; Q558-A561 PolarHBondContact O-N 3.25Å; Q558-S562 VanDerWaalsContact O-CB 3.31Å; Q558-S562 WeakPolarHBondContact O-CB 3.48Å; Q558-S562 PolarHBondContact O-N 2.82Å; Q558-R673 HydrophobicContact CG-CG 4.05Å; Q558-R673 WeakPolarHBondContact CG-O 3.35Å; Q558-R673 PolarHBondContact NE2-O 3.49Å; Q558-R675 PolarHBondContact NE2-O 3.3Å
559	S	93.1	Very high	91.2	Very high	8 Å²	8	37.4 Å²	37.4	6%	0.056	21%	0.21	C	C	.	.	H	α-helix	trans	-69	-36.9	179.7	57.9	0	0	0	0	112.7	F475 W506 D555 L556 F563	F475-S559 WeakPolarHBondContact CE2-OG 3.22Å; W506-S559 WeakPolarHBondContact CZ2-OG 3.49Å; D555-S559 VanDerWaalsContact O-CB 3.23Å; D555-S559 WeakPolarHBondContact O-CB 3.33Å; D555-S559 PolarHBondContact O-N 3.34Å; D555-S559 PolarHBondContact O-OG 2.83Å; L556-S559 PolarHBondContact O-OG 3.5Å; S559-F563 WeakPolarHBondContact O-CB 3.31Å; S559-F563 PolarHBondContact O-N 2.88Å
560	L	92.6	Very high	91.2	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-66.6	-45.6	174.2	-178.1	65.6	0	0	0	111.4	F494 W506 F535 I543 L556 V557 S562 F563 L564	F494-L560 HydrophobicContact CE2-CD2 4.03Å; F494-L560 HydrophobicContact CZ-CD2 3.92Å; W506-L560 HydrophobicContact CB-CD1 4.35Å; W506-L560 HydrophobicContact CD2-CD1 3.77Å; W506-L560 HydrophobicContact CE3-CD1 4.03Å; W506-L560 HydrophobicContact CG-CD1 3.9Å; W506-L560 HydrophobicContact CZ2-CB 4.21Å; F535-L560 HydrophobicContact CZ-CD2 4.35Å; I543-L560 HydrophobicContact CD1-CD2 3.76Å; L556-L560 VanDerWaalsContact O-CB 3.22Å; L556-L560 WeakPolarHBondContact O-CB 3.37Å; L556-L560 PolarHBondContact O-N 2.82Å; V557-L560 PolarHBondContact O-N 2.97Å; L560-S562 PolarHBondContact O-N 2.78Å; L560-F563 PolarHBondContact O-N 2.93Å; L560-L564 HydrophobicContact CD1-CD1 3.96Å; L560-L564 HydrophobicContact CD1-CG 4.25Å; L560-L564 HydrophobicContact CG-CD1 4.03Å; L560-L564 WeakPolarHBondContact O-CB 3.23Å; L560-L564 WeakPolarHBondContact O-CG 3.41Å; L560-L564 PolarHBondContact O-N 2.79Å
561	A	92	Very high	91.2	Very high	2 Å²	2	38 Å²	38	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-42.8	178.1	0	0	0	0	0	112	V557 Q558 L564 A565 M566 V676	V557-A561 VanDerWaalsContact O-CB 3.27Å; V557-A561 WeakPolarHBondContact O-CB 3.26Å; V557-A561 PolarHBondContact O-N 2.79Å; Q558-A561 PolarHBondContact O-N 3.25Å; A561-L564 CarbonylContact O-C 3.57Å; A561-L564 PolarHBondContact O-N 2.94Å; A561-A565 PolarHBondContact O-N 2.84Å; A561-M566 HydrophobicContact CB-CB 4.2Å; A561-M566 PolarHBondContact O-N 3.23Å; A561-V676 HydrophobicContact CB-CB 4.41Å; A561-V676 HydrophobicContact CB-CG1 4.29Å; A561-V676 HydrophobicContact CB-CG2 3.63Å
562	S	90.6	Very high	91.4	Very high	96 Å²	96	41.4 Å²	41.4	67%	0.671	24%	0.235	S	C	*	.	H	α-helix	trans	-61	-44.3	174.7	179.1	0	0	0	0	111.8	Q558 L560 L564 A565	Q558-S562 VanDerWaalsContact O-CB 3.31Å; Q558-S562 WeakPolarHBondContact O-CB 3.48Å; Q558-S562 PolarHBondContact O-N 2.82Å; L560-S562 PolarHBondContact O-N 2.78Å; S562-L564 VanDerWaalsContact C-N 3.34Å; S562-L564 PolarHBondContact O-N 2.92Å; S562-A565 PolarHBondContact O-N 2.87Å; S562-A565 VanDerWaalsContact O-N 3.14Å
563	F	92.1	Very high	91.5	Very high	52 Å²	52	41.1 Å²	41.1	23%	0.228	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-35.8	178.2	179.6	-98.3	0	0	0	113.7	M505 W506 Q509 S559 L560 A565	M505-F563 HydrophobicContact CE-CE1 4.14Å; M505-F563 HydrophobicContact CE-CE2 4.35Å; M505-F563 HydrophobicContact CE-CZ 3.44Å; M505-F563 VanDerWaalsContact CE-CZ 3.44Å; M505-F563 HydrophobicContact CG-CZ 4.37Å; W506-F563 HydrophobicContact CB-CD1 3.7Å; W506-F563 HydrophobicContact CB-CE1 3.62Å; W506-F563 HydrophobicContact CB-CG 4.23Å; W506-F563 HydrophobicContact CB-CZ 4.06Å; W506-F563 AromaticContact CD1-CD1 3.8Å; W506-F563 AromaticContact CD1-CD2 3.99Å; W506-F563 AromaticContact CD1-CG 3.5Å; W506-F563 HydrophobicContact CG-CB 4.49Å; W506-F563 HydrophobicContact CG-CD1 4.07Å; W506-F563 HydrophobicContact CG-CE1 4.43Å; W506-F563 HydrophobicContact CG-CG 4.21Å; Q509-F563 VanDerWaalsContact OE1-CE2 3.24Å; S559-F563 WeakPolarHBondContact O-CB 3.31Å; S559-F563 PolarHBondContact O-N 2.88Å; L560-F563 PolarHBondContact O-N 2.93Å; F563-A565 VanDerWaalsContact C-N 3.29Å
564	L	91.2	Very high	91.5	Very high	13 Å²	13	43.5 Å²	43.5	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-84.9	-3.6	176.4	-64.2	178.8	0	0	0	112.9	I496 E498 R502 L560 A561 S562 M566	I496-L564 HydrophobicContact CD1-CD1 4.03Å; E498-L564 HydrophobicContact CB-CD1 4.46Å; E498-L564 HydrophobicContact CG-CD1 4.36Å; E498-L564 HydrophobicContact CG-CD2 4.19Å; R502-L564 HydrophobicContact CB-CD2 4.24Å; L560-L564 HydrophobicContact CD1-CD1 3.96Å; L560-L564 HydrophobicContact CD1-CG 4.25Å; L560-L564 HydrophobicContact CG-CD1 4.03Å; L560-L564 WeakPolarHBondContact O-CB 3.23Å; L560-L564 WeakPolarHBondContact O-CG 3.41Å; L560-L564 PolarHBondContact O-N 2.79Å; A561-L564 CarbonylContact O-C 3.57Å; A561-L564 PolarHBondContact O-N 2.94Å; S562-L564 VanDerWaalsContact C-N 3.34Å; S562-L564 PolarHBondContact O-N 2.92Å; L564-M566 HydrophobicContact CB-CG 3.9Å; L564-M566 HydrophobicContact CB-SD 4.34Å; L564-M566 HydrophobicContact CD1-SD 4.29Å
565	A	89.8	Confident	91.5	Very high	86 Å²	86	43.5 Å²	43.5	71%	0.711	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	46	-174.4	0	0	0	0	0	113.1	A561 S562 F563	A561-A565 PolarHBondContact O-N 2.84Å; S562-A565 PolarHBondContact O-N 2.87Å; S562-A565 VanDerWaalsContact O-N 3.14Å; F563-A565 VanDerWaalsContact C-N 3.29Å
566	M	88	Confident	91.5	Very high	52 Å²	52	44.7 Å²	44.7	26%	0.256	26%	0.255	S	S	.	.			trans	-84.5	127.1	176.4	-60.9	-175.4	67.7	0	0	110.8	I496 A561 L564 L569	I496-M566 HydrophobicContact CG2-CE 4.28Å; I496-M566 HydrophobicContact CG2-SD 4.04Å; A561-M566 HydrophobicContact CB-CB 4.2Å; A561-M566 PolarHBondContact O-N 3.23Å; L564-M566 HydrophobicContact CB-CG 3.9Å; L564-M566 HydrophobicContact CB-SD 4.34Å; L564-M566 HydrophobicContact CD1-SD 4.29Å; M566-L569 HydrophobicContact CE-CB 4.45Å; M566-L569 HydrophobicContact CE-CD1 3.76Å
567	E	85.9	Confident	91.5	Very high	170 Å²	170	48.3 Å²	48.3	79%	0.794	28%	0.28	S	S	*	.	S	Bend	trans	-80.5	-41.9	177.6	-65.7	-177.8	176.4	0	0	112.4	G677	E567-G677 WeakPolarHBondContact O-CA 3.4Å; E567-G677 PolarHBondContact O-N 2.83Å
568	D	88.8	Confident	91.4	Very high	78 Å²	78	49.9 Å²	49.9	42%	0.417	29%	0.286	S	S	.	.			trans	-130.2	131.9	-176.5	-77.8	-36.7	0	0	0	110.7	V676 G677 K678	D568-V676 WeakPolarHBondContact CA-O 3.4Å; D568-G677 VanDerWaalsContact OD1-CA 3.29Å; D568-G677 WeakPolarHBondContact OD1-CA 3.12Å; D568-K678 PolarHBondContact OD1-N 2.88Å
569	L	90.5	Very high	91.4	Very high	10 Å²	10	48 Å²	48	5%	0.052	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-143.7	120.4	174.6	-176.7	67.5	0	0	0	111.3	F494 V557 M566 V571 V676	F494-L569 HydrophobicContact CB-CD1 4.18Å; F494-L569 HydrophobicContact CD2-CD1 3.94Å; F494-L569 HydrophobicContact CD2-CD2 3.93Å; F494-L569 HydrophobicContact CD2-CG 4.46Å; F494-L569 HydrophobicContact CE2-CD2 4.21Å; F494-L569 HydrophobicContact CG-CD1 4.36Å; F494-L569 HydrophobicContact CG-CD2 4.29Å; V557-L569 HydrophobicContact CG1-CD2 3.65Å; M566-L569 HydrophobicContact CE-CB 4.45Å; M566-L569 HydrophobicContact CE-CD1 3.76Å; L569-V571 HydrophobicContact CD2-CG2 4.2Å; L569-V571 HydrophobicContact CG-CG2 4.05Å; L569-V676 HydrophobicContact CB-CB 3.87Å; L569-V676 HydrophobicContact CB-CG2 4.06Å; L569-V676 HydrophobicContact CD2-CG2 4.42Å; L569-V676 PolarHBondContact N-O 3.01Å; L569-V676 PolarHBondContact O-N 2.95Å; L569-V676 VanDerWaalsContact O-N 3.11Å
570	S	90.9	Very high	91.3	Very high	90 Å²	90	52.3 Å²	52.3	63%	0.629	30%	0.297	S	S	*	.			trans	-94.5	143.2	170.2	61.6	0	0	0	0	111.1
571	V	92.4	Very high	91.3	Very high	6 Å²	6	58 Å²	58	4%	0.036	32%	0.323	C	S	.	.			trans	-135.7	141.1	-173.9	-179.3	0	0	0	0	110.4	V492 F494 V557 L569 L674 R675	V492-V571 HydrophobicContact CB-CG1 4.49Å; V492-V571 HydrophobicContact CG1-CG1 3.15Å; F494-V571 HydrophobicContact CB-CG2 3.97Å; F494-V571 HydrophobicContact CD1-CG1 4.39Å; F494-V571 HydrophobicContact CD1-CG2 4.3Å; F494-V571 HydrophobicContact CG-CG2 4.31Å; V557-V571 HydrophobicContact CG1-CG2 4.41Å; L569-V571 HydrophobicContact CD2-CG2 4.2Å; L569-V571 HydrophobicContact CG-CG2 4.05Å; V571-L674 WeakPolarHBondContact CG2-O 3.47Å; V571-R675 HydrophobicContact CB-CG 4.18Å; V571-R675 HydrophobicContact CG2-CG 4.35Å; V571-R675 PolarHBondContact O-NE 2.99Å; V571-R675 PolarHBondContact O-NH2 3.33Å
572	E	93.3	Very high	91.3	Very high	128 Å²	128	58.2 Å²	58.2	60%	0.598	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	120	167.7	-174.2	176.1	-174.4	0	0	108.8	V492 S493 R704	V492-E572 CarbonylContact C-O 3.57Å; V492-E572 WeakPolarHBondContact CA-O 3.49Å; S493-E572 PolarHBondContact N-O 2.86Å; S493-E572 PolarHBondContact O-N 3.4Å; E572-R704 WeakPolarHBondContact CA-O 3.22Å
573	A	94	Very high	91.3	Very high	2 Å²	2	57.3 Å²	57.3	2%	0.017	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.7	-174.7	0	0	0	0	0	111.2	T491 V492 F575 L674 R704	T491-A573 CarbonylContact O-C 3.51Å; T491-A573 VanDerWaalsContact O-CA 3.31Å; T491-A573 WeakPolarHBondContact O-CA 3.25Å; V492-A573 HydrophobicContact CG2-CB 4.04Å; A573-F575 HydrophobicContact CB-CD2 4.34Å; A573-F575 HydrophobicContact CB-CE2 3.96Å; A573-L674 HydrophobicContact CB-CD1 3.93Å; A573-R704 PolarHBondContact N-O 3.49Å; A573-R704 WeakPolarHBondContact O-CA 3.33Å; A573-R704 VanDerWaalsContact O-CB 3.27Å; A573-R704 WeakPolarHBondContact O-CB 3.42Å; A573-R704 VanDerWaalsContact O-CG 3.29Å; A573-R704 WeakPolarHBondContact O-CG 3.48Å
574	D	93.5	Very high	91.4	Very high	50 Å²	50	58.4 Å²	58.4	27%	0.267	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.2	170.2	-167.5	26.6	0	0	0	110.5	G490 T491 R704	G490-D574 CarbonylContact C-O 3.58Å; G490-D574 VanDerWaalsContact CA-O 3.3Å; G490-D574 WeakPolarHBondContact CA-O 3.45Å; T491-D574 PolarHBondContact N-O 2.87Å; T491-D574 PolarHBondContact O-N 3.14Å; D574-R704 IonicContact OD1-CZ 2.63Å; D574-R704 IonicContact OD1-NE 3.4Å; D574-R704 PolarHBondContact OD1-NE 3.13Å; D574-R704 IonicContact OD1-NH1 3.87Å; D574-R704 IonicContact OD1-NH2 2.72Å; D574-R704 PolarHBondContact OD1-NH2 2.68Å
575	F	93.8	Very high	91.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.316	C	S	.	.			trans	-129.4	82.4	178.1	-66.6	-87.7	0	0	0	109	V492 T547 I550 A553 A573 S577 Y578 F579 L674	V492-F575 HydrophobicContact CG2-CE1 4.45Å; V492-F575 HydrophobicContact CG2-CE2 3.59Å; V492-F575 HydrophobicContact CG2-CZ 3.37Å; T547-F575 VanDerWaalsContact O-CE1 3.28Å; T547-F575 WeakPolarHBondContact O-CE1 3.04Å; I550-F575 HydrophobicContact CB-CD1 4.4Å; I550-F575 HydrophobicContact CB-CE1 4.18Å; I550-F575 HydrophobicContact CB-CE2 4.35Å; I550-F575 HydrophobicContact CB-CZ 4.15Å; I550-F575 HydrophobicContact CD1-CD2 4.12Å; I550-F575 HydrophobicContact CD1-CE2 4.21Å; I550-F575 HydrophobicContact CG1-CD2 4.21Å; I550-F575 HydrophobicContact CG1-CE2 3.88Å; I550-F575 HydrophobicContact CG1-CZ 4.08Å; A553-F575 HydrophobicContact CB-CZ 3.89Å; A573-F575 HydrophobicContact CB-CD2 4.34Å; A573-F575 HydrophobicContact CB-CE2 3.96Å; F575-S577 PolarHBondContact O-N 2.77Å; F575-Y578 PolarHBondContact O-N 2.74Å; F575-F579 HydrophobicContact CB-CD2 4.41Å; F575-F579 HydrophobicContact CB-CE2 4.26Å; F575-F579 WeakPolarHBondContact O-CB 3.29Å; F575-F579 WeakPolarHBondContact O-CD2 3.36Å; F575-F579 WeakPolarHBondContact O-CG 3.43Å; F575-F579 PolarHBondContact O-N 3.38Å; F575-L674 HydrophobicContact CE2-CD1 3.9Å
576	P	91.4	Very high	91.4	Very high	48 Å²	48	55.2 Å²	55.2	31%	0.312	29%	0.288	S	S	.	.	H	α-helix	trans	-59.7	-47.5	-169	-27.2	35.6	0	0	0	114.1	F579 E580	P576-F579 PolarHBondContact O-N 2.84Å; P576-E580 WeakPolarHBondContact O-CG 3.08Å; P576-E580 PolarHBondContact O-N 3.44Å; P576-E580 VanDerWaalsContact O-N 3.1Å
577	S	91.4	Very high	91.5	Very high	77 Å²	77	56.2 Å²	56.2	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-46.9	179.4	49.4	0	0	0	0	111.9	F575 F579 E580 E581	F575-S577 PolarHBondContact O-N 2.77Å; S577-F579 PolarHBondContact O-N 3.1Å; S577-E580 PolarHBondContact O-N 2.95Å; S577-E581 PolarHBondContact O-N 2.81Å; S577-E581 VanDerWaalsContact O-N 3.15Å
578	Y	92.1	Very high	91.8	Very high	32 Å²	32	50.4 Å²	50.4	13%	0.125	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-40.3	178.9	-176.2	-112.5	0	0	0	112.4	I550 F575 E581 L582 A667 R670	I550-Y578 HydrophobicContact CD1-CD1 3.91Å; I550-Y578 HydrophobicContact CD1-CE1 3.74Å; I550-Y578 HydrophobicContact CG2-CE1 4.35Å; I550-Y578 HydrophobicContact CG2-CE2 4.5Å; F575-Y578 PolarHBondContact O-N 2.74Å; Y578-E581 PolarHBondContact O-N 3Å; Y578-L582 WeakPolarHBondContact O-CB 2.97Å; Y578-L582 PolarHBondContact O-N 2.85Å; Y578-A667 HydrophobicContact CE1-CB 4.39Å; Y578-A667 VanDerWaalsContact OH-CA 3.31Å; Y578-A667 WeakPolarHBondContact OH-CA 3.24Å; Y578-A667 VanDerWaalsContact OH-CB 3.26Å; Y578-A667 WeakPolarHBondContact OH-CB 3.48Å; Y578-R670 WeakPolarHBondContact OH-CD 3.42Å; Y578-R670 PolarHBondContact OH-NH1 2.99Å
579	F	91.5	Very high	91.8	Very high	5 Å²	5	47.3 Å²	47.3	2%	0.022	25%	0.254	C	S	.	.	H	α-helix	trans	-70.3	-32.8	179	-69.1	-41.4	0	0	0	113.4	F575 P576 S577 R583 F700 M703 R704	F575-F579 HydrophobicContact CB-CD2 4.41Å; F575-F579 HydrophobicContact CB-CE2 4.26Å; F575-F579 WeakPolarHBondContact O-CB 3.29Å; F575-F579 WeakPolarHBondContact O-CD2 3.36Å; F575-F579 WeakPolarHBondContact O-CG 3.43Å; F575-F579 PolarHBondContact O-N 3.38Å; P576-F579 PolarHBondContact O-N 2.84Å; S577-F579 PolarHBondContact O-N 3.1Å; F579-R583 WeakPolarHBondContact O-CB 3.21Å; F579-R583 PolarHBondContact O-N 3.45Å; F579-F700 HydrophobicContact CB-CD1 3.79Å; F579-F700 HydrophobicContact CB-CE1 3.65Å; F579-F700 AromaticContact CD1-CD1 3.53Å; F579-F700 HydrophobicContact CD1-CD1 3.53Å; F579-F700 AromaticContact CD1-CE1 3.67Å; F579-F700 HydrophobicContact CD1-CE1 3.67Å; F579-F700 HydrophobicContact CE1-CD1 4.26Å; F579-F700 AromaticContact CG-CD1 3.77Å; F579-F700 HydrophobicContact CG-CD1 3.77Å; F579-F700 AromaticContact CG-CE1 3.98Å; F579-F700 HydrophobicContact CG-CE1 3.98Å; F579-F700 VanDerWaalsContact O-CE1 3.28Å; F579-F700 WeakPolarHBondContact O-CE1 3.34Å; F579-F700 VanDerWaalsContact O-CZ 3.24Å; F579-F700 WeakPolarHBondContact O-CZ 3.23Å; F579-M703 HydrophobicContact CE1-CB 3.97Å; F579-M703 HydrophobicContact CE1-SD 4.08Å; F579-M703 HydrophobicContact CZ-CB 4.13Å; F579-R704 HydrophobicContact CD2-CG 4.36Å; F579-R704 HydrophobicContact CE2-CG 3.52Å; F579-R704 HydrophobicContact CZ-CG 3.93Å
580	E	91.7	Very high	91.6	Very high	98 Å²	98	51 Å²	51	46%	0.458	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-39.4	172.1	-68.9	-54.2	147.2	0	0	112.2	P576 S577 R583 T584	P576-E580 WeakPolarHBondContact O-CG 3.08Å; P576-E580 PolarHBondContact O-N 3.44Å; P576-E580 VanDerWaalsContact O-N 3.1Å; S577-E580 PolarHBondContact O-N 2.95Å; E580-R583 PolarHBondContact O-N 3.35Å; E580-R583 IonicContact OE1-CZ 3.89Å; E580-R583 IonicContact OE1-NH1 3.84Å; E580-R583 PolarHBondContact OE1-NH1 3.4Å; E580-R583 IonicContact OE2-CZ 2.58Å; E580-R583 IonicContact OE2-NH1 3.89Å; E580-R583 PolarHBondContact OE2-NH1 3.43Å; E580-T584 PolarHBondContact O-N 2.91Å; E580-T584 PolarHBondContact O-OG1 2.8Å
581	E	92.2	Very high	91.6	Very high	122 Å²	122	52.9 Å²	52.9	57%	0.57	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-43.5	173.7	-173	-178.8	179	0	0	111.5	S577 Y578 R583 T584 T585	S577-E581 PolarHBondContact O-N 2.81Å; S577-E581 VanDerWaalsContact O-N 3.15Å; Y578-E581 PolarHBondContact O-N 3Å; E581-R583 VanDerWaalsContact C-N 3.32Å; E581-R583 PolarHBondContact O-N 2.91Å; E581-T584 PolarHBondContact O-N 3.41Å; E581-T585 PolarHBondContact O-N 2.69Å; E581-T585 PolarHBondContact O-OG1 2.83Å
582	L	92	Very high	91.4	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-38.2	175.3	-178.5	60.2	0	0	0	111.8	Y578 T584 T585 L586 V664 A667 F700 M703	Y578-L582 WeakPolarHBondContact O-CB 2.97Å; Y578-L582 PolarHBondContact O-N 2.85Å; L582-T584 VanDerWaalsContact C-N 3.34Å; L582-T585 WeakPolarHBondContact O-CB 3.28Å; L582-T585 PolarHBondContact O-N 3.19Å; L582-L586 HydrophobicContact CG-CD1 4.39Å; L582-L586 WeakPolarHBondContact O-CG 3.47Å; L582-L586 PolarHBondContact O-N 3.02Å; L582-V664 HydrophobicContact CD1-CG2 4.33Å; L582-A667 HydrophobicContact CD1-CB 3.68Å; L582-A667 HydrophobicContact CD2-CB 3.71Å; L582-A667 HydrophobicContact CG-CB 4.32Å; L582-F700 HydrophobicContact CB-CE1 4.12Å; L582-F700 HydrophobicContact CB-CZ 4.27Å; L582-F700 HydrophobicContact CD2-CE1 3.83Å; L582-F700 HydrophobicContact CD2-CZ 4.34Å; L582-F700 HydrophobicContact CG-CE1 4.14Å; L582-F700 HydrophobicContact CG-CZ 4.23Å; L582-M703 HydrophobicContact CD2-CE 4.08Å; L582-M703 HydrophobicContact CD2-SD 3.84Å
583	R	91.9	Very high	91.1	Very high	77 Å²	77	52.2 Å²	52.2	29%	0.291	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-45	176.6	-175.6	176.9	-69.4	129.7	2.3	111	F579 E580 E581 T585 L586 T587 F700	F579-R583 WeakPolarHBondContact O-CB 3.21Å; F579-R583 PolarHBondContact O-N 3.45Å; E580-R583 PolarHBondContact O-N 3.35Å; E580-R583 IonicContact OE1-CZ 3.89Å; E580-R583 IonicContact OE1-NH1 3.84Å; E580-R583 PolarHBondContact OE1-NH1 3.4Å; E580-R583 IonicContact OE2-CZ 2.58Å; E580-R583 IonicContact OE2-NH1 3.89Å; E580-R583 PolarHBondContact OE2-NH1 3.43Å; E581-R583 VanDerWaalsContact C-N 3.32Å; E581-R583 PolarHBondContact O-N 2.91Å; R583-T585 VanDerWaalsContact C-N 3.3Å; R583-T585 PolarHBondContact O-N 3.15Å; R583-L586 PolarHBondContact O-N 3.07Å; R583-T587 PolarHBondContact O-N 3.15Å; R583-T587 VanDerWaalsContact O-N 3.14Å; R583-T587 PolarHBondContact O-OG1 2.92Å; R583-F700 HydrophobicContact CB-CE2 3.98Å; R583-F700 HydrophobicContact CB-CZ 3.78Å; R583-F700 HydrophobicContact CG-CE2 4.32Å
584	T	92.5	Very high	90.8	Very high	74 Å²	74	55.8 Å²	55.8	45%	0.454	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-41.6	176	-51.9	0	0	0	0	110.9	E580 E581 L582 L586 T587 E588	E580-T584 PolarHBondContact O-N 2.91Å; E580-T584 PolarHBondContact O-OG1 2.8Å; E581-T584 PolarHBondContact O-N 3.41Å; L582-T584 VanDerWaalsContact C-N 3.34Å; T584-L586 PolarHBondContact O-N 3.43Å; T584-T587 WeakPolarHBondContact CA-OG1 3.21Å; T584-T587 PolarHBondContact O-N 3.5Å; T584-T587 PolarHBondContact O-OG1 3.03Å; T584-E588 WeakPolarHBondContact O-CG 3.25Å; T584-E588 PolarHBondContact O-N 3.12Å
585	T	92.1	Very high	90.7	Very high	9 Å²	9	56.6 Å²	56.6	6%	0.055	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-43.5	177.2	-59.3	0	0	0	0	112.1	E581 L582 R583 T587 E588 V589 R660 V664	E581-T585 PolarHBondContact O-N 2.69Å; E581-T585 PolarHBondContact O-OG1 2.83Å; L582-T585 WeakPolarHBondContact O-CB 3.28Å; L582-T585 PolarHBondContact O-N 3.19Å; R583-T585 VanDerWaalsContact C-N 3.3Å; R583-T585 PolarHBondContact O-N 3.15Å; T585-T587 VanDerWaalsContact C-N 3.34Å; T585-T587 PolarHBondContact O-N 3.5Å; T585-E588 PolarHBondContact O-N 3.14Å; T585-V589 WeakPolarHBondContact O-CG2 3.2Å; T585-V589 PolarHBondContact O-N 3.29Å; T585-R660 HydrophobicContact CG2-CB 3.99Å; T585-R660 HydrophobicContact CG2-CG 4.32Å; T585-V664 HydrophobicContact CG2-CG2 4.01Å
586	L	89.7	Confident	90.3	Very high	23 Å²	23	59 Å²	59	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-40	177.3	-74	167	0	0	0	112	L582 R583 T584 V589 D590 V664 V696 L699	L582-L586 HydrophobicContact CG-CD1 4.39Å; L582-L586 WeakPolarHBondContact O-CG 3.47Å; L582-L586 PolarHBondContact O-N 3.02Å; R583-L586 PolarHBondContact O-N 3.07Å; T584-L586 PolarHBondContact O-N 3.43Å; L586-V589 PolarHBondContact O-N 2.82Å; L586-D590 PolarHBondContact O-N 3.5Å; L586-V664 HydrophobicContact CD2-CG1 4.03Å; L586-V664 HydrophobicContact CD2-CG2 3.79Å; L586-V664 HydrophobicContact CG-CG2 4.38Å; L586-V696 HydrophobicContact CD1-CG1 4.17Å; L586-V696 HydrophobicContact CD1-CG2 4.49Å; L586-L699 HydrophobicContact CD1-CD2 3.75Å
587	T	90.3	Very high	90.1	Very high	74 Å²	74	63.8 Å²	63.8	45%	0.454	33%	0.33	S	S	.	.	H	α-helix	trans	-65.4	-39.5	175.4	47.9	0	0	0	0	112.5	R583 T584 T585 V589 D590 E591	R583-T587 PolarHBondContact O-N 3.15Å; R583-T587 VanDerWaalsContact O-N 3.14Å; R583-T587 PolarHBondContact O-OG1 2.92Å; T584-T587 WeakPolarHBondContact CA-OG1 3.21Å; T584-T587 PolarHBondContact O-N 3.5Å; T584-T587 PolarHBondContact O-OG1 3.03Å; T585-T587 VanDerWaalsContact C-N 3.34Å; T585-T587 PolarHBondContact O-N 3.5Å; T587-V589 VanDerWaalsContact C-N 3.31Å; T587-V589 PolarHBondContact O-N 3.34Å; T587-D590 PolarHBondContact O-N 2.96Å; T587-E591 PolarHBondContact O-N 2.81Å
588	E	91.1	Very high	90	Very high	48 Å²	48	66.9 Å²	66.9	22%	0.224	33%	0.333	C	S	.	.	H	α-helix	trans	-64.7	-34.6	175.6	-72.4	179.7	-168.9	0	0	112.3	T584 T585 D590 E591 F592 R660	T584-E588 WeakPolarHBondContact O-CG 3.25Å; T584-E588 PolarHBondContact O-N 3.12Å; T585-E588 PolarHBondContact O-N 3.14Å; E588-D590 PolarHBondContact O-N 2.98Å; E588-E591 PolarHBondContact O-N 3.12Å; E588-F592 HydrophobicContact CB-CD2 4.33Å; E588-F592 HydrophobicContact CB-CE2 4.03Å; E588-F592 WeakPolarHBondContact O-CB 3.16Å; E588-F592 WeakPolarHBondContact O-CD2 3.42Å; E588-F592 VanDerWaalsContact O-CG 3.29Å; E588-F592 WeakPolarHBondContact O-CG 3.43Å; E588-F592 PolarHBondContact O-N 2.87Å; E588-R660 IonicContact OE1-NH2 2.79Å; E588-R660 PolarHBondContact OE1-NH2 3.16Å; E588-R660 IonicContact OE2-CZ 2.75Å; E588-R660 IonicContact OE2-NE 3.13Å; E588-R660 PolarHBondContact OE2-NE 3.09Å; E588-R660 IonicContact OE2-NH2 3.77Å; E588-R660 PolarHBondContact OE2-NH2 2.79Å
589	V	88.7	Confident	89.8	Confident	12 Å²	12	66.4 Å²	66.4	7%	0.073	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-43.8	177.3	168.7	0	0	0	0	111.1	T585 L586 T587 F592 H593 L657 R660 L661 V664	T585-V589 WeakPolarHBondContact O-CG2 3.2Å; T585-V589 PolarHBondContact O-N 3.29Å; L586-V589 PolarHBondContact O-N 2.82Å; T587-V589 VanDerWaalsContact C-N 3.31Å; T587-V589 PolarHBondContact O-N 3.34Å; V589-F592 PolarHBondContact O-N 2.97Å; V589-H593 WeakPolarHBondContact CG1-ND1 3.21Å; V589-H593 PolarHBondContact O-N 3.34Å; V589-H593 PolarHBondContact O-ND1 3.42Å; V589-L657 HydrophobicContact CG1-CD1 4.04Å; V589-R660 HydrophobicContact CG2-CB 3.6Å; V589-L661 HydrophobicContact CG1-CD2 3.97Å; V589-V664 HydrophobicContact CG2-CG2 4.45Å
590	D	86.9	Confident	89.5	Confident	88 Å²	88	69 Å²	69	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-42.1	178	-74.9	-15.1	0	0	0	111.6	L586 T587 E588 H593 S594	L586-D590 PolarHBondContact O-N 3.5Å; T587-D590 PolarHBondContact O-N 2.96Å; E588-D590 PolarHBondContact O-N 2.98Å; D590-H593 PolarHBondContact O-N 3.34Å; D590-S594 PolarHBondContact O-N 3.48Å; D590-S594 VanDerWaalsContact O-N 3.09Å
591	E	90.4	Very high	89.4	Confident	129 Å²	129	66.8 Å²	66.8	60%	0.603	35%	0.348	S	S	*	.	H	α-helix	trans	-61.3	-45.8	175	-70.3	-175.1	177	0	0	111.6	T587 E588 H593 S594 V595	T587-E591 PolarHBondContact O-N 2.81Å; E588-E591 PolarHBondContact O-N 3.12Å; E591-H593 PolarHBondContact O-N 3.22Å; E591-S594 PolarHBondContact O-N 2.8Å; E591-V595 WeakPolarHBondContact O-CG2 3.34Å; E591-V595 PolarHBondContact O-N 3.43Å
592	F	89.5	Confident	89.2	Confident	48 Å²	48	63.7 Å²	63.7	21%	0.211	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-38.9	178.9	-71	-40	0	0	0	112.5	E588 V589 V595 H596 N653 A656 L657 R660	E588-F592 HydrophobicContact CB-CD2 4.33Å; E588-F592 HydrophobicContact CB-CE2 4.03Å; E588-F592 WeakPolarHBondContact O-CB 3.16Å; E588-F592 WeakPolarHBondContact O-CD2 3.42Å; E588-F592 VanDerWaalsContact O-CG 3.29Å; E588-F592 WeakPolarHBondContact O-CG 3.43Å; E588-F592 PolarHBondContact O-N 2.87Å; V589-F592 PolarHBondContact O-N 2.97Å; F592-V595 PolarHBondContact O-N 3Å; F592-H596 VanDerWaalsContact O-CB 3.24Å; F592-H596 WeakPolarHBondContact O-CB 3.44Å; F592-H596 PolarHBondContact O-N 3.39Å; F592-N653 WeakPolarHBondContact CD1-ND2 3.2Å; F592-A656 HydrophobicContact CE1-CB 4.43Å; F592-A656 HydrophobicContact CE2-CB 4.16Å; F592-A656 HydrophobicContact CZ-CB 4Å; F592-L657 HydrophobicContact CB-CB 4.09Å; F592-L657 HydrophobicContact CB-CD1 3.95Å; F592-L657 HydrophobicContact CB-CG 4.46Å; F592-R660 HydrophobicContact CD2-CG 4.3Å; F592-R660 HydrophobicContact CE2-CG 3.95Å
593	H	86.1	Confident	88.9	Confident	73 Å²	73	63.8 Å²	63.8	34%	0.338	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-45.6	173.8	-83.4	89.6	0	0	0	111.9	V589 D590 E591 H596 Q597	V589-H593 WeakPolarHBondContact CG1-ND1 3.21Å; V589-H593 PolarHBondContact O-N 3.34Å; V589-H593 PolarHBondContact O-ND1 3.42Å; D590-H593 PolarHBondContact O-N 3.34Å; E591-H593 PolarHBondContact O-N 3.22Å; H593-H596 PolarHBondContact O-N 2.81Å; H593-Q597 WeakPolarHBondContact O-CB 3.4Å; H593-Q597 PolarHBondContact O-N 3Å
594	S	88.8	Confident	88.7	Confident	77 Å²	77	62.3 Å²	62.3	54%	0.538	34%	0.34	S	S	.	.	H	α-helix	trans	-60.5	-46.5	178.2	-180	0	0	0	0	112	D590 E591 Q597 K598	D590-S594 PolarHBondContact O-N 3.48Å; D590-S594 VanDerWaalsContact O-N 3.09Å; E591-S594 PolarHBondContact O-N 2.8Å; S594-Q597 PolarHBondContact O-N 3.15Å; S594-K598 PolarHBondContact O-N 3.17Å; S594-K598 VanDerWaalsContact O-N 3.12Å
595	V	89.8	Confident	88.5	Confident	66 Å²	66	63.9 Å²	63.9	40%	0.4	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-42.9	176.4	173.1	0	0	0	0	111.3	E591 F592 Q597 K598 L599	E591-V595 WeakPolarHBondContact O-CG2 3.34Å; E591-V595 PolarHBondContact O-N 3.43Å; F592-V595 PolarHBondContact O-N 3Å; V595-Q597 PolarHBondContact O-N 3.27Å; V595-K598 PolarHBondContact O-N 2.88Å; V595-L599 HydrophobicContact CG1-CD1 3.77Å; V595-L599 HydrophobicContact CG1-CG 4.29Å; V595-L599 WeakPolarHBondContact O-CG 3.46Å; V595-L599 PolarHBondContact O-N 3.02Å
596	H	85.9	Confident	88.3	Confident	51 Å²	51	65.8 Å²	65.8	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-44.6	178.9	-173.3	78.2	0	0	0	112.1	F592 H593 L599 T600 N653 H654	F592-H596 VanDerWaalsContact O-CB 3.24Å; F592-H596 WeakPolarHBondContact O-CB 3.44Å; F592-H596 PolarHBondContact O-N 3.39Å; H593-H596 PolarHBondContact O-N 2.81Å; H596-L599 PolarHBondContact O-N 3.23Å; H596-T600 WeakPolarHBondContact O-CB 3.33Å; H596-T600 PolarHBondContact O-N 3.37Å; H596-T600 PolarHBondContact O-OG1 2.98Å; H596-N653 WeakPolarHBondContact CB-OD1 3.41Å; H596-H654 AromaticContact CE1-ND1 3.87Å
597	Q	86.9	Confident	88.2	Confident	149 Å²	149	67 Å²	67	70%	0.696	36%	0.364	S	S	*	.	H	α-helix	trans	-62.3	-44.7	178.3	-171.9	179.4	15.6	0	0	111.1	H593 S594 V595 T600 A601	H593-Q597 WeakPolarHBondContact O-CB 3.4Å; H593-Q597 PolarHBondContact O-N 3Å; S594-Q597 PolarHBondContact O-N 3.15Å; V595-Q597 PolarHBondContact O-N 3.27Å; Q597-T600 PolarHBondContact O-N 2.73Å; Q597-A601 PolarHBondContact O-N 2.91Å; Q597-A601 VanDerWaalsContact O-N 3.09Å
598	K	89.7	Confident	88.2	Confident	142 Å²	142	66.6 Å²	66.6	62%	0.617	36%	0.359	S	S	*	.	H	α-helix	trans	-62	-50.7	177.7	-174.5	179.5	177.3	-176.6	0	112.2	S594 V595 T600 A601 D602	S594-K598 PolarHBondContact O-N 3.17Å; S594-K598 VanDerWaalsContact O-N 3.12Å; V595-K598 PolarHBondContact O-N 2.88Å; K598-T600 PolarHBondContact O-N 3.01Å; K598-A601 PolarHBondContact O-N 3.42Å; K598-A601 VanDerWaalsContact O-N 3.16Å; K598-D602 PolarHBondContact O-N 3.44Å
599	L	88	Confident	88.1	Confident	22 Å²	22	69.7 Å²	69.7	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-60.7	-35	178.3	-70.8	171.7	0	0	0	111.9	V595 H596 M603 I649 R650	V595-L599 HydrophobicContact CG1-CD1 3.77Å; V595-L599 HydrophobicContact CG1-CG 4.29Å; V595-L599 WeakPolarHBondContact O-CG 3.46Å; V595-L599 PolarHBondContact O-N 3.02Å; H596-L599 PolarHBondContact O-N 3.23Å; L599-M603 WeakPolarHBondContact O-CB 3.44Å; L599-M603 WeakPolarHBondContact O-CG 3.24Å; L599-M603 PolarHBondContact O-N 3.4Å; L599-I649 HydrophobicContact CD1-CG2 3.89Å; L599-R650 HydrophobicContact CB-CB 4.37Å; L599-R650 HydrophobicContact CB-CG 4.34Å; L599-R650 HydrophobicContact CD1-CB 4.08Å
600	T	86.3	Confident	88.3	Confident	58 Å²	58	70.7 Å²	70.7	36%	0.356	37%	0.374	S	S	.	.	H	α-helix	trans	-67.7	-39.8	177.8	-60.8	0	0	0	0	112	H596 Q597 K598 A604	H596-T600 WeakPolarHBondContact O-CB 3.33Å; H596-T600 PolarHBondContact O-N 3.37Å; H596-T600 PolarHBondContact O-OG1 2.98Å; Q597-T600 PolarHBondContact O-N 2.73Å; K598-T600 PolarHBondContact O-N 3.01Å; T600-A604 WeakPolarHBondContact O-CB 3.37Å; T600-A604 PolarHBondContact O-N 3.45Å; T600-A604 VanDerWaalsContact O-N 3.15Å
601	A	88.4	Confident	88.4	Confident	53 Å²	53	74.1 Å²	74.1	44%	0.438	38%	0.38	S	S	.	.	H	α-helix	trans	-64.6	-49.4	173.6	0	0	0	0	0	111.5	Q597 K598 M603 A604 D605	Q597-A601 PolarHBondContact O-N 2.91Å; Q597-A601 VanDerWaalsContact O-N 3.09Å; K598-A601 PolarHBondContact O-N 3.42Å; K598-A601 VanDerWaalsContact O-N 3.16Å; A601-M603 VanDerWaalsContact C-N 3.34Å; A601-M603 PolarHBondContact O-N 2.8Å; A601-A604 WeakPolarHBondContact O-CB 3.32Å; A601-A604 PolarHBondContact O-N 3.24Å; A601-A604 VanDerWaalsContact O-N 3.11Å; A601-D605 PolarHBondContact O-N 2.86Å; A601-D605 VanDerWaalsContact O-N 3.1Å
602	D	87.4	Confident	88.5	Confident	56 Å²	56	72.7 Å²	72.7	30%	0.299	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-44.6	-179.7	-68.2	-19.7	0	0	0	111.2	K598 A604 D605 H606	K598-D602 PolarHBondContact O-N 3.44Å; D602-A604 VanDerWaalsContact C-N 3.33Å; D602-A604 PolarHBondContact O-N 2.82Å; D602-D605 PolarHBondContact O-N 2.75Å; D602-H606 PolarHBondContact O-N 2.95Å; D602-H606 PolarHBondContact O-ND1 2.91Å
603	M	85.7	Confident	88.6	Confident	11 Å²	11	70.5 Å²	70.5	5%	0.054	37%	0.367	C	S	.	.	H	α-helix	trans	-66.7	-31.8	178	-71.8	-179.3	72.6	0	0	113.4	L599 A601 S607 L643 E646 Y647 R650	L599-M603 WeakPolarHBondContact O-CB 3.44Å; L599-M603 WeakPolarHBondContact O-CG 3.24Å; L599-M603 PolarHBondContact O-N 3.4Å; A601-M603 VanDerWaalsContact C-N 3.34Å; A601-M603 PolarHBondContact O-N 2.8Å; M603-S607 WeakPolarHBondContact O-CB 3.33Å; M603-S607 PolarHBondContact O-N 3.09Å; M603-S607 PolarHBondContact O-OG 2.74Å; M603-L643 HydrophobicContact CE-CD2 4.16Å; M603-L643 HydrophobicContact CE-CG 4.37Å; M603-E646 HydrophobicContact CG-CB 4.03Å; M603-E646 WeakPolarHBondContact CG-OE2 3.36Å; M603-E646 HydrophobicContact SD-CB 4.34Å; M603-Y647 HydrophobicContact CE-CD2 3.93Å; M603-Y647 HydrophobicContact CE-CG 4.36Å; M603-R650 HydrophobicContact SD-CB 4.25Å; M603-R650 PolarHBondContact SD-NH1 2.86Å; M603-R650 VanDerWaalsContact SD-NH1 3.42Å
604	A	87.6	Confident	88.9	Confident	46 Å²	46	71.1 Å²	71.1	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-41.8	175.4	0	0	0	0	0	111	T600 A601 D602 S607 N608	T600-A604 WeakPolarHBondContact O-CB 3.37Å; T600-A604 PolarHBondContact O-N 3.45Å; T600-A604 VanDerWaalsContact O-N 3.15Å; A601-A604 WeakPolarHBondContact O-CB 3.32Å; A601-A604 PolarHBondContact O-N 3.24Å; A601-A604 VanDerWaalsContact O-N 3.11Å; D602-A604 VanDerWaalsContact C-N 3.33Å; D602-A604 PolarHBondContact O-N 2.82Å; A604-S607 WeakPolarHBondContact O-CB 3.16Å; A604-S607 PolarHBondContact O-N 3.33Å; A604-N608 VanDerWaalsContact O-CG 3.24Å; A604-N608 PolarHBondContact O-N 3Å; A604-N608 PolarHBondContact O-ND2 2.95Å
605	D	88.7	Confident	89.2	Confident	106 Å²	106	72.4 Å²	72.4	57%	0.567	38%	0.377	S	S	*	.	H	α-helix	trans	-65	-44.7	175.7	-75	-19.4	0	0	0	111.9	A601 D602 S607 N608 Y609	A601-D605 PolarHBondContact O-N 2.86Å; A601-D605 VanDerWaalsContact O-N 3.1Å; D602-D605 PolarHBondContact O-N 2.75Å; D605-S607 VanDerWaalsContact C-N 3.31Å; D605-S607 PolarHBondContact O-N 3.27Å; D605-N608 WeakPolarHBondContact O-CB 3.48Å; D605-N608 PolarHBondContact O-N 2.96Å; D605-Y609 PolarHBondContact O-N 3.01Å
606	H	88	Confident	89.3	Confident	49 Å²	49	73.4 Å²	73.4	23%	0.227	38%	0.377	C	S	.	.	H	α-helix	trans	-60	-40.4	173.1	-72.7	101.1	0	0	0	112.1	D602 Y609 I610 L643 E646	D602-H606 PolarHBondContact O-N 2.95Å; D602-H606 PolarHBondContact O-ND1 2.91Å; H606-Y609 PolarHBondContact O-N 2.89Å; H606-I610 VanDerWaalsContact O-CG1 3.31Å; H606-I610 WeakPolarHBondContact O-CG1 3.22Å; H606-I610 PolarHBondContact O-N 2.73Å; H606-L643 HydrophobicContact CB-CD1 4.11Å; H606-E646 IonicContact CE1-OE1 2.69Å; H606-E646 PolarHBondContact CE1-OE1 2.99Å; H606-E646 VanDerWaalsContact CE1-OE1 3.27Å; H606-E646 IonicContact CE1-OE2 2.87Å; H606-E646 IonicContact ND1-OE1 2.75Å; H606-E646 IonicContact ND1-OE2 3.98Å; H606-E646 PolarHBondContact ND1-OE2 2.89Å
607	S	87.7	Confident	89.6	Confident	50 Å²	50	71 Å²	71	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-39.2	177	-61.7	0	0	0	0	112.4	M603 A604 D605 R611	M603-S607 WeakPolarHBondContact O-CB 3.33Å; M603-S607 PolarHBondContact O-N 3.09Å; M603-S607 PolarHBondContact O-OG 2.74Å; A604-S607 WeakPolarHBondContact O-CB 3.16Å; A604-S607 PolarHBondContact O-N 3.33Å; D605-S607 VanDerWaalsContact C-N 3.31Å; D605-S607 PolarHBondContact O-N 3.27Å; S607-R611 WeakPolarHBondContact O-CG 3.27Å; S607-R611 PolarHBondContact O-N 3.43Å; S607-R611 VanDerWaalsContact O-N 3.07Å
608	N	90.2	Very high	90	Very high	64 Å²	64	67.5 Å²	67.5	34%	0.342	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-43.4	172.8	-69.9	-28.1	0	0	0	111.3	A604 D605 R611 N612	A604-N608 VanDerWaalsContact O-CG 3.24Å; A604-N608 PolarHBondContact O-N 3Å; A604-N608 PolarHBondContact O-ND2 2.95Å; D605-N608 WeakPolarHBondContact O-CB 3.48Å; D605-N608 PolarHBondContact O-N 2.96Å; N608-R611 PolarHBondContact O-N 3.47Å; N608-R611 PolarHBondContact OD1-NH2 2.96Å; N608-N612 PolarHBondContact O-N 2.91Å; N608-N612 VanDerWaalsContact O-N 3.08Å
609	Y	90	Very high	90.2	Very high	114 Å²	114	64.9 Å²	64.9	45%	0.447	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-41.3	178.7	-168.8	-120.7	0	0	0	112.2	D605 H606 N612 M613 L639	D605-Y609 PolarHBondContact O-N 3.01Å; H606-Y609 PolarHBondContact O-N 2.89Å; Y609-N612 PolarHBondContact O-N 2.99Å; Y609-M613 HydrophobicContact CE1-CE 4.31Å; Y609-M613 WeakPolarHBondContact O-CB 3.46Å; Y609-M613 PolarHBondContact O-N 2.81Å; Y609-L639 HydrophobicContact CD1-CD1 3.27Å; Y609-L639 HydrophobicContact CD1-CD2 3.82Å; Y609-L639 HydrophobicContact CD1-CG 4.16Å; Y609-L639 HydrophobicContact CE1-CD1 3.54Å; Y609-L639 HydrophobicContact CE1-CD2 4.09Å; Y609-L639 HydrophobicContact CE1-CG 4.3Å; Y609-L639 HydrophobicContact CG-CD1 4.43Å
610	I	91.3	Very high	90.5	Very high	32 Å²	32	64 Å²	64	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-46.8	173.7	-72	167.1	0	0	0	111.1	H606 N612 M613 L614 L636 L639 L643	H606-I610 VanDerWaalsContact O-CG1 3.31Å; H606-I610 WeakPolarHBondContact O-CG1 3.22Å; H606-I610 PolarHBondContact O-N 2.73Å; I610-N612 PolarHBondContact O-N 3.06Å; I610-M613 PolarHBondContact O-N 3.13Å; I610-L614 HydrophobicContact CG2-CD1 3.92Å; I610-L614 HydrophobicContact CG2-CG 4.36Å; I610-L614 WeakPolarHBondContact O-CB 3.33Å; I610-L614 WeakPolarHBondContact O-CG 3.43Å; I610-L614 PolarHBondContact O-N 2.85Å; I610-L636 HydrophobicContact CB-CD2 4.41Å; I610-L636 HydrophobicContact CG1-CD2 4.43Å; I610-L636 HydrophobicContact CG2-CD2 4Å; I610-L639 HydrophobicContact CD1-CB 4.42Å; I610-L639 HydrophobicContact CG1-CB 4.22Å; I610-L639 HydrophobicContact CG1-CD1 3.99Å; I610-L643 HydrophobicContact CD1-CD1 3.7Å
611	R	90.4	Very high	90.9	Very high	160 Å²	160	66.2 Å²	66.2	60%	0.604	34%	0.34	S	S	*	.	H	α-helix	trans	-58.4	-46.7	177.7	-75.7	-170	-71.5	174.4	-5.7	111.9	S607 N608 M613 L614 V615	S607-R611 WeakPolarHBondContact O-CG 3.27Å; S607-R611 PolarHBondContact O-N 3.43Å; S607-R611 VanDerWaalsContact O-N 3.07Å; N608-R611 PolarHBondContact O-N 3.47Å; N608-R611 PolarHBondContact OD1-NH2 2.96Å; R611-M613 PolarHBondContact O-N 2.85Å; R611-L614 PolarHBondContact O-N 3.16Å; R611-V615 WeakPolarHBondContact O-CG2 3.02Å; R611-V615 PolarHBondContact O-N 2.77Å
612	N	92.3	Very high	91.3	Very high	100 Å²	100	69.3 Å²	69.3	54%	0.535	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-41.3	177.5	-72.9	-20.1	0	0	0	112	N608 Y609 I610 V615 Q616	N608-N612 PolarHBondContact O-N 2.91Å; N608-N612 VanDerWaalsContact O-N 3.08Å; Y609-N612 PolarHBondContact O-N 2.99Å; I610-N612 PolarHBondContact O-N 3.06Å; N612-V615 PolarHBondContact O-N 3.19Å; N612-Q616 WeakPolarHBondContact O-CG 3.4Å; N612-Q616 PolarHBondContact O-N 2.89Å; N612-Q616 VanDerWaalsContact O-N 3.1Å
613	M	90.9	Very high	91.6	Very high	2 Å²	2	72.7 Å²	72.7	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-72.5	-30.6	-179.1	-170.9	156.7	57	0	0	113.1	Y609 I610 R611 V615 Q616 A617 R632 E635 L636 L639	Y609-M613 HydrophobicContact CE1-CE 4.31Å; Y609-M613 WeakPolarHBondContact O-CB 3.46Å; Y609-M613 PolarHBondContact O-N 2.81Å; I610-M613 PolarHBondContact O-N 3.13Å; R611-M613 PolarHBondContact O-N 2.85Å; M613-V615 VanDerWaalsContact C-N 3.35Å; M613-Q616 PolarHBondContact O-N 2.86Å; M613-A617 WeakPolarHBondContact O-CB 3.45Å; M613-A617 PolarHBondContact O-N 3.12Å; M613-R632 HydrophobicContact CG-CB 4.08Å; M613-R632 HydrophobicContact CG-CG 4.4Å; M613-R632 HydrophobicContact SD-CB 4.47Å; M613-E635 VanDerWaalsContact CE-C 3.42Å; M613-E635 HydrophobicContact CE-CB 3.66Å; M613-E635 HydrophobicContact SD-CB 3.44Å; M613-E635 WeakPolarHBondContact SD-CB 3.07Å; M613-E635 HydrophobicContact SD-CG 4.47Å; M613-E635 VanDerWaalsContact SD-OE2 3.39Å; M613-L636 HydrophobicContact CB-CD2 4Å; M613-L636 HydrophobicContact CB-CG 4.45Å; M613-L636 HydrophobicContact CE-CB 4.07Å; M613-L636 HydrophobicContact CE-CD2 3.5Å; M613-L636 HydrophobicContact CE-CG 3.57Å; M613-L636 HydrophobicContact CG-CD2 4.1Å; M613-L636 HydrophobicContact CG-CG 4Å; M613-L636 HydrophobicContact SD-CG 4.38Å; M613-L639 HydrophobicContact CE-CD1 3.16Å; M613-L639 HydrophobicContact CE-CG 4.25Å
614	L	93.4	Very high	92	Very high	85 Å²	85	75.4 Å²	75.4	45%	0.445	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-43.6	170	-78.1	167.8	0	0	0	111.3	I610 R611 Q616 A617 E618 L636	I610-L614 HydrophobicContact CG2-CD1 3.92Å; I610-L614 HydrophobicContact CG2-CG 4.36Å; I610-L614 WeakPolarHBondContact O-CB 3.33Å; I610-L614 WeakPolarHBondContact O-CG 3.43Å; I610-L614 PolarHBondContact O-N 2.85Å; R611-L614 PolarHBondContact O-N 3.16Å; L614-Q616 PolarHBondContact O-N 2.89Å; L614-A617 PolarHBondContact O-N 2.85Å; L614-E618 WeakPolarHBondContact O-CB 3.12Å; L614-E618 PolarHBondContact O-N 2.89Å; L614-L636 HydrophobicContact CD2-CD1 3.7Å; L614-L636 HydrophobicContact CD2-CD2 4.46Å; L614-L636 HydrophobicContact CG-CD1 4.21Å; L614-L636 HydrophobicContact CG-CD2 4.18Å
615	V	94.1	Very high	92.3	Very high	104 Å²	104	76.3 Å²	76.3	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-61.5	-44.4	175.3	176.1	0	0	0	0	110.9	R611 N612 M613 E618 D619	R611-V615 WeakPolarHBondContact O-CG2 3.02Å; R611-V615 PolarHBondContact O-N 2.77Å; N612-V615 PolarHBondContact O-N 3.19Å; M613-V615 VanDerWaalsContact C-N 3.35Å; V615-E618 PolarHBondContact O-N 3.1Å; V615-D619 WeakPolarHBondContact O-CB 3.46Å; V615-D619 PolarHBondContact O-N 2.84Å
616	Q	92.3	Very high	92.4	Very high	87 Å²	87	76 Å²	76	41%	0.407	38%	0.383	S	S	.	.	H	α-helix	trans	-66.3	-37	177.4	-67.6	180	21.5	0	0	113.3	N612 M613 L614 E618 A620 R632	N612-Q616 WeakPolarHBondContact O-CG 3.4Å; N612-Q616 PolarHBondContact O-N 2.89Å; N612-Q616 VanDerWaalsContact O-N 3.1Å; M613-Q616 PolarHBondContact O-N 2.86Å; L614-Q616 PolarHBondContact O-N 2.89Å; Q616-E618 VanDerWaalsContact C-N 3.34Å; Q616-A620 WeakPolarHBondContact O-CB 3.43Å; Q616-A620 PolarHBondContact O-N 3.01Å; Q616-R632 VanDerWaalsContact OE1-CZ 3.26Å; Q616-R632 VanDerWaalsContact OE1-NE 3.15Å
617	A	93.3	Very high	92.7	Very high	1 Å²	1	82 Å²	82	1%	0.008	41%	0.409	C	S	.	.	H	α-helix	trans	-66.7	-39.8	176.5	0	0	0	0	0	111.1	M613 L614 R621 R632 Y633	M613-A617 WeakPolarHBondContact O-CB 3.45Å; M613-A617 PolarHBondContact O-N 3.12Å; L614-A617 PolarHBondContact O-N 2.85Å; A617-R621 WeakPolarHBondContact O-CB 3.32Å; A617-R621 PolarHBondContact O-N 3.06Å; A617-R632 HydrophobicContact CB-CB 3.84Å; A617-Y633 HydrophobicContact CB-CE2 4.24Å
618	E	94	Very high	93	Very high	75 Å²	75	82.1 Å²	82.1	35%	0.35	41%	0.407	S	S	.	.	H	α-helix	trans	-69.2	-40.7	177.2	-172	59.1	-164	0	0	111.8	L614 V615 Q616 R621 L622	L614-E618 WeakPolarHBondContact O-CB 3.12Å; L614-E618 PolarHBondContact O-N 2.89Å; V615-E618 PolarHBondContact O-N 3.1Å; Q616-E618 VanDerWaalsContact C-N 3.34Å; E618-R621 VanDerWaalsContact CD-NE 3.29Å; E618-R621 WeakPolarHBondContact O-CB 3.16Å; E618-R621 PolarHBondContact O-N 3.41Å; E618-R621 VanDerWaalsContact O-N 3.16Å; E618-R621 IonicContact OE1-CZ 2.67Å; E618-R621 VanDerWaalsContact OE1-CZ 3.24Å; E618-R621 IonicContact OE1-NE 2.94Å; E618-R621 PolarHBondContact OE1-NE 2.84Å; E618-R621 IonicContact OE1-NH2 2.99Å; E618-R621 PolarHBondContact OE1-NH2 3.26Å; E618-R621 IonicContact OE2-CZ 3.94Å; E618-R621 IonicContact OE2-NE 2.72Å; E618-R621 PolarHBondContact OE2-NE 3.13Å; E618-L622 WeakPolarHBondContact O-CG 3.45Å; E618-L622 PolarHBondContact O-N 2.87Å
619	D	95.1	Very high	93.1	Very high	87 Å²	87	80.7 Å²	80.7	47%	0.465	40%	0.399	S	S	.	.	H	α-helix	trans	-60.7	-46.3	173.7	-174.3	47.2	0	0	0	111.8	V615 R621 L622 M623	V615-D619 WeakPolarHBondContact O-CB 3.46Å; V615-D619 PolarHBondContact O-N 2.84Å; D619-R621 VanDerWaalsContact C-N 3.28Å; D619-R621 PolarHBondContact O-N 3.02Å; D619-L622 PolarHBondContact O-N 2.75Å; D619-M623 PolarHBondContact O-N 3.17Å; D619-M623 VanDerWaalsContact OD2-CE 3.23Å; D619-M623 WeakPolarHBondContact OD2-CE 3.24Å
620	A	93.8	Very high	93.3	Very high	3 Å²	3	81.8 Å²	81.8	3%	0.025	41%	0.406	C	S	.	.	H	α-helix	trans	-61.7	-35.7	174	0	0	0	0	0	112.5	Q616 M623 A624 D625 T628 M629	Q616-A620 WeakPolarHBondContact O-CB 3.43Å; Q616-A620 PolarHBondContact O-N 3.01Å; A620-M623 PolarHBondContact O-N 3.16Å; A620-A624 PolarHBondContact O-N 3.1Å; A620-D625 PolarHBondContact O-N 3.12Å; A620-T628 HydrophobicContact CB-CG2 4.12Å; A620-M629 HydrophobicContact CB-CB 4.25Å
621	R	94.9	Very high	93.4	Very high	105 Å²	105	85.4 Å²	85.4	40%	0.396	42%	0.421	S	S	.	.	H	α-helix	trans	-65.7	-43.9	174.5	-169.5	-166.6	74.8	72.7	1.1	111.2	A617 E618 D619 M623 A624 M629	A617-R621 WeakPolarHBondContact O-CB 3.32Å; A617-R621 PolarHBondContact O-N 3.06Å; E618-R621 VanDerWaalsContact CD-NE 3.29Å; E618-R621 WeakPolarHBondContact O-CB 3.16Å; E618-R621 PolarHBondContact O-N 3.41Å; E618-R621 VanDerWaalsContact O-N 3.16Å; E618-R621 IonicContact OE1-CZ 2.67Å; E618-R621 VanDerWaalsContact OE1-CZ 3.24Å; E618-R621 IonicContact OE1-NE 2.94Å; E618-R621 PolarHBondContact OE1-NE 2.84Å; E618-R621 IonicContact OE1-NH2 2.99Å; E618-R621 PolarHBondContact OE1-NH2 3.26Å; E618-R621 IonicContact OE2-CZ 3.94Å; E618-R621 IonicContact OE2-NE 2.72Å; E618-R621 PolarHBondContact OE2-NE 3.13Å; D619-R621 VanDerWaalsContact C-N 3.28Å; D619-R621 PolarHBondContact O-N 3.02Å; R621-M623 VanDerWaalsContact C-N 3.31Å; R621-M623 PolarHBondContact O-N 3.22Å; R621-A624 PolarHBondContact O-N 3.11Å; R621-A624 VanDerWaalsContact O-N 3.13Å; R621-M629 HydrophobicContact CB-CE 4.21Å; R621-M629 HydrophobicContact CB-CG 4.44Å; R621-M629 HydrophobicContact CB-SD 4.04Å; R621-M629 HydrophobicContact CG-CE 3.78Å; R621-M629 HydrophobicContact CG-SD 3.93Å
622	L	95.5	Very high	93.5	Very high	119 Å²	119	80.4 Å²	80.4	62%	0.623	40%	0.402	S	S	*	.	H	α-helix	trans	-64.4	-35.2	177.2	-70.4	171.9	0	0	0	111.9	E618 D619 A624	E618-L622 WeakPolarHBondContact O-CG 3.45Å; E618-L622 PolarHBondContact O-N 2.87Å; D619-L622 PolarHBondContact O-N 2.75Å; L622-A624 VanDerWaalsContact C-N 3.27Å; L622-A624 PolarHBondContact O-N 2.79Å
623	M	94.4	Very high	93.6	Very high	127 Å²	127	80.5 Å²	80.5	63%	0.626	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	1.9	174.1	-68.2	-168.1	-76.6	0	0	114.5	D619 A620 R621 D625	D619-M623 PolarHBondContact O-N 3.17Å; D619-M623 VanDerWaalsContact OD2-CE 3.23Å; D619-M623 WeakPolarHBondContact OD2-CE 3.24Å; A620-M623 PolarHBondContact O-N 3.16Å; R621-M623 VanDerWaalsContact C-N 3.31Å; R621-M623 PolarHBondContact O-N 3.22Å; M623-D625 PolarHBondContact O-N 3.42Å; M623-D625 VanDerWaalsContact O-N 3.17Å
624	A	93.6	Very high	93.7	Very high	67 Å²	67	88 Å²	88	55%	0.554	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	21.1	-174.6	0	0	0	0	0	115.2	A620 R621 L622 M626	A620-A624 PolarHBondContact O-N 3.1Å; R621-A624 PolarHBondContact O-N 3.11Å; R621-A624 VanDerWaalsContact O-N 3.13Å; L622-A624 VanDerWaalsContact C-N 3.27Å; L622-A624 PolarHBondContact O-N 2.79Å; A624-M626 VanDerWaalsContact C-N 3.35Å; A624-M626 PolarHBondContact O-N 3.4Å
625	D	94.8	Very high	93.6	Very high	66 Å²	66	86.4 Å²	86.4	35%	0.353	41%	0.414	S	S	.	.			trans	-80.2	82.8	172.4	-177.3	-0.7	0	0	0	110.7	A620 M623 K627 T628 M629	A620-D625 PolarHBondContact O-N 3.12Å; M623-D625 PolarHBondContact O-N 3.42Å; M623-D625 VanDerWaalsContact O-N 3.17Å; D625-K627 PolarHBondContact O-N 3.15Å; D625-K627 PolarHBondContact OD1-N 3.37Å; D625-K627 VanDerWaalsContact OD1-N 3.12Å; D625-T628 VanDerWaalsContact CG-OG1 3.3Å; D625-T628 PolarHBondContact O-N 2.96Å; D625-T628 PolarHBondContact OD1-N 2.8Å; D625-T628 VanDerWaalsContact OD1-N 3.11Å; D625-T628 WeakPolarHBondContact OD2-CB 3.49Å; D625-T628 PolarHBondContact OD2-OG1 3.38Å; D625-M629 WeakPolarHBondContact O-CB 3.48Å; D625-M629 PolarHBondContact O-N 3.41Å
626	M	91.4	Very high	93.6	Very high	99 Å²	99	82.4 Å²	82.4	49%	0.488	39%	0.389	S	S	.	.	H	α-helix	trans	-63.6	-22.8	-178.9	-64	-63.9	152.8	0	0	113.5	A624 M629 K630	A624-M626 VanDerWaalsContact C-N 3.35Å; A624-M626 PolarHBondContact O-N 3.4Å; M626-M629 HydrophobicContact SD-SD 3.89Å; M626-K630 WeakPolarHBondContact O-CB 3.32Å; M626-K630 VanDerWaalsContact O-CG 3.22Å; M626-K630 WeakPolarHBondContact O-CG 3.09Å; M626-K630 PolarHBondContact O-N 2.8Å; M626-K630 VanDerWaalsContact O-N 3.11Å
627	K	93.9	Very high	93.6	Very high	176 Å²	176	85 Å²	85	77%	0.765	40%	0.399	S	S	*	.	H	α-helix	trans	-76.1	-46.9	-179	-172.3	179.8	179.1	-177.1	0	110	D625 K631	D625-K627 PolarHBondContact O-N 3.15Å; D625-K627 PolarHBondContact OD1-N 3.37Å; D625-K627 VanDerWaalsContact OD1-N 3.12Å; K627-K631 PolarHBondContact O-N 3.48Å; K627-K631 VanDerWaalsContact O-N 3.08Å
628	T	92.4	Very high	93.6	Very high	52 Å²	52	88.2 Å²	88.2	32%	0.319	42%	0.416	S	S	.	.	H	α-helix	trans	-69	-41.4	177	-58.4	0	0	0	0	110.9	A620 D625 K630 K631 R632	A620-T628 HydrophobicContact CB-CG2 4.12Å; D625-T628 VanDerWaalsContact CG-OG1 3.3Å; D625-T628 PolarHBondContact O-N 2.96Å; D625-T628 PolarHBondContact OD1-N 2.8Å; D625-T628 VanDerWaalsContact OD1-N 3.11Å; D625-T628 WeakPolarHBondContact OD2-CB 3.49Å; D625-T628 PolarHBondContact OD2-OG1 3.38Å; T628-K630 PolarHBondContact O-N 3Å; T628-K631 WeakPolarHBondContact O-CB 3.45Å; T628-K631 PolarHBondContact O-N 3.28Å; T628-K631 VanDerWaalsContact O-N 3.11Å; T628-R632 HydrophobicContact CG2-CG 4.44Å; T628-R632 WeakPolarHBondContact O-CG 3.22Å; T628-R632 PolarHBondContact O-N 3.45Å
629	M	93.9	Very high	93.4	Very high	34 Å²	34	85.8 Å²	85.8	17%	0.167	41%	0.405	C	S	.	.	H	α-helix	trans	-54	-54.8	173.2	-175.6	-166.4	177.7	0	0	111.4	A620 R621 D625 M626 K631 R632 Y633	A620-M629 HydrophobicContact CB-CB 4.25Å; R621-M629 HydrophobicContact CB-CE 4.21Å; R621-M629 HydrophobicContact CB-CG 4.44Å; R621-M629 HydrophobicContact CB-SD 4.04Å; R621-M629 HydrophobicContact CG-CE 3.78Å; R621-M629 HydrophobicContact CG-SD 3.93Å; D625-M629 WeakPolarHBondContact O-CB 3.48Å; D625-M629 PolarHBondContact O-N 3.41Å; M626-M629 HydrophobicContact SD-SD 3.89Å; M629-K631 PolarHBondContact O-N 3.27Å; M629-R632 PolarHBondContact O-N 3.27Å; M629-R632 VanDerWaalsContact O-N 3.17Å; M629-Y633 HydrophobicContact CE-CD2 4.19Å; M629-Y633 HydrophobicContact CE-CE2 3.39Å; M629-Y633 HydrophobicContact CG-CD2 3.73Å; M629-Y633 HydrophobicContact CG-CE2 3.5Å; M629-Y633 VanDerWaalsContact O-CD2 3.22Å; M629-Y633 WeakPolarHBondContact O-CD2 3.35Å; M629-Y633 PolarHBondContact O-N 3.49Å; M629-Y633 HydrophobicContact SD-CE2 4.28Å
630	K	93.2	Very high	93.2	Very high	137 Å²	137	85.5 Å²	85.5	60%	0.596	40%	0.404	S	S	*	.	H	α-helix	trans	-63.6	-26.4	178.4	-74	176.9	-178	-177.8	0	113.7	M626 T628 R634	M626-K630 WeakPolarHBondContact O-CB 3.32Å; M626-K630 VanDerWaalsContact O-CG 3.22Å; M626-K630 WeakPolarHBondContact O-CG 3.09Å; M626-K630 PolarHBondContact O-N 2.8Å; M626-K630 VanDerWaalsContact O-N 3.11Å; T628-K630 PolarHBondContact O-N 3Å; K630-R634 WeakPolarHBondContact O-CG 3.24Å; K630-R634 PolarHBondContact O-N 2.96Å; K630-R634 PolarHBondContact O-NE 3.24Å; K630-R634 VanDerWaalsContact O-NE 3.15Å
631	K	94.4	Very high	93.1	Very high	108 Å²	108	91 Å²	91	47%	0.47	42%	0.424	S	S	.	.	H	α-helix	trans	-70.2	-50	173	-177.8	-179.1	171.2	-176.9	0	110.1	K627 T628 M629 Y633 R634 E635	K627-K631 PolarHBondContact O-N 3.48Å; K627-K631 VanDerWaalsContact O-N 3.08Å; T628-K631 WeakPolarHBondContact O-CB 3.45Å; T628-K631 PolarHBondContact O-N 3.28Å; T628-K631 VanDerWaalsContact O-N 3.11Å; M629-K631 PolarHBondContact O-N 3.27Å; K631-Y633 PolarHBondContact O-N 2.88Å; K631-R634 PolarHBondContact O-N 3.17Å; K631-R634 VanDerWaalsContact O-N 3.14Å; K631-E635 WeakPolarHBondContact CE-OE1 3.29Å; K631-E635 PolarHBondContact O-N 3.2Å
632	R	91.9	Very high	92.8	Very high	54 Å²	54	89.2 Å²	89.2	20%	0.204	42%	0.422	C	S	.	.	H	α-helix	trans	-62	-38.6	178	-63.9	-46.8	-170.9	-163.8	6.5	112.9	M613 Q616 A617 T628 M629 R634 E635 L636	M613-R632 HydrophobicContact CG-CB 4.08Å; M613-R632 HydrophobicContact CG-CG 4.4Å; M613-R632 HydrophobicContact SD-CB 4.47Å; Q616-R632 VanDerWaalsContact OE1-CZ 3.26Å; Q616-R632 VanDerWaalsContact OE1-NE 3.15Å; A617-R632 HydrophobicContact CB-CB 3.84Å; T628-R632 HydrophobicContact CG2-CG 4.44Å; T628-R632 WeakPolarHBondContact O-CG 3.22Å; T628-R632 PolarHBondContact O-N 3.45Å; M629-R632 PolarHBondContact O-N 3.27Å; M629-R632 VanDerWaalsContact O-N 3.17Å; R632-R634 VanDerWaalsContact C-N 3.35Å; R632-R634 PolarHBondContact O-N 2.94Å; R632-E635 VanDerWaalsContact CD-OE2 3.28Å; R632-E635 WeakPolarHBondContact CD-OE2 3.42Å; R632-E635 IonicContact CZ-OE2 3.92Å; R632-E635 IonicContact NE-OE2 3.24Å; R632-E635 IonicContact NH1-OE1 3.23Å; R632-E635 IonicContact NH1-OE2 3.55Å; R632-E635 PolarHBondContact NH1-OE2 2.65Å; R632-E635 PolarHBondContact O-N 3.41Å; R632-L636 WeakPolarHBondContact O-CB 3.35Å; R632-L636 WeakPolarHBondContact O-CG 3.49Å; R632-L636 PolarHBondContact O-N 3.06Å
633	Y	93.4	Very high	92.4	Very high	103 Å²	103	85 Å²	85	40%	0.404	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-32.3	174.3	-80.6	-69.8	0	0	0	114	A617 M629 K631 L636 F637	A617-Y633 HydrophobicContact CB-CE2 4.24Å; M629-Y633 HydrophobicContact CE-CD2 4.19Å; M629-Y633 HydrophobicContact CE-CE2 3.39Å; M629-Y633 HydrophobicContact CG-CD2 3.73Å; M629-Y633 HydrophobicContact CG-CE2 3.5Å; M629-Y633 VanDerWaalsContact O-CD2 3.22Å; M629-Y633 WeakPolarHBondContact O-CD2 3.35Å; M629-Y633 PolarHBondContact O-N 3.49Å; M629-Y633 HydrophobicContact SD-CE2 4.28Å; K631-Y633 PolarHBondContact O-N 2.88Å; Y633-L636 HydrophobicContact CD1-CD1 3.99Å; Y633-L636 HydrophobicContact CE1-CD1 4.24Å; Y633-L636 PolarHBondContact O-N 3.01Å; Y633-F637 WeakPolarHBondContact O-CB 3.42Å; Y633-F637 PolarHBondContact O-N 3.42Å
634	R	93.5	Very high	92.1	Very high	160 Å²	160	83 Å²	83	60%	0.604	39%	0.391	S	S	*	.	H	α-helix	trans	-67.8	-45.2	173.2	-81.5	-178.2	-76.2	161.5	-5.3	111.2	K630 K631 R632 L636 F637 D638	K630-R634 WeakPolarHBondContact O-CG 3.24Å; K630-R634 PolarHBondContact O-N 2.96Å; K630-R634 PolarHBondContact O-NE 3.24Å; K630-R634 VanDerWaalsContact O-NE 3.15Å; K631-R634 PolarHBondContact O-N 3.17Å; K631-R634 VanDerWaalsContact O-N 3.14Å; R632-R634 VanDerWaalsContact C-N 3.35Å; R632-R634 PolarHBondContact O-N 2.94Å; R634-L636 VanDerWaalsContact C-N 3.32Å; R634-L636 PolarHBondContact O-N 2.68Å; R634-F637 WeakPolarHBondContact O-CB 3.49Å; R634-F637 PolarHBondContact O-N 3.43Å; R634-F637 VanDerWaalsContact O-N 3.15Å; R634-D638 PolarHBondContact O-N 3.48Å
635	E	92.3	Very high	91.9	Very high	51 Å²	51	83.8 Å²	83.8	24%	0.238	39%	0.386	C	S	.	.	H	α-helix	trans	-60.9	-40.9	174.2	-68	167.9	-177.5	0	0	111.1	M613 K631 R632 F637 D638 L639	M613-E635 VanDerWaalsContact CE-C 3.42Å; M613-E635 HydrophobicContact CE-CB 3.66Å; M613-E635 HydrophobicContact SD-CB 3.44Å; M613-E635 WeakPolarHBondContact SD-CB 3.07Å; M613-E635 HydrophobicContact SD-CG 4.47Å; M613-E635 VanDerWaalsContact SD-OE2 3.39Å; K631-E635 WeakPolarHBondContact CE-OE1 3.29Å; K631-E635 PolarHBondContact O-N 3.2Å; R632-E635 VanDerWaalsContact CD-OE2 3.28Å; R632-E635 WeakPolarHBondContact CD-OE2 3.42Å; R632-E635 IonicContact CZ-OE2 3.92Å; R632-E635 IonicContact NE-OE2 3.24Å; R632-E635 IonicContact NH1-OE1 3.23Å; R632-E635 IonicContact NH1-OE2 3.55Å; R632-E635 PolarHBondContact NH1-OE2 2.65Å; R632-E635 PolarHBondContact O-N 3.41Å; E635-F637 VanDerWaalsContact C-N 3.32Å; E635-F637 PolarHBondContact O-N 3.26Å; E635-D638 PolarHBondContact O-N 3.16Å; E635-L639 VanDerWaalsContact O-CG 3.29Å; E635-L639 WeakPolarHBondContact O-CG 3.48Å; E635-L639 PolarHBondContact O-N 2.9Å
636	L	93.6	Very high	91.6	Very high	19 Å²	19	82.3 Å²	82.3	10%	0.099	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-40.7	174.3	-79.3	173.9	0	0	0	111.5	I610 M613 L614 R632 Y633 R634 N640	I610-L636 HydrophobicContact CB-CD2 4.41Å; I610-L636 HydrophobicContact CG1-CD2 4.43Å; I610-L636 HydrophobicContact CG2-CD2 4Å; M613-L636 HydrophobicContact CB-CD2 4Å; M613-L636 HydrophobicContact CB-CG 4.45Å; M613-L636 HydrophobicContact CE-CB 4.07Å; M613-L636 HydrophobicContact CE-CD2 3.5Å; M613-L636 HydrophobicContact CE-CG 3.57Å; M613-L636 HydrophobicContact CG-CD2 4.1Å; M613-L636 HydrophobicContact CG-CG 4Å; M613-L636 HydrophobicContact SD-CG 4.38Å; L614-L636 HydrophobicContact CD2-CD1 3.7Å; L614-L636 HydrophobicContact CD2-CD2 4.46Å; L614-L636 HydrophobicContact CG-CD1 4.21Å; L614-L636 HydrophobicContact CG-CD2 4.18Å; R632-L636 WeakPolarHBondContact O-CB 3.35Å; R632-L636 WeakPolarHBondContact O-CG 3.49Å; R632-L636 PolarHBondContact O-N 3.06Å; Y633-L636 HydrophobicContact CD1-CD1 3.99Å; Y633-L636 HydrophobicContact CE1-CD1 4.24Å; Y633-L636 PolarHBondContact O-N 3.01Å; R634-L636 VanDerWaalsContact C-N 3.32Å; R634-L636 PolarHBondContact O-N 2.68Å; L636-N640 WeakPolarHBondContact O-CB 3.3Å; L636-N640 PolarHBondContact O-N 2.8Å
637	F	92.6	Very high	91.2	Very high	142 Å²	142	83.4 Å²	83.4	62%	0.623	38%	0.376	S	S	*	.	H	α-helix	trans	-64.4	-44.7	178.9	-178.9	-91.8	0	0	0	111.8	Y633 R634 E635 N640 R641	Y633-F637 WeakPolarHBondContact O-CB 3.42Å; Y633-F637 PolarHBondContact O-N 3.42Å; R634-F637 WeakPolarHBondContact O-CB 3.49Å; R634-F637 PolarHBondContact O-N 3.43Å; R634-F637 VanDerWaalsContact O-N 3.15Å; E635-F637 VanDerWaalsContact C-N 3.32Å; E635-F637 PolarHBondContact O-N 3.26Å; F637-N640 PolarHBondContact O-N 3.32Å; F637-R641 PolarHBondContact O-N 2.85Å
638	D	92	Very high	90.9	Very high	69 Å²	69	78.1 Å²	78.1	37%	0.369	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-48.2	177.4	-73.7	-43.3	0	0	0	111.2	R634 E635 N640 R641 D642	R634-D638 PolarHBondContact O-N 3.48Å; E635-D638 PolarHBondContact O-N 3.16Å; D638-N640 VanDerWaalsContact C-N 3.31Å; D638-N640 PolarHBondContact O-N 3Å; D638-R641 WeakPolarHBondContact O-CB 3.29Å; D638-R641 PolarHBondContact O-N 2.91Å; D638-R641 IonicContact OD1-CZ 2.84Å; D638-R641 IonicContact OD1-NH1 2.75Å; D638-R641 IonicContact OD1-NH2 2.85Å; D638-R641 PolarHBondContact OD1-NH2 3.35Å; D638-D642 VanDerWaalsContact O-CG 3.29Å; D638-D642 PolarHBondContact O-N 3.5Å
639	L	91.1	Very high	90.7	Very high	23 Å²	23	80.2 Å²	80.2	12%	0.12	37%	0.367	C	S	.	.	H	α-helix	trans	-60.2	-39.4	175.6	-69.4	171.9	0	0	0	113.1	Y609 I610 M613 E635 R641 D642 L643	Y609-L639 HydrophobicContact CD1-CD1 3.27Å; Y609-L639 HydrophobicContact CD1-CD2 3.82Å; Y609-L639 HydrophobicContact CD1-CG 4.16Å; Y609-L639 HydrophobicContact CE1-CD1 3.54Å; Y609-L639 HydrophobicContact CE1-CD2 4.09Å; Y609-L639 HydrophobicContact CE1-CG 4.3Å; Y609-L639 HydrophobicContact CG-CD1 4.43Å; I610-L639 HydrophobicContact CD1-CB 4.42Å; I610-L639 HydrophobicContact CG1-CB 4.22Å; I610-L639 HydrophobicContact CG1-CD1 3.99Å; M613-L639 HydrophobicContact CE-CD1 3.16Å; M613-L639 HydrophobicContact CE-CG 4.25Å; E635-L639 VanDerWaalsContact O-CG 3.29Å; E635-L639 WeakPolarHBondContact O-CG 3.48Å; E635-L639 PolarHBondContact O-N 2.9Å; L639-R641 VanDerWaalsContact C-N 3.32Å; L639-D642 PolarHBondContact O-N 2.8Å; L639-L643 VanDerWaalsContact O-CB 3.3Å; L639-L643 WeakPolarHBondContact O-CB 3.28Å; L639-L643 PolarHBondContact O-N 3.18Å
640	N	90.9	Very high	90.3	Very high	82 Å²	82	81.7 Å²	81.7	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-67.2	-37.6	179.9	-173.5	72	0	0	0	111	L636 F637 D638 I644	L636-N640 WeakPolarHBondContact O-CB 3.3Å; L636-N640 PolarHBondContact O-N 2.8Å; F637-N640 PolarHBondContact O-N 3.32Å; D638-N640 VanDerWaalsContact C-N 3.31Å; D638-N640 PolarHBondContact O-N 3Å; N640-I644 WeakPolarHBondContact ND2-CD1 3.35Å; N640-I644 WeakPolarHBondContact O-CB 3.03Å; N640-I644 WeakPolarHBondContact O-CD1 3.45Å; N640-I644 WeakPolarHBondContact O-CG1 3.5Å; N640-I644 PolarHBondContact O-N 2.79Å
641	R	90.4	Very high	89.9	Confident	119 Å²	119	77 Å²	77	45%	0.449	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-44.5	172.5	-177.4	-177.7	64.2	-142.9	-15.3	110.9	F637 D638 L639 I644 N645	F637-R641 PolarHBondContact O-N 2.85Å; D638-R641 WeakPolarHBondContact O-CB 3.29Å; D638-R641 PolarHBondContact O-N 2.91Å; D638-R641 IonicContact OD1-CZ 2.84Å; D638-R641 IonicContact OD1-NH1 2.75Å; D638-R641 IonicContact OD1-NH2 2.85Å; D638-R641 PolarHBondContact OD1-NH2 3.35Å; L639-R641 VanDerWaalsContact C-N 3.32Å; R641-I644 PolarHBondContact O-N 3.38Å; R641-N645 PolarHBondContact O-N 2.5Å; R641-N645 VanDerWaalsContact O-N 3.08Å; R641-N645 PolarHBondContact O-ND2 2.94Å
642	D	89.2	Confident	89.6	Confident	66 Å²	66	76.7 Å²	76.7	35%	0.353	36%	0.359	S	S	.	.	H	α-helix	trans	-66	-42.7	-179.5	-63.6	-14.4	0	0	0	111	D638 L639 I644 N645 E646	D638-D642 VanDerWaalsContact O-CG 3.29Å; D638-D642 PolarHBondContact O-N 3.5Å; L639-D642 PolarHBondContact O-N 2.8Å; D642-I644 VanDerWaalsContact C-N 3.35Å; D642-I644 PolarHBondContact O-N 2.78Å; D642-N645 WeakPolarHBondContact O-CB 3.4Å; D642-N645 PolarHBondContact O-N 2.78Å; D642-N645 VanDerWaalsContact O-N 3.11Å; D642-E646 PolarHBondContact O-N 2.79Å
643	L	88.1	Confident	89.5	Confident	30 Å²	30	74.9 Å²	74.9	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-63.6	-36.7	175.4	-167.4	152.2	0	0	0	112.4	M603 H606 I610 L639 N645 E646 Y647	M603-L643 HydrophobicContact CE-CD2 4.16Å; M603-L643 HydrophobicContact CE-CG 4.37Å; H606-L643 HydrophobicContact CB-CD1 4.11Å; I610-L643 HydrophobicContact CD1-CD1 3.7Å; L639-L643 VanDerWaalsContact O-CB 3.3Å; L639-L643 WeakPolarHBondContact O-CB 3.28Å; L639-L643 PolarHBondContact O-N 3.18Å; L643-N645 VanDerWaalsContact C-N 3.34Å; L643-E646 PolarHBondContact O-N 2.76Å; L643-Y647 WeakPolarHBondContact O-CB 3.36Å; L643-Y647 PolarHBondContact O-N 2.91Å
644	I	87.6	Confident	89	Confident	85 Å²	85	71.9 Å²	71.9	44%	0.436	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-40.7	173.5	-72	164.9	0	0	0	110.8	N640 R641 D642 Y647 T648	N640-I644 WeakPolarHBondContact ND2-CD1 3.35Å; N640-I644 WeakPolarHBondContact O-CB 3.03Å; N640-I644 WeakPolarHBondContact O-CD1 3.45Å; N640-I644 WeakPolarHBondContact O-CG1 3.5Å; N640-I644 PolarHBondContact O-N 2.79Å; R641-I644 PolarHBondContact O-N 3.38Å; D642-I644 VanDerWaalsContact C-N 3.35Å; D642-I644 PolarHBondContact O-N 2.78Å; I644-Y647 PolarHBondContact O-N 2.94Å; I644-T648 WeakPolarHBondContact O-CB 3.37Å; I644-T648 PolarHBondContact O-N 3.11Å; I644-T648 PolarHBondContact O-OG1 2.96Å
645	N	89.6	Confident	88.7	Confident	84 Å²	84	68.4 Å²	68.4	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-65.4	-48.1	176.8	-67.4	-27.3	0	0	0	110.8	R641 D642 L643 Y647 T648 I649	R641-N645 PolarHBondContact O-N 2.5Å; R641-N645 VanDerWaalsContact O-N 3.08Å; R641-N645 PolarHBondContact O-ND2 2.94Å; D642-N645 WeakPolarHBondContact O-CB 3.4Å; D642-N645 PolarHBondContact O-N 2.78Å; D642-N645 VanDerWaalsContact O-N 3.11Å; L643-N645 VanDerWaalsContact C-N 3.34Å; N645-Y647 VanDerWaalsContact C-N 3.34Å; N645-Y647 PolarHBondContact O-N 3.22Å; N645-T648 WeakPolarHBondContact O-CB 3.35Å; N645-T648 PolarHBondContact O-N 3.08Å; N645-I649 WeakPolarHBondContact O-CG1 3.48Å; N645-I649 PolarHBondContact O-N 2.87Å
646	E	87.1	Confident	88.5	Confident	35 Å²	35	67.6 Å²	67.6	16%	0.164	34%	0.339	C	S	.	.	H	α-helix	trans	-59.5	-43.3	175.2	-72.3	-177.9	173.6	0	0	112	M603 H606 D642 L643 T648 I649 R650	M603-E646 HydrophobicContact CG-CB 4.03Å; M603-E646 WeakPolarHBondContact CG-OE2 3.36Å; M603-E646 HydrophobicContact SD-CB 4.34Å; H606-E646 IonicContact CE1-OE1 2.69Å; H606-E646 PolarHBondContact CE1-OE1 2.99Å; H606-E646 VanDerWaalsContact CE1-OE1 3.27Å; H606-E646 IonicContact CE1-OE2 2.87Å; H606-E646 IonicContact ND1-OE1 2.75Å; H606-E646 IonicContact ND1-OE2 3.98Å; H606-E646 PolarHBondContact ND1-OE2 2.89Å; D642-E646 PolarHBondContact O-N 2.79Å; L643-E646 PolarHBondContact O-N 2.76Å; E646-T648 VanDerWaalsContact C-N 3.31Å; E646-T648 PolarHBondContact O-N 2.51Å; E646-I649 PolarHBondContact O-N 2.76Å; E646-R650 WeakPolarHBondContact O-CB 3.11Å; E646-R650 PolarHBondContact O-N 2.92Å
647	Y	84.4	Confident	88.3	Confident	122 Å²	122	67.1 Å²	67.1	48%	0.478	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-42.2	175.4	179.4	-88.2	0	0	0	111.4	M603 L643 I644 N645 R650 S651	M603-Y647 HydrophobicContact CE-CD2 3.93Å; M603-Y647 HydrophobicContact CE-CG 4.36Å; L643-Y647 WeakPolarHBondContact O-CB 3.36Å; L643-Y647 PolarHBondContact O-N 2.91Å; I644-Y647 PolarHBondContact O-N 2.94Å; N645-Y647 VanDerWaalsContact C-N 3.34Å; N645-Y647 PolarHBondContact O-N 3.22Å; Y647-R650 PolarHBondContact O-N 3.37Å; Y647-S651 VanDerWaalsContact O-CB 3.24Å; Y647-S651 WeakPolarHBondContact O-CB 3.47Å; Y647-S651 PolarHBondContact O-N 3.39Å
648	T	87.1	Confident	87.9	Confident	66 Å²	66	61.3 Å²	61.3	41%	0.405	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-43.6	178.3	-57	0	0	0	0	110.9	I644 N645 E646 S651 N652	I644-T648 WeakPolarHBondContact O-CB 3.37Å; I644-T648 PolarHBondContact O-N 3.11Å; I644-T648 PolarHBondContact O-OG1 2.96Å; N645-T648 WeakPolarHBondContact O-CB 3.35Å; N645-T648 PolarHBondContact O-N 3.08Å; E646-T648 VanDerWaalsContact C-N 3.31Å; E646-T648 PolarHBondContact O-N 2.51Å; T648-S651 PolarHBondContact O-N 2.98Å; T648-N652 WeakPolarHBondContact O-CB 3.5Å; T648-N652 VanDerWaalsContact O-CG 3.24Å; T648-N652 PolarHBondContact O-N 3.25Å; T648-N652 PolarHBondContact O-ND2 3.23Å
649	I	89.3	Confident	87.7	Confident	96 Å²	96	61.9 Å²	61.9	49%	0.492	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-46.7	175.5	-64.9	165.1	0	0	0	110.3	L599 N645 E646 S651 N652 N653	L599-I649 HydrophobicContact CD1-CG2 3.89Å; N645-I649 WeakPolarHBondContact O-CG1 3.48Å; N645-I649 PolarHBondContact O-N 2.87Å; E646-I649 PolarHBondContact O-N 2.76Å; I649-S651 PolarHBondContact O-N 3.39Å; I649-N652 PolarHBondContact O-N 2.75Å; I649-N653 VanDerWaalsContact O-CB 3.26Å; I649-N653 WeakPolarHBondContact O-CB 3.3Å; I649-N653 PolarHBondContact O-N 2.94Å
650	R	85.4	Confident	87.7	Confident	64 Å²	64	64.3 Å²	64.3	24%	0.242	33%	0.325	C	S	.	.	H	α-helix	trans	-62.4	-42.7	178.5	-171.6	-176.1	68.8	177.9	1.9	111.9	L599 M603 E646 Y647 N653 H654	L599-R650 HydrophobicContact CB-CB 4.37Å; L599-R650 HydrophobicContact CB-CG 4.34Å; L599-R650 HydrophobicContact CD1-CB 4.08Å; M603-R650 HydrophobicContact SD-CB 4.25Å; M603-R650 PolarHBondContact SD-NH1 2.86Å; M603-R650 VanDerWaalsContact SD-NH1 3.42Å; E646-R650 WeakPolarHBondContact O-CB 3.11Å; E646-R650 PolarHBondContact O-N 2.92Å; Y647-R650 PolarHBondContact O-N 3.37Å; R650-N653 PolarHBondContact O-N 2.93Å; R650-H654 VanDerWaalsContact O-CB 3.22Å; R650-H654 WeakPolarHBondContact O-CB 3.48Å; R650-H654 PolarHBondContact O-N 3.29Å
651	S	83.1	Confident	87.5	Confident	40 Å²	40	61.6 Å²	61.6	28%	0.28	31%	0.311	S	S	.	.	H	α-helix	trans	-61.6	-46.6	177.3	-176.5	0	0	0	0	111.1	Y647 T648 I649 H654 N655	Y647-S651 VanDerWaalsContact O-CB 3.24Å; Y647-S651 WeakPolarHBondContact O-CB 3.47Å; Y647-S651 PolarHBondContact O-N 3.39Å; T648-S651 PolarHBondContact O-N 2.98Å; I649-S651 PolarHBondContact O-N 3.39Å; S651-H654 PolarHBondContact O-N 2.95Å; S651-N655 WeakPolarHBondContact O-CB 3.34Å; S651-N655 VanDerWaalsContact O-CG 3.27Å; S651-N655 PolarHBondContact O-N 3.34Å; S651-N655 PolarHBondContact O-ND2 2.65Å
652	N	88.6	Confident	87.4	Confident	101 Å²	101	58.1 Å²	58.1	54%	0.54	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-44.3	177.2	-69.5	-16.5	0	0	0	112	T648 I649 N655 A656	T648-N652 WeakPolarHBondContact O-CB 3.5Å; T648-N652 VanDerWaalsContact O-CG 3.24Å; T648-N652 PolarHBondContact O-N 3.25Å; T648-N652 PolarHBondContact O-ND2 3.23Å; I649-N652 PolarHBondContact O-N 2.75Å; N652-N655 PolarHBondContact O-N 2.99Å; N652-A656 WeakPolarHBondContact O-CB 3.39Å; N652-A656 PolarHBondContact O-N 2.83Å
653	N	89.6	Confident	87.4	Confident	16 Å²	16	56.8 Å²	56.8	9%	0.086	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-43.6	174.8	169.3	-98.1	0	0	0	111.8	F592 H596 I649 R650 A656 L657	F592-N653 WeakPolarHBondContact CD1-ND2 3.2Å; H596-N653 WeakPolarHBondContact CB-OD1 3.41Å; I649-N653 VanDerWaalsContact O-CB 3.26Å; I649-N653 WeakPolarHBondContact O-CB 3.3Å; I649-N653 PolarHBondContact O-N 2.94Å; R650-N653 PolarHBondContact O-N 2.93Å; N653-A656 PolarHBondContact O-N 3.39Å; N653-L657 WeakPolarHBondContact O-CB 3.34Å; N653-L657 PolarHBondContact O-N 3.11Å
654	H	84.3	Confident	87.5	Confident	40 Å²	40	55.8 Å²	55.8	19%	0.185	29%	0.29	C	S	.	.	H	α-helix	trans	-66.2	-42.2	178	-176	69.7	0	0	0	112.1	H596 R650 S651 A656 L657 L658	H596-H654 AromaticContact CE1-ND1 3.87Å; R650-H654 VanDerWaalsContact O-CB 3.22Å; R650-H654 WeakPolarHBondContact O-CB 3.48Å; R650-H654 PolarHBondContact O-N 3.29Å; S651-H654 PolarHBondContact O-N 2.95Å; H654-A656 VanDerWaalsContact C-N 3.34Å; H654-A656 PolarHBondContact O-N 3.41Å; H654-L657 WeakPolarHBondContact O-CB 3.33Å; H654-L657 PolarHBondContact O-N 3.33Å; H654-L658 WeakPolarHBondContact O-CG 3.44Å; H654-L658 PolarHBondContact O-N 3.05Å
655	N	86.1	Confident	87.6	Confident	86 Å²	86	52.3 Å²	52.3	46%	0.46	27%	0.272	S	S	.	.	H	α-helix	trans	-63.6	-40	175.4	-71	-29.3	0	0	0	112.1	S651 N652 T659	S651-N655 WeakPolarHBondContact O-CB 3.34Å; S651-N655 VanDerWaalsContact O-CG 3.27Å; S651-N655 PolarHBondContact O-N 3.34Å; S651-N655 PolarHBondContact O-ND2 2.65Å; N652-N655 PolarHBondContact O-N 2.99Å; N655-T659 PolarHBondContact O-N 2.91Å; N655-T659 VanDerWaalsContact O-N 3.07Å; N655-T659 PolarHBondContact O-OG1 3.01Å
656	A	89.1	Confident	87.6	Confident	35 Å²	35	50.3 Å²	50.3	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-45	173.6	0	0	0	0	0	111.2	F592 N652 N653 H654 L658 T659 R660	F592-A656 HydrophobicContact CE1-CB 4.43Å; F592-A656 HydrophobicContact CE2-CB 4.16Å; F592-A656 HydrophobicContact CZ-CB 4Å; N652-A656 WeakPolarHBondContact O-CB 3.39Å; N652-A656 PolarHBondContact O-N 2.83Å; N653-A656 PolarHBondContact O-N 3.39Å; H654-A656 VanDerWaalsContact C-N 3.34Å; H654-A656 PolarHBondContact O-N 3.41Å; A656-L658 PolarHBondContact O-N 3.32Å; A656-T659 WeakPolarHBondContact O-CB 3.41Å; A656-T659 PolarHBondContact O-N 3.24Å; A656-R660 WeakPolarHBondContact O-CG 3.43Å; A656-R660 PolarHBondContact O-N 3.17Å
657	L	87.6	Confident	87.9	Confident	8 Å²	8	48.7 Å²	48.7	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-48.7	175.9	175.9	60	0	0	0	111.9	V589 F592 N653 H654 T659 R660 L661	V589-L657 HydrophobicContact CG1-CD1 4.04Å; F592-L657 HydrophobicContact CB-CB 4.09Å; F592-L657 HydrophobicContact CB-CD1 3.95Å; F592-L657 HydrophobicContact CB-CG 4.46Å; N653-L657 WeakPolarHBondContact O-CB 3.34Å; N653-L657 PolarHBondContact O-N 3.11Å; H654-L657 WeakPolarHBondContact O-CB 3.33Å; H654-L657 PolarHBondContact O-N 3.33Å; L657-T659 VanDerWaalsContact C-N 3.28Å; L657-T659 PolarHBondContact O-N 3.08Å; L657-R660 PolarHBondContact O-N 2.78Å; L657-R660 VanDerWaalsContact O-N 3.15Å; L657-L661 HydrophobicContact CD1-CD1 4.23Å; L657-L661 HydrophobicContact CD1-CG 4.11Å; L657-L661 HydrophobicContact CG-CD1 4.14Å; L657-L661 HydrophobicContact CG-CG 4.45Å; L657-L661 WeakPolarHBondContact O-CG 3.46Å; L657-L661 PolarHBondContact O-N 2.86Å
658	L	85.3	Confident	88.2	Confident	20 Å²	20	43 Å²	43	11%	0.105	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-39.1	177.2	-72.2	177.2	0	0	0	112	T116 H654 A656 K662	T116-L658 WeakPolarHBondContact O-CD2 3.42Å; H654-L658 WeakPolarHBondContact O-CG 3.44Å; H654-L658 PolarHBondContact O-N 3.05Å; A656-L658 PolarHBondContact O-N 3.32Å; L658-K662 WeakPolarHBondContact O-CB 3.49Å; L658-K662 PolarHBondContact O-N 3.06Å
659	T	87.8	Confident	88.3	Confident	82 Å²	82	40.7 Å²	40.7	50%	0.503	22%	0.215	S	C	.	.	H	α-helix	trans	-64.6	-42.3	176.4	-55.1	0	0	0	0	111	N655 A656 L657 K662 S663	N655-T659 PolarHBondContact O-N 2.91Å; N655-T659 VanDerWaalsContact O-N 3.07Å; N655-T659 PolarHBondContact O-OG1 3.01Å; A656-T659 WeakPolarHBondContact O-CB 3.41Å; A656-T659 PolarHBondContact O-N 3.24Å; L657-T659 VanDerWaalsContact C-N 3.28Å; L657-T659 PolarHBondContact O-N 3.08Å; T659-K662 WeakPolarHBondContact O-CB 3.47Å; T659-K662 PolarHBondContact O-N 2.87Å; T659-S663 PolarHBondContact O-N 2.83Å; T659-S663 PolarHBondContact O-OG 2.98Å
660	R	90.7	Very high	88.4	Confident	74 Å²	74	38.9 Å²	38.9	28%	0.279	20%	0.202	S	C	.	.	H	α-helix	trans	-69	-41.8	177	-64.3	-40.1	-161.2	178	3.2	112.7	T585 E588 V589 F592 A656 L657 K662 S663 V664	T585-R660 HydrophobicContact CG2-CB 3.99Å; T585-R660 HydrophobicContact CG2-CG 4.32Å; E588-R660 IonicContact OE1-NH2 2.79Å; E588-R660 PolarHBondContact OE1-NH2 3.16Å; E588-R660 IonicContact OE2-CZ 2.75Å; E588-R660 IonicContact OE2-NE 3.13Å; E588-R660 PolarHBondContact OE2-NE 3.09Å; E588-R660 IonicContact OE2-NH2 3.77Å; E588-R660 PolarHBondContact OE2-NH2 2.79Å; V589-R660 HydrophobicContact CG2-CB 3.6Å; F592-R660 HydrophobicContact CD2-CG 4.3Å; F592-R660 HydrophobicContact CE2-CG 3.95Å; A656-R660 WeakPolarHBondContact O-CG 3.43Å; A656-R660 PolarHBondContact O-N 3.17Å; L657-R660 PolarHBondContact O-N 2.78Å; L657-R660 VanDerWaalsContact O-N 3.15Å; R660-K662 VanDerWaalsContact C-N 3.28Å; R660-K662 PolarHBondContact O-N 2.66Å; R660-S663 WeakPolarHBondContact O-CB 3.33Å; R660-S663 PolarHBondContact O-N 3.11Å; R660-S663 VanDerWaalsContact O-N 3.11Å; R660-V664 WeakPolarHBondContact O-CG2 3.21Å; R660-V664 PolarHBondContact O-N 3.49Å
661	L	86.6	Confident	88.7	Confident	25 Å²	25	36 Å²	36	13%	0.131	19%	0.192	C	C	.	.	H	α-helix	trans	-58.7	-42	173	-74.3	176.3	0	0	0	111.2	V589 L657 S663 V664 N665	V589-L661 HydrophobicContact CG1-CD2 3.97Å; L657-L661 HydrophobicContact CD1-CD1 4.23Å; L657-L661 HydrophobicContact CD1-CG 4.11Å; L657-L661 HydrophobicContact CG-CD1 4.14Å; L657-L661 HydrophobicContact CG-CG 4.45Å; L657-L661 WeakPolarHBondContact O-CG 3.46Å; L657-L661 PolarHBondContact O-N 2.86Å; L661-S663 PolarHBondContact O-N 2.69Å; L661-V664 PolarHBondContact O-N 2.91Å; L661-N665 PolarHBondContact O-N 2.83Å
662	K	87.9	Confident	89	Confident	45 Å²	45	34.1 Å²	34.1	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-58.4	-46.7	172.5	-175.9	175	179.6	169.1	0	111.6	D160 N161 L658 T659 R660 V664 N665 Q666	D160-K662 WeakPolarHBondContact OD1-CE 3.49Å; D160-K662 IonicContact OD1-NZ 3.97Å; D160-K662 PolarHBondContact OD1-NZ 3.44Å; D160-K662 IonicContact OD2-NZ 2.64Å; N161-K662 PolarHBondContact ND2-NZ 2.87Å; N161-K662 PolarHBondContact OD1-NZ 2.8Å; L658-K662 WeakPolarHBondContact O-CB 3.49Å; L658-K662 PolarHBondContact O-N 3.06Å; T659-K662 WeakPolarHBondContact O-CB 3.47Å; T659-K662 PolarHBondContact O-N 2.87Å; R660-K662 VanDerWaalsContact C-N 3.28Å; R660-K662 PolarHBondContact O-N 2.66Å; K662-V664 VanDerWaalsContact C-N 3.33Å; K662-V664 PolarHBondContact O-N 3.14Å; K662-N665 PolarHBondContact O-N 3.3Å; K662-Q666 VanDerWaalsContact CE-NE2 3.3Å; K662-Q666 HydrophobicContact CG-CG 4.46Å; K662-Q666 WeakPolarHBondContact O-CB 3.27Å; K662-Q666 VanDerWaalsContact O-CG 3.32Å; K662-Q666 WeakPolarHBondContact O-CG 3.35Å; K662-Q666 PolarHBondContact O-N 3.12Å
663	S	90	Very high	89.1	Confident	39 Å²	39	31.7 Å²	31.7	27%	0.273	16%	0.162	S	C	.	.	H	α-helix	trans	-61	-38.5	176.5	-59.8	0	0	0	0	113	T659 R660 L661 A667	T659-S663 PolarHBondContact O-N 2.83Å; T659-S663 PolarHBondContact O-OG 2.98Å; R660-S663 WeakPolarHBondContact O-CB 3.33Å; R660-S663 PolarHBondContact O-N 3.11Å; R660-S663 VanDerWaalsContact O-N 3.11Å; L661-S663 PolarHBondContact O-N 2.69Å; S663-A667 WeakPolarHBondContact O-CB 3.43Å; S663-A667 PolarHBondContact O-N 2.69Å
664	V	90.9	Very high	89.2	Confident	9 Å²	9	31 Å²	31	6%	0.055	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-48.2	175.4	173.3	0	0	0	0	110.8	L582 T585 L586 V589 R660 L661 K662 Q666 A667 I668 I691	L582-V664 HydrophobicContact CD1-CG2 4.33Å; T585-V664 HydrophobicContact CG2-CG2 4.01Å; L586-V664 HydrophobicContact CD2-CG1 4.03Å; L586-V664 HydrophobicContact CD2-CG2 3.79Å; L586-V664 HydrophobicContact CG-CG2 4.38Å; V589-V664 HydrophobicContact CG2-CG2 4.45Å; R660-V664 WeakPolarHBondContact O-CG2 3.21Å; R660-V664 PolarHBondContact O-N 3.49Å; L661-V664 PolarHBondContact O-N 2.91Å; K662-V664 VanDerWaalsContact C-N 3.33Å; K662-V664 PolarHBondContact O-N 3.14Å; V664-Q666 VanDerWaalsContact C-N 3.34Å; V664-Q666 PolarHBondContact O-N 3.46Å; V664-A667 WeakPolarHBondContact O-CB 3.37Å; V664-A667 PolarHBondContact O-N 2.75Å; V664-A667 VanDerWaalsContact O-N 3.11Å; V664-I668 HydrophobicContact CG1-CD1 4.47Å; V664-I668 WeakPolarHBondContact O-CG1 3.31Å; V664-I668 PolarHBondContact O-N 3.22Å; V664-I668 VanDerWaalsContact O-N 3.08Å; V664-I691 HydrophobicContact CG1-CD1 3.93Å
665	N	89.4	Confident	89.6	Confident	12 Å²	12	29.3 Å²	29.3	6%	0.064	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-42.7	177.2	-72.2	-20.9	0	0	0	111.3	D117 N140 C141 V157 L661 K662 A667 I668 Q669	D117-N665 PolarHBondContact OD1-ND2 2.66Å; N140-N665 PolarHBondContact O-ND2 3.36Å; N140-N665 VanDerWaalsContact O-ND2 3.1Å; C141-N665 HydrophobicContact CB-CB 3.69Å; V157-N665 HydrophobicContact CG2-CB 4.02Å; V157-N665 WeakPolarHBondContact CG2-O 3.48Å; L661-N665 PolarHBondContact O-N 2.83Å; K662-N665 PolarHBondContact O-N 3.3Å; N665-A667 VanDerWaalsContact C-N 3.31Å; N665-A667 PolarHBondContact O-N 2.71Å; N665-I668 PolarHBondContact O-N 3.34Å; N665-Q669 PolarHBondContact O-N 3.36Å
666	Q	90.2	Very high	89.8	Confident	42 Å²	42	26 Å²	26	20%	0.196	13%	0.133	C	C	.	.	H	α-helix	trans	-60.8	-38.1	173.5	-75.6	-179.8	-14.3	0	0	112.4	K662 V664 I668 Q669 R670	K662-Q666 VanDerWaalsContact CE-NE2 3.3Å; K662-Q666 HydrophobicContact CG-CG 4.46Å; K662-Q666 WeakPolarHBondContact O-CB 3.27Å; K662-Q666 VanDerWaalsContact O-CG 3.32Å; K662-Q666 WeakPolarHBondContact O-CG 3.35Å; K662-Q666 PolarHBondContact O-N 3.12Å; V664-Q666 VanDerWaalsContact C-N 3.34Å; V664-Q666 PolarHBondContact O-N 3.46Å; Q666-I668 PolarHBondContact O-N 3.07Å; Q666-Q669 PolarHBondContact O-N 2.88Å; Q666-R670 WeakPolarHBondContact O-CB 3.49Å; Q666-R670 VanDerWaalsContact O-CG 3.25Å; Q666-R670 WeakPolarHBondContact O-CG 3.29Å; Q666-R670 PolarHBondContact O-N 2.9Å
667	A	91.7	Very high	89.7	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-39.9	176	0	0	0	0	0	112.5	Y578 L582 S663 V664 N665 Q669 R670 A671 M703	Y578-A667 HydrophobicContact CE1-CB 4.39Å; Y578-A667 VanDerWaalsContact OH-CA 3.31Å; Y578-A667 WeakPolarHBondContact OH-CA 3.24Å; Y578-A667 VanDerWaalsContact OH-CB 3.26Å; Y578-A667 WeakPolarHBondContact OH-CB 3.48Å; L582-A667 HydrophobicContact CD1-CB 3.68Å; L582-A667 HydrophobicContact CD2-CB 3.71Å; L582-A667 HydrophobicContact CG-CB 4.32Å; S663-A667 WeakPolarHBondContact O-CB 3.43Å; S663-A667 PolarHBondContact O-N 2.69Å; V664-A667 WeakPolarHBondContact O-CB 3.37Å; V664-A667 PolarHBondContact O-N 2.75Å; V664-A667 VanDerWaalsContact O-N 3.11Å; N665-A667 VanDerWaalsContact C-N 3.31Å; N665-A667 PolarHBondContact O-N 2.71Å; A667-Q669 VanDerWaalsContact C-N 3.35Å; A667-R670 PolarHBondContact O-N 3.25Å; A667-A671 WeakPolarHBondContact O-CB 3.19Å; A667-A671 PolarHBondContact O-N 3.19Å; A667-M703 HydrophobicContact CB-CE 4.41Å
668	I	91.3	Very high	89.7	Confident	1 Å²	1	31 Å²	31	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-62.9	-44.8	173.6	-58.4	167.2	0	0	0	110.1	W155 V157 V664 N665 Q666 A671 G672 I684 C687 I691 M703	W155-I668 HydrophobicContact CH2-CD1 4.38Å; V157-I668 HydrophobicContact CG1-CG2 4.18Å; V664-I668 HydrophobicContact CG1-CD1 4.47Å; V664-I668 WeakPolarHBondContact O-CG1 3.31Å; V664-I668 PolarHBondContact O-N 3.22Å; V664-I668 VanDerWaalsContact O-N 3.08Å; N665-I668 PolarHBondContact O-N 3.34Å; Q666-I668 PolarHBondContact O-N 3.07Å; I668-A671 PolarHBondContact O-N 3.4Å; I668-G672 PolarHBondContact O-N 3.35Å; I668-I684 HydrophobicContact CG2-CB 4.48Å; I668-I684 HydrophobicContact CG2-CG1 4.32Å; I668-I684 HydrophobicContact CG2-CG2 4.38Å; I668-C687 HydrophobicContact CG1-CB 4.17Å; I668-C687 HydrophobicContact CG2-CB 3.81Å; I668-I691 HydrophobicContact CD1-CD1 3.43Å; I668-I691 VanDerWaalsContact CD1-CD1 3.43Å; I668-I691 HydrophobicContact CG1-CD1 4.15Å; I668-M703 HydrophobicContact CG1-CE 4.05Å
669	Q	89.9	Confident	89.9	Confident	18 Å²	18	30.9 Å²	30.9	8%	0.084	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-45.2	178.6	-171.2	-85.1	0.9	0	0	111.6	V157 N665 Q666 A667 G672 R673	V157-Q669 HydrophobicContact CG1-CB 3.92Å; V157-Q669 HydrophobicContact CG1-CG 4.36Å; V157-Q669 HydrophobicContact CG2-CB 4.12Å; N665-Q669 PolarHBondContact O-N 3.36Å; Q666-Q669 PolarHBondContact O-N 2.88Å; A667-Q669 VanDerWaalsContact C-N 3.35Å; Q669-G672 CarbonylContact O-C 3.56Å; Q669-G672 WeakPolarHBondContact O-CA 3.47Å; Q669-G672 PolarHBondContact O-N 2.9Å; Q669-G672 VanDerWaalsContact O-N 3.11Å; Q669-R673 WeakPolarHBondContact O-CB 3.47Å; Q669-R673 PolarHBondContact O-N 2.81Å
670	R	91.3	Very high	90	Very high	58 Å²	58	28.1 Å²	28.1	22%	0.219	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-45.2	177.4	-76	167.1	167.1	169	1.3	111.7	I550 D551 Y578 Q666 A667 G672 R673 L674	I550-R670 HydrophobicContact CD1-CB 3.99Å; I550-R670 HydrophobicContact CG1-CB 4.3Å; I550-R670 HydrophobicContact CG2-CG 4.42Å; D551-R670 VanDerWaalsContact CG-NE 3.34Å; D551-R670 WeakPolarHBondContact OD1-CG 3.19Å; D551-R670 IonicContact OD1-CZ 2.74Å; D551-R670 IonicContact OD1-NE 2.83Å; D551-R670 PolarHBondContact OD1-NE 3Å; D551-R670 IonicContact OD1-NH2 3.86Å; D551-R670 IonicContact OD2-CZ 3.21Å; D551-R670 IonicContact OD2-NE 3.28Å; D551-R670 PolarHBondContact OD2-NE 3.3Å; D551-R670 VanDerWaalsContact OD2-NE 3.14Å; D551-R670 IonicContact OD2-NH2 2.83Å; D551-R670 PolarHBondContact OD2-NH2 3.04Å; Y578-R670 WeakPolarHBondContact OH-CD 3.42Å; Y578-R670 PolarHBondContact OH-NH1 2.99Å; Q666-R670 WeakPolarHBondContact O-CB 3.49Å; Q666-R670 VanDerWaalsContact O-CG 3.25Å; Q666-R670 WeakPolarHBondContact O-CG 3.29Å; Q666-R670 PolarHBondContact O-N 2.9Å; A667-R670 PolarHBondContact O-N 3.25Å; R670-G672 VanDerWaalsContact C-N 3.26Å; R670-G672 PolarHBondContact O-N 2.88Å; R670-R673 PolarHBondContact O-N 2.86Å; R670-R673 VanDerWaalsContact O-N 3.14Å; R670-L674 PolarHBondContact O-N 3.34Å; R670-L674 VanDerWaalsContact O-N 3.1Å
671	A	91.8	Very high	89.7	Confident	4 Å²	4	25.4 Å²	25.4	3%	0.033	13%	0.129	C	C	.	.	H	α-helix	trans	-60.8	-36.1	174.4	0	0	0	0	0	112.3	A667 I668 R675 V683 M703	A667-A671 WeakPolarHBondContact O-CB 3.19Å; A667-A671 PolarHBondContact O-N 3.19Å; I668-A671 PolarHBondContact O-N 3.4Å; A671-R675 PolarHBondContact O-NH1 3.47Å; A671-V683 HydrophobicContact CB-CG1 4.27Å; A671-M703 HydrophobicContact CB-CB 4.1Å; A671-M703 HydrophobicContact CB-CE 4.33Å; A671-M703 HydrophobicContact CB-CG 3.71Å; A671-M703 HydrophobicContact CB-SD 4.29Å
672	G	89.8	Confident	89.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.5	-43.1	171.3	0	0	0	0	0	113.1	I668 Q669 R670 L674 R675 K680	I668-G672 PolarHBondContact O-N 3.35Å; Q669-G672 CarbonylContact O-C 3.56Å; Q669-G672 WeakPolarHBondContact O-CA 3.47Å; Q669-G672 PolarHBondContact O-N 2.9Å; Q669-G672 VanDerWaalsContact O-N 3.11Å; R670-G672 VanDerWaalsContact C-N 3.26Å; R670-G672 PolarHBondContact O-N 2.88Å; G672-L674 PolarHBondContact O-N 3.14Å; G672-R675 PolarHBondContact O-N 3.46Å; G672-R675 VanDerWaalsContact O-O 3.09Å; G672-K680 WeakPolarHBondContact O-CG 3.25Å
673	R	89.7	Confident	90	Very high	50 Å²	50	28 Å²	28	19%	0.189	14%	0.141	C	C	.	.	H	α-helix	trans	-66.8	-19.2	-179.1	-168.2	178.4	179.8	121.3	-9.5	113	E198 D555 Q558 Q669 R670 R675	E198-R673 IonicContact OE1-NH1 3.42Å; D555-R673 IonicContact OD1-CZ 3.45Å; D555-R673 VanDerWaalsContact OD1-CZ 3.25Å; D555-R673 IonicContact OD1-NE 3.16Å; D555-R673 PolarHBondContact OD1-NE 3.22Å; D555-R673 IonicContact OD1-NH2 3.2Å; D555-R673 PolarHBondContact OD1-NH2 3.13Å; Q558-R673 HydrophobicContact CG-CG 4.05Å; Q558-R673 WeakPolarHBondContact CG-O 3.35Å; Q558-R673 PolarHBondContact NE2-O 3.49Å; Q669-R673 WeakPolarHBondContact O-CB 3.47Å; Q669-R673 PolarHBondContact O-N 2.81Å; R670-R673 PolarHBondContact O-N 2.86Å; R670-R673 VanDerWaalsContact O-N 3.14Å; R673-R675 PolarHBondContact O-N 3.3Å
674	L	92.8	Very high	89.9	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-7.6	167.9	-70.8	170	0	0	0	113.6	V492 I550 A553 V571 A573 F575 R670 G672	V492-L674 HydrophobicContact CG1-CD2 4.49Å; V492-L674 HydrophobicContact CG2-CD2 4.26Å; I550-L674 HydrophobicContact CD1-CD1 4.06Å; I550-L674 HydrophobicContact CG1-CD1 3.98Å; I550-L674 HydrophobicContact CG1-CG 4.41Å; A553-L674 HydrophobicContact CB-CD2 3.81Å; V571-L674 WeakPolarHBondContact CG2-O 3.47Å; A573-L674 HydrophobicContact CB-CD1 3.93Å; F575-L674 HydrophobicContact CE2-CD1 3.9Å; R670-L674 PolarHBondContact O-N 3.34Å; R670-L674 VanDerWaalsContact O-N 3.1Å; G672-L674 PolarHBondContact O-N 3.14Å
675	R	92.1	Very high	89.8	Confident	3 Å²	3	28.4 Å²	28.4	1%	0.011	15%	0.146	C	C	.	.	S	Bend	trans	-127.7	157.8	-175.8	-65.6	171.4	-179.6	87.6	2.4	110.8	Q558 V571 A671 G672 R673 A679 K680 M703 R704	Q558-R675 PolarHBondContact NE2-O 3.3Å; V571-R675 HydrophobicContact CB-CG 4.18Å; V571-R675 HydrophobicContact CG2-CG 4.35Å; V571-R675 PolarHBondContact O-NE 2.99Å; V571-R675 PolarHBondContact O-NH2 3.33Å; A671-R675 PolarHBondContact O-NH1 3.47Å; G672-R675 PolarHBondContact O-N 3.46Å; G672-R675 VanDerWaalsContact O-O 3.09Å; R673-R675 PolarHBondContact O-N 3.3Å; R675-A679 HydrophobicContact CB-CB 4.13Å; R675-K680 HydrophobicContact CB-CB 4.49Å; R675-M703 PolarHBondContact NH1-O 3.21Å; R675-M703 PolarHBondContact NH2-O 3.46Å; R675-R704 PolarHBondContact NH2-O 3.48Å
676	V	89.6	Confident	89.8	Confident	17 Å²	17	29 Å²	29	10%	0.103	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-122	141.5	-176.3	-171.7	0	0	0	0	109.6	V557 A561 D568 L569	V557-V676 HydrophobicContact CG1-CG2 4.41Å; A561-V676 HydrophobicContact CB-CB 4.41Å; A561-V676 HydrophobicContact CB-CG1 4.29Å; A561-V676 HydrophobicContact CB-CG2 3.63Å; D568-V676 WeakPolarHBondContact CA-O 3.4Å; L569-V676 HydrophobicContact CB-CB 3.87Å; L569-V676 HydrophobicContact CB-CG2 4.06Å; L569-V676 HydrophobicContact CD2-CG2 4.42Å; L569-V676 PolarHBondContact N-O 3.01Å; L569-V676 PolarHBondContact O-N 2.95Å; L569-V676 VanDerWaalsContact O-N 3.11Å
677	G	87.7	Confident	89.8	Confident	23 Å²	23	27 Å²	27	24%	0.237	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-139	178.4	0	0	0	0	0	113.8	E567 D568 A679 K680	E567-G677 WeakPolarHBondContact O-CA 3.4Å; E567-G677 PolarHBondContact O-N 2.83Å; D568-G677 VanDerWaalsContact OD1-CA 3.29Å; D568-G677 WeakPolarHBondContact OD1-CA 3.12Å; G677-A679 PolarHBondContact O-N 3.42Å; G677-K680 VanDerWaalsContact O-CB 3.27Å; G677-K680 WeakPolarHBondContact O-CB 3.48Å; G677-K680 PolarHBondContact O-N 3.44Å
678	K	87.3	Confident	89.6	Confident	125 Å²	125	29 Å²	29	54%	0.543	15%	0.151	S	C	.	.	H	α-helix	trans	-59.3	-33.3	-173.9	-66.4	174.6	-177.6	167.2	0	113.3	D568 K680 N681 Q682	D568-K678 PolarHBondContact OD1-N 2.88Å; K678-K680 PolarHBondContact O-N 3.36Å; K678-N681 PolarHBondContact O-N 3.08Å; K678-Q682 WeakPolarHBondContact O-CG 3.46Å; K678-Q682 PolarHBondContact O-N 3.25Å; K678-Q682 VanDerWaalsContact O-N 3.11Å
679	A	89.2	Confident	89.4	Confident	18 Å²	18	33.6 Å²	33.6	15%	0.149	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-30.2	178.6	0	0	0	0	0	112.3	R675 G677 V683	R675-A679 HydrophobicContact CB-CB 4.13Å; G677-A679 PolarHBondContact O-N 3.42Å; A679-V683 WeakPolarHBondContact O-CG2 3.35Å; A679-V683 PolarHBondContact O-N 2.72Å
680	K	89.3	Confident	89.4	Confident	23 Å²	23	33 Å²	33	10%	0.1	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-50.4	175.2	176.6	171.7	-179.1	179.6	0	111.2	G672 R675 G677 K678 Q682 V683 I684	G672-K680 WeakPolarHBondContact O-CG 3.25Å; R675-K680 HydrophobicContact CB-CB 4.49Å; G677-K680 VanDerWaalsContact O-CB 3.27Å; G677-K680 WeakPolarHBondContact O-CB 3.48Å; G677-K680 PolarHBondContact O-N 3.44Å; K678-K680 PolarHBondContact O-N 3.36Å; K680-Q682 PolarHBondContact O-N 3.23Å; K680-V683 PolarHBondContact O-N 3.49Å; K680-I684 HydrophobicContact CG-CD1 3.92Å; K680-I684 WeakPolarHBondContact O-CG1 3.37Å; K680-I684 PolarHBondContact O-N 3.45Å; K680-I684 VanDerWaalsContact O-N 3.09Å
681	N	85.1	Confident	89.2	Confident	17 Å²	17	33.2 Å²	33.2	9%	0.091	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-43	-178	-59	-1.9	0	0	0	111.6	D193 Q194 K678 V683 I684 A685	D193-N681 PolarHBondContact O-ND2 3.48Å; D193-N681 PolarHBondContact O-OD1 2.86Å; Q194-N681 VanDerWaalsContact CA-ND2 3.29Å; Q194-N681 WeakPolarHBondContact CA-ND2 3.45Å; K678-N681 PolarHBondContact O-N 3.08Å; N681-V683 VanDerWaalsContact C-N 3.29Å; N681-V683 PolarHBondContact O-N 2.82Å; N681-I684 PolarHBondContact O-N 3.4Å; N681-I684 VanDerWaalsContact O-N 3.16Å; N681-A685 WeakPolarHBondContact O-CB 3.28Å; N681-A685 PolarHBondContact O-N 3.15Å
682	Q	88.8	Confident	88.8	Confident	125 Å²	125	39.2 Å²	39.2	58%	0.584	20%	0.204	S	C	*	.	H	α-helix	trans	-58.2	-41.9	178.3	-72.6	175.8	-2.1	0	0	111.9	K678 K680 A686	K678-Q682 WeakPolarHBondContact O-CG 3.46Å; K678-Q682 PolarHBondContact O-N 3.25Å; K678-Q682 VanDerWaalsContact O-N 3.11Å; K680-Q682 PolarHBondContact O-N 3.23Å; Q682-A686 WeakPolarHBondContact O-CB 3.48Å; Q682-A686 PolarHBondContact O-N 3.1Å
683	V	91.6	Very high	88.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-67.4	-43.2	176.4	168.8	0	0	0	0	111.4	A671 A679 K680 N681 A685 A686 C687 I702	A671-V683 HydrophobicContact CB-CG1 4.27Å; A679-V683 WeakPolarHBondContact O-CG2 3.35Å; A679-V683 PolarHBondContact O-N 2.72Å; K680-V683 PolarHBondContact O-N 3.49Å; N681-V683 VanDerWaalsContact C-N 3.29Å; N681-V683 PolarHBondContact O-N 2.82Å; V683-A685 PolarHBondContact O-N 3.05Å; V683-A686 PolarHBondContact O-N 3.31Å; V683-C687 WeakPolarHBondContact O-CB 3.38Å; V683-C687 PolarHBondContact O-N 2.95Å; V683-C687 PolarHBondContact O-SG 3.49Å; V683-I702 HydrophobicContact CG1-CG2 4.31Å; V683-I702 HydrophobicContact CG2-CG2 4.49Å
684	I	89.5	Confident	88.4	Confident	9 Å²	9	45.7 Å²	45.7	5%	0.046	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-48.1	178.9	-68.6	165.6	0	0	0	110.6	W155 V157 I668 K680 N681 C687 R688	W155-I684 HydrophobicContact CE3-CG2 4.42Å; W155-I684 HydrophobicContact CZ3-CG2 3.7Å; V157-I684 HydrophobicContact CB-CG2 4.46Å; V157-I684 HydrophobicContact CG1-CD1 3.92Å; V157-I684 HydrophobicContact CG1-CG1 3.95Å; V157-I684 HydrophobicContact CG1-CG2 3.85Å; I668-I684 HydrophobicContact CG2-CB 4.48Å; I668-I684 HydrophobicContact CG2-CG1 4.32Å; I668-I684 HydrophobicContact CG2-CG2 4.38Å; K680-I684 HydrophobicContact CG-CD1 3.92Å; K680-I684 WeakPolarHBondContact O-CG1 3.37Å; K680-I684 PolarHBondContact O-N 3.45Å; K680-I684 VanDerWaalsContact O-N 3.09Å; N681-I684 PolarHBondContact O-N 3.4Å; N681-I684 VanDerWaalsContact O-N 3.16Å; I684-C687 PolarHBondContact O-N 3.45Å; I684-R688 PolarHBondContact O-N 2.94Å
685	A	87.3	Confident	88.1	Confident	47 Å²	47	49.2 Å²	49.2	39%	0.388	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-47.9	178	0	0	0	0	0	111.9	N681 V683 C687 R688 D689	N681-A685 WeakPolarHBondContact O-CB 3.28Å; N681-A685 PolarHBondContact O-N 3.15Å; V683-A685 PolarHBondContact O-N 3.05Å; A685-C687 PolarHBondContact O-N 2.99Å; A685-R688 VanDerWaalsContact O-CB 3.3Å; A685-R688 WeakPolarHBondContact O-CB 3.44Å; A685-R688 PolarHBondContact O-N 2.93Å; A685-R688 VanDerWaalsContact O-N 3.15Å; A685-D689 PolarHBondContact O-N 3.36Å
686	A	90.2	Very high	87.9	Confident	23 Å²	23	51 Å²	51	19%	0.19	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-36.1	-179.6	0	0	0	0	0	112.7	Q682 V683 R688 D689 A690 I702	Q682-A686 WeakPolarHBondContact O-CB 3.48Å; Q682-A686 PolarHBondContact O-N 3.1Å; V683-A686 PolarHBondContact O-N 3.31Å; A686-R688 VanDerWaalsContact C-N 3.34Å; A686-D689 PolarHBondContact O-N 3.04Å; A686-A690 WeakPolarHBondContact O-CB 3.44Å; A686-A690 PolarHBondContact O-N 3.46Å; A686-I702 HydrophobicContact CB-CD1 3.94Å; A686-I702 HydrophobicContact CB-CG1 4.42Å; A686-I702 HydrophobicContact CB-CG2 3.86Å
687	C	90.4	Very high	87.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-41.7	172.3	-76.2	0	0	0	0	111.3	I668 V683 I684 A685 A690 I691 L699	I668-C687 HydrophobicContact CG1-CB 4.17Å; I668-C687 HydrophobicContact CG2-CB 3.81Å; V683-C687 WeakPolarHBondContact O-CB 3.38Å; V683-C687 PolarHBondContact O-N 2.95Å; V683-C687 PolarHBondContact O-SG 3.49Å; I684-C687 PolarHBondContact O-N 3.45Å; A685-C687 PolarHBondContact O-N 2.99Å; C687-A690 PolarHBondContact O-N 3.14Å; C687-I691 WeakPolarHBondContact O-CG1 3.42Å; C687-I691 PolarHBondContact O-N 3.33Å; C687-L699 HydrophobicContact CB-CD1 3.61Å
688	R	87	Confident	87.9	Confident	44 Å²	44	55.6 Å²	55.6	17%	0.166	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-47.9	175.7	-166.1	-162.2	-165.9	-162.2	-4	111.5	D152 W155 I684 A685 A686 A690 I691 K692	D152-R688 IonicContact OD2-CZ 2.68Å; D152-R688 VanDerWaalsContact OD2-CZ 3.27Å; D152-R688 IonicContact OD2-NH1 3.36Å; D152-R688 PolarHBondContact OD2-NH1 2.58Å; D152-R688 IonicContact OD2-NH2 3.82Å; D152-R688 PolarHBondContact OD2-NH2 2.89Å; W155-R688 VanDerWaalsContact CD2-CD 3.48Å; W155-R688 HydrophobicContact CD2-CG 4.11Å; W155-R688 HydrophobicContact CE3-CB 4.14Å; W155-R688 HydrophobicContact CE3-CG 3.84Å; W155-R688 VanDerWaalsContact CG-NH2 3.26Å; W155-R688 HydrophobicContact CH2-CB 3.96Å; W155-R688 HydrophobicContact CH2-CG 3.82Å; W155-R688 HydrophobicContact CZ2-CG 4.1Å; W155-R688 HydrophobicContact CZ3-CB 3.62Å; W155-R688 HydrophobicContact CZ3-CG 3.67Å; I684-R688 PolarHBondContact O-N 2.94Å; A685-R688 VanDerWaalsContact O-CB 3.3Å; A685-R688 WeakPolarHBondContact O-CB 3.44Å; A685-R688 PolarHBondContact O-N 2.93Å; A685-R688 VanDerWaalsContact O-N 3.15Å; A686-R688 VanDerWaalsContact C-N 3.34Å; R688-A690 VanDerWaalsContact C-N 3.31Å; R688-A690 PolarHBondContact O-N 3.33Å; R688-I691 PolarHBondContact O-N 2.84Å; R688-K692 VanDerWaalsContact CZ-NZ 3.25Å; R688-K692 WeakPolarHBondContact O-CG 3.43Å; R688-K692 PolarHBondContact O-N 3.42Å
689	D	88.3	Confident	88	Confident	98 Å²	98	49.8 Å²	49.8	52%	0.524	27%	0.274	S	S	.	.	H	α-helix	trans	-65.6	-36.3	-179.7	-68.6	-21	0	0	0	111.9	A685 A686 K692 S693	A685-D689 PolarHBondContact O-N 3.36Å; A686-D689 PolarHBondContact O-N 3.04Å; D689-K692 PolarHBondContact O-N 3.34Å; D689-S693 WeakPolarHBondContact O-CB 3Å; D689-S693 PolarHBondContact O-N 2.91Å; D689-S693 PolarHBondContact O-OG 3.17Å
690	A	88.1	Confident	88.1	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-64.7	-39.1	173.7	0	0	0	0	0	112.3	A686 C687 R688 S693 N694 N695 L699 I702	A686-A690 WeakPolarHBondContact O-CB 3.44Å; A686-A690 PolarHBondContact O-N 3.46Å; C687-A690 PolarHBondContact O-N 3.14Å; R688-A690 VanDerWaalsContact C-N 3.31Å; R688-A690 PolarHBondContact O-N 3.33Å; A690-S693 WeakPolarHBondContact CA-OG 3.41Å; A690-S693 PolarHBondContact O-OG 3.15Å; A690-N694 PolarHBondContact O-N 2.94Å; A690-N694 VanDerWaalsContact O-N 3.16Å; A690-N695 PolarHBondContact O-N 2.99Å; A690-L699 HydrophobicContact CB-CB 3.96Å; A690-L699 HydrophobicContact CB-CD1 4.23Å; A690-I702 HydrophobicContact CB-CD1 4.14Å
691	I	86.9	Confident	88.1	Confident	63 Å²	63	53.1 Å²	53.1	32%	0.323	28%	0.282	S	S	.	.	H	α-helix	trans	-69.1	-44.8	175.1	-68.5	166	0	0	0	110.7	V664 I668 C687 R688 S693 N694 L699	V664-I691 HydrophobicContact CG1-CD1 3.93Å; I668-I691 HydrophobicContact CD1-CD1 3.43Å; I668-I691 VanDerWaalsContact CD1-CD1 3.43Å; I668-I691 HydrophobicContact CG1-CD1 4.15Å; C687-I691 WeakPolarHBondContact O-CG1 3.42Å; C687-I691 PolarHBondContact O-N 3.33Å; R688-I691 PolarHBondContact O-N 2.84Å; I691-S693 VanDerWaalsContact C-N 3.26Å; I691-S693 PolarHBondContact O-N 3.36Å; I691-N694 PolarHBondContact O-N 2.67Å; I691-L699 HydrophobicContact CD1-CD1 4.28Å; I691-L699 HydrophobicContact CD1-CD2 4.35Å; I691-L699 HydrophobicContact CG1-CD1 4.12Å; I691-L699 HydrophobicContact CG1-CD2 3.97Å
692	K	84.4	Confident	88.5	Confident	130 Å²	130	52.6 Å²	52.6	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-60	-35.2	176.6	-76.5	-175.7	175.4	-177.1	0	112.8	R688 D689 N694	R688-K692 VanDerWaalsContact CZ-NZ 3.25Å; R688-K692 WeakPolarHBondContact O-CG 3.43Å; R688-K692 PolarHBondContact O-N 3.42Å; D689-K692 PolarHBondContact O-N 3.34Å; K692-N694 VanDerWaalsContact C-N 3.31Å
693	S	86.9	Confident	88.6	Confident	81 Å²	81	46.9 Å²	46.9	57%	0.566	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	3.1	176.6	57.4	0	0	0	0	114.1	D689 A690 I691 N695	D689-S693 WeakPolarHBondContact O-CB 3Å; D689-S693 PolarHBondContact O-N 2.91Å; D689-S693 PolarHBondContact O-OG 3.17Å; A690-S693 WeakPolarHBondContact CA-OG 3.41Å; A690-S693 PolarHBondContact O-OG 3.15Å; I691-S693 VanDerWaalsContact C-N 3.26Å; I691-S693 PolarHBondContact O-N 3.36Å; S693-N695 PolarHBondContact O-N 2.86Å
694	N	83.9	Confident	88.6	Confident	105 Å²	105	50.9 Å²	50.9	56%	0.561	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	36.8	-174.8	-156	0.2	0	0	0	113.9	A690 I691 K692	A690-N694 PolarHBondContact O-N 2.94Å; A690-N694 VanDerWaalsContact O-N 3.16Å; I691-N694 PolarHBondContact O-N 2.67Å; K692-N694 VanDerWaalsContact C-N 3.31Å
695	N	87.8	Confident	88.5	Confident	76 Å²	76	52.6 Å²	52.6	41%	0.406	28%	0.284	S	S	.	.			trans	-101.8	79.4	179.2	-167.4	-17.4	0	0	0	111.2	A690 S693 N697 A698 L699	A690-N695 PolarHBondContact O-N 2.99Å; S693-N695 PolarHBondContact O-N 2.86Å; N695-N697 VanDerWaalsContact C-N 3.29Å; N695-N697 PolarHBondContact O-N 3.16Å; N695-A698 HydrophobicContact CB-CB 4.04Å; N695-A698 PolarHBondContact O-N 2.94Å; N695-A698 WeakPolarHBondContact OD1-CB 3.44Å; N695-A698 PolarHBondContact OD1-N 2.95Å; N695-L699 PolarHBondContact O-N 2.98Å
696	V	86.4	Confident	88	Confident	41 Å²	41	51.2 Å²	51.2	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-36.8	-178.1	179	0	0	0	0	112.5	L586 L699 F700	L586-V696 HydrophobicContact CD1-CG1 4.17Å; L586-V696 HydrophobicContact CD1-CG2 4.49Å; V696-L699 WeakPolarHBondContact O-CB 3.45Å; V696-L699 PolarHBondContact O-N 3.11Å; V696-F700 HydrophobicContact CG1-CD2 3.77Å; V696-F700 HydrophobicContact CG1-CE2 3.34Å; V696-F700 HydrophobicContact CG1-CZ 4.42Å; V696-F700 WeakPolarHBondContact O-CD2 3.33Å; V696-F700 PolarHBondContact O-N 3.46Å; V696-F700 VanDerWaalsContact O-N 3.15Å
697	N	88.1	Confident	87.1	Confident	119 Å²	119	54 Å²	54	64%	0.636	29%	0.289	S	S	*	.	H	α-helix	trans	-68.7	-40.8	179.4	-69.6	-31.7	0	0	0	111.9	N695 L699 R701	N695-N697 VanDerWaalsContact C-N 3.29Å; N695-N697 PolarHBondContact O-N 3.16Å; N697-L699 VanDerWaalsContact C-N 3.33Å; N697-R701 PolarHBondContact O-N 3.11Å; N697-R701 VanDerWaalsContact O-N 3.15Å
698	A	88.8	Confident	85.5	Confident	18 Å²	18	57.1 Å²	57.1	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-41.2	173.6	0	0	0	0	0	111.2	N695 F700 R701 I702	N695-A698 HydrophobicContact CB-CB 4.04Å; N695-A698 PolarHBondContact O-N 2.94Å; N695-A698 WeakPolarHBondContact OD1-CB 3.44Å; N695-A698 PolarHBondContact OD1-N 2.95Å; A698-F700 PolarHBondContact O-N 3.34Å; A698-R701 PolarHBondContact O-N 2.97Å; A698-I702 WeakPolarHBondContact O-CD1 3.13Å; A698-I702 WeakPolarHBondContact O-CG1 3.41Å; A698-I702 PolarHBondContact O-N 2.56Å
699	L	90.3	Very high	83.4	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.016	33%	0.328	C	S	.	.	H	α-helix	trans	-54.3	-53	176.7	-179.8	67.6	0	0	0	111.8	L586 C687 A690 I691 N695 V696 N697 R701 I702 M703	L586-L699 HydrophobicContact CD1-CD2 3.75Å; C687-L699 HydrophobicContact CB-CD1 3.61Å; A690-L699 HydrophobicContact CB-CB 3.96Å; A690-L699 HydrophobicContact CB-CD1 4.23Å; I691-L699 HydrophobicContact CD1-CD1 4.28Å; I691-L699 HydrophobicContact CD1-CD2 4.35Å; I691-L699 HydrophobicContact CG1-CD1 4.12Å; I691-L699 HydrophobicContact CG1-CD2 3.97Å; N695-L699 PolarHBondContact O-N 2.98Å; V696-L699 WeakPolarHBondContact O-CB 3.45Å; V696-L699 PolarHBondContact O-N 3.11Å; N697-L699 VanDerWaalsContact C-N 3.33Å; L699-R701 VanDerWaalsContact C-N 3.33Å; L699-R701 PolarHBondContact O-N 3.11Å; L699-I702 PolarHBondContact O-N 3.08Å; L699-M703 HydrophobicContact CD1-CE 3.94Å; L699-M703 HydrophobicContact CG-CE 4.19Å; L699-M703 HydrophobicContact CG-SD 4.45Å; L699-M703 WeakPolarHBondContact O-CG 3.46Å; L699-M703 PolarHBondContact O-N 3.18Å
700	F	91.3	Very high	80.9	Confident	7 Å²	7	62.1 Å²	62.1	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-63.8	-38	179.3	-73.2	-64.5	0	0	0	112.7	F579 L582 R583 V696 A698 I702 M703 R704	F579-F700 HydrophobicContact CB-CD1 3.79Å; F579-F700 HydrophobicContact CB-CE1 3.65Å; F579-F700 AromaticContact CD1-CD1 3.53Å; F579-F700 HydrophobicContact CD1-CD1 3.53Å; F579-F700 AromaticContact CD1-CE1 3.67Å; F579-F700 HydrophobicContact CD1-CE1 3.67Å; F579-F700 HydrophobicContact CE1-CD1 4.26Å; F579-F700 AromaticContact CG-CD1 3.77Å; F579-F700 HydrophobicContact CG-CD1 3.77Å; F579-F700 AromaticContact CG-CE1 3.98Å; F579-F700 HydrophobicContact CG-CE1 3.98Å; F579-F700 VanDerWaalsContact O-CE1 3.28Å; F579-F700 WeakPolarHBondContact O-CE1 3.34Å; F579-F700 VanDerWaalsContact O-CZ 3.24Å; F579-F700 WeakPolarHBondContact O-CZ 3.23Å; L582-F700 HydrophobicContact CB-CE1 4.12Å; L582-F700 HydrophobicContact CB-CZ 4.27Å; L582-F700 HydrophobicContact CD2-CE1 3.83Å; L582-F700 HydrophobicContact CD2-CZ 4.34Å; L582-F700 HydrophobicContact CG-CE1 4.14Å; L582-F700 HydrophobicContact CG-CZ 4.23Å; R583-F700 HydrophobicContact CB-CE2 3.98Å; R583-F700 HydrophobicContact CB-CZ 3.78Å; R583-F700 HydrophobicContact CG-CE2 4.32Å; V696-F700 HydrophobicContact CG1-CD2 3.77Å; V696-F700 HydrophobicContact CG1-CE2 3.34Å; V696-F700 HydrophobicContact CG1-CZ 4.42Å; V696-F700 WeakPolarHBondContact O-CD2 3.33Å; V696-F700 PolarHBondContact O-N 3.46Å; V696-F700 VanDerWaalsContact O-N 3.15Å; A698-F700 PolarHBondContact O-N 3.34Å; F700-I702 VanDerWaalsContact C-N 3.35Å; F700-M703 PolarHBondContact O-N 3.17Å; F700-R704 WeakPolarHBondContact O-CB 3.22Å; F700-R704 VanDerWaalsContact O-CG 3.26Å; F700-R704 WeakPolarHBondContact O-CG 3.32Å; F700-R704 PolarHBondContact O-N 3.39Å
701	R	90.3	Very high	80.6	Confident	104 Å²	104	65 Å²	65	39%	0.392	38%	0.38	S	S	.	.	H	α-helix	trans	-63.5	-41.8	176	-171.1	-178.4	65.2	164.8	-0	111.7	N697 A698 L699 R704 A705 S709	N697-R701 PolarHBondContact O-N 3.11Å; N697-R701 VanDerWaalsContact O-N 3.15Å; A698-R701 PolarHBondContact O-N 2.97Å; L699-R701 VanDerWaalsContact C-N 3.33Å; L699-R701 PolarHBondContact O-N 3.11Å; R701-R704 PolarHBondContact O-N 3.25Å; R701-A705 PolarHBondContact O-N 3.47Å; R701-S709 PolarHBondContact NH1-O 3.12Å; R701-S709 PolarHBondContact NH2-O 3.2Å
702	I	92.4	Very high	80.2	Confident	6 Å²	6	65.1 Å²	65.1	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-63.9	-46.3	176.5	-67.8	158.4	0	0	0	110.2	V683 A686 A690 A698 L699 F700 R704 G706 A708	V683-I702 HydrophobicContact CG1-CG2 4.31Å; V683-I702 HydrophobicContact CG2-CG2 4.49Å; A686-I702 HydrophobicContact CB-CD1 3.94Å; A686-I702 HydrophobicContact CB-CG1 4.42Å; A686-I702 HydrophobicContact CB-CG2 3.86Å; A690-I702 HydrophobicContact CB-CD1 4.14Å; A698-I702 WeakPolarHBondContact O-CD1 3.13Å; A698-I702 WeakPolarHBondContact O-CG1 3.41Å; A698-I702 PolarHBondContact O-N 2.56Å; L699-I702 PolarHBondContact O-N 3.08Å; F700-I702 VanDerWaalsContact C-N 3.35Å; I702-R704 VanDerWaalsContact C-N 3.28Å; I702-R704 PolarHBondContact O-N 3.45Å; I702-G706 WeakPolarHBondContact O-CA 3.34Å; I702-G706 PolarHBondContact O-N 3.13Å; I702-A708 HydrophobicContact CD1-CB 4.19Å; I702-A708 HydrophobicContact CG1-CB 4.11Å
703	M	91.5	Very high	80	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.02	37%	0.373	C	S	.	.	H	α-helix	trans	-59.9	-39	177.7	-70.9	-177	167.5	0	0	112.1	F579 L582 A667 I668 A671 R675 L699 F700	F579-M703 HydrophobicContact CE1-CB 3.97Å; F579-M703 HydrophobicContact CE1-SD 4.08Å; F579-M703 HydrophobicContact CZ-CB 4.13Å; L582-M703 HydrophobicContact CD2-CE 4.08Å; L582-M703 HydrophobicContact CD2-SD 3.84Å; A667-M703 HydrophobicContact CB-CE 4.41Å; I668-M703 HydrophobicContact CG1-CE 4.05Å; A671-M703 HydrophobicContact CB-CB 4.1Å; A671-M703 HydrophobicContact CB-CE 4.33Å; A671-M703 HydrophobicContact CB-CG 3.71Å; A671-M703 HydrophobicContact CB-SD 4.29Å; R675-M703 PolarHBondContact NH1-O 3.21Å; R675-M703 PolarHBondContact NH2-O 3.46Å; L699-M703 HydrophobicContact CD1-CE 3.94Å; L699-M703 HydrophobicContact CG-CE 4.19Å; L699-M703 HydrophobicContact CG-SD 4.45Å; L699-M703 WeakPolarHBondContact O-CG 3.46Å; L699-M703 PolarHBondContact O-N 3.18Å; F700-M703 PolarHBondContact O-N 3.17Å
704	R	91.9	Very high	79.6	Confident	85 Å²	85	60.4 Å²	60.4	32%	0.321	36%	0.361	S	S	.	.	H	α-helix	trans	-71.7	-58.3	179.2	-70.2	178.3	-173.3	-164.2	-1.9	113.6	E572 A573 D574 F579 R675 F700 R701 I702	E572-R704 WeakPolarHBondContact CA-O 3.22Å; A573-R704 PolarHBondContact N-O 3.49Å; A573-R704 WeakPolarHBondContact O-CA 3.33Å; A573-R704 VanDerWaalsContact O-CB 3.27Å; A573-R704 WeakPolarHBondContact O-CB 3.42Å; A573-R704 VanDerWaalsContact O-CG 3.29Å; A573-R704 WeakPolarHBondContact O-CG 3.48Å; D574-R704 IonicContact OD1-CZ 2.63Å; D574-R704 IonicContact OD1-NE 3.4Å; D574-R704 PolarHBondContact OD1-NE 3.13Å; D574-R704 IonicContact OD1-NH1 3.87Å; D574-R704 IonicContact OD1-NH2 2.72Å; D574-R704 PolarHBondContact OD1-NH2 2.68Å; F579-R704 HydrophobicContact CD2-CG 4.36Å; F579-R704 HydrophobicContact CE2-CG 3.52Å; F579-R704 HydrophobicContact CZ-CG 3.93Å; R675-R704 PolarHBondContact NH2-O 3.48Å; F700-R704 WeakPolarHBondContact O-CB 3.22Å; F700-R704 VanDerWaalsContact O-CG 3.26Å; F700-R704 WeakPolarHBondContact O-CG 3.32Å; F700-R704 PolarHBondContact O-N 3.39Å; R701-R704 PolarHBondContact O-N 3.25Å; I702-R704 VanDerWaalsContact C-N 3.28Å; I702-R704 PolarHBondContact O-N 3.45Å
705	A	86.4	Confident	79.3	Confident	46 Å²	46	57.6 Å²	57.6	38%	0.38	35%	0.349	S	S	.	.	H	α-helix	trans	-102.8	-9	-168.5	0	0	0	0	0	114.4	R701 T707	R701-A705 PolarHBondContact O-N 3.47Å; A705-T707 PolarHBondContact O-N 3.19Å
706	G	77.4	Confident	78.8	Confident	17 Å²	17	56.3 Å²	56.3	18%	0.175	35%	0.345	C	S	.	.	S	Bend	trans	74.1	-0.7	179.5	0	0	0	0	0	115.5	I702	I702-G706 WeakPolarHBondContact O-CA 3.34Å; I702-G706 PolarHBondContact O-N 3.13Å
707	T	71.4	Confident	78.2	Confident	83 Å²	83	57.4 Å²	57.4	51%	0.509	35%	0.352	S	S	.	.			trans	-123.3	131.9	-179.1	55	0	0	0	0	112.4	A705 S709	A705-T707 PolarHBondContact O-N 3.19Å; T707-S709 PolarHBondContact O-N 2.91Å
708	A	55.2	Low	77.5	Confident	65 Å²	65	52.7 Å²	52.7	54%	0.537	33%	0.33	S	S	.	.			trans	-87.2	75.7	165.3	0	0	0	0	0	108.5	I702 S710	I702-A708 HydrophobicContact CD1-CB 4.19Å; I702-A708 HydrophobicContact CG1-CB 4.11Å; A708-S710 PolarHBondContact O-N 3.01Å
709	S	44.3	Very low	76.5	Confident	64 Å²	64	55.6 Å²	55.6	45%	0.448	35%	0.345	S	S	.	.			trans	-77.8	119	172.2	39.7	0	0	0	0	110.3	R701 T707	R701-S709 PolarHBondContact NH1-O 3.12Å; R701-S709 PolarHBondContact NH2-O 3.2Å; T707-S709 PolarHBondContact O-N 2.91Å
710	S	36.1	Very low	75.3	Confident	183 Å²	183	60.4 Å²	60.4	100%	1.28	38%	0.375	S	S	*	.			trans	-4.8	0	168.9	58.8	0	0	0	0	117.9	A708	A708-S710 PolarHBondContact O-N 3.01Å

Retrieved 710 of 710 residues in 732 ms (Link to these results)

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