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Epithelial splicing regulatory protein 1

mRNA splicing factor that regulates the formation of epithelial cell-specific isoforms. Specifically regulates the expression of FGFR2-IIIb, an epithelial cell-specific isoform of FGFR2. Also regulates the splicing of CD44, CTNND1, ENAH, 3 transcripts that undergo changes in splicing during the epithelial-to-mesenchymal transition (EMT). Acts by directly binding specific sequences in mRNAs. Binds the GU-rich sequence motifs in the ISE/ISS-3, a cis-element regulatory region present in the mRNA of FGFR2. Regulates splicing and expression of genes involved in inner ear development, auditory hair cell differentiation, and cell fate specification in the cochlear epithelium.

AlphaFold DB , UniProt , Accession Z4YJI3, Species MOUSE (Mus musculus, Mouse), Gene Esrp1, Length 659 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	83.2	Confident	242 Å²	242	52 Å²	52	100%	1.192	30%	0.3	S	S	*	.				0	112.1	0	-68.9	178.6	82.8	0	0	107.1
2	T	56.4	Low	84.3	Confident	66 Å²	66	49.4 Å²	49.4	41%	0.405	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-69.4	134.2	167.9	27.7	0	0	0	0	108.4	S201	T2-S201 PolarHBondContact OG1-O 2.76Å
3	A	72.1	Confident	85.1	Confident	92 Å²	92	45.9 Å²	45.9	76%	0.76	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-63.2	147.6	174.5	0	0	0	0	0	109.7
4	S	82.4	Confident	85.7	Confident	46 Å²	46	42.9 Å²	42.9	32%	0.322	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-62.5	136.9	172.7	55.2	0	0	0	0	109.6	F200	S4-F200 WeakPolarHBondContact CA-O 3.45Å; S4-F200 WeakPolarHBondContact CB-O 3.48Å
5	P	90.5	Very high	86.3	Confident	12 Å²	12	40.1 Å²	40.1	8%	0.078	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-65.4	153.8	177.4	30.3	-35.1	0	0	0	110.5	L8 L40 S103 C105 F137 F200	P5-L8 HydrophobicContact CG-CD2 3.84Å; P5-L40 HydrophobicContact CG-CD1 4.15Å; P5-L40 VanDerWaalsContact O-CD1 3.25Å; P5-L40 WeakPolarHBondContact O-CD1 3.5Å; P5-S103 WeakPolarHBondContact CA-OG 3.33Å; P5-C105 HydrophobicContact CB-CB 4.25Å; P5-C105 HydrophobicContact CG-CB 4.18Å; P5-F137 HydrophobicContact CG-CE2 4.04Å; P5-F200 WeakPolarHBondContact CD-O 3.5Å
6	D	90.6	Very high	86.6	Confident	64 Å²	64	37.7 Å²	37.7	34%	0.342	22%	0.217	S	C	.	.	S	Bend	trans	-76.1	-33.6	174.4	-53.2	-64.4	0	0	0	110.8	L40 S103	D6-L40 WeakPolarHBondContact O-CB 3.22Å; D6-L40 PolarHBondContact O-N 3.47Å; D6-L40 VanDerWaalsContact O-N 3.09Å; D6-S103 WeakPolarHBondContact CB-O 3.37Å; D6-S103 PolarHBondContact N-O 3.45Å; D6-S103 PolarHBondContact N-OG 3.02Å; D6-S103 PolarHBondContact OD2-N 2.96Å; D6-S103 PolarHBondContact OD2-OG 3.24Å
7	Y	94.5	Very high	86.9	Confident	49 Å²	49	35.6 Å²	35.6	19%	0.192	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.2	-178	-59.3	-88.9	0	0	0	112	V37 V38 D39 L96 T102 S103 F104 C105	Y7-V37 HydrophobicContact CD1-CG1 3.97Å; Y7-V38 CarbonylContact C-O 3.52Å; Y7-V38 VanDerWaalsContact CA-O 3.29Å; Y7-V38 WeakPolarHBondContact CA-O 3.4Å; Y7-D39 HydrophobicContact CD1-CB 3.94Å; Y7-D39 HydrophobicContact CE1-CB 3.69Å; Y7-D39 VanDerWaalsContact CE1-CG 3.48Å; Y7-D39 WeakPolarHBondContact CE1-OD2 3.22Å; Y7-L96 HydrophobicContact CD1-CD2 3.43Å; Y7-L96 VanDerWaalsContact CD1-CD2 3.43Å; Y7-L96 HydrophobicContact CD2-CD2 3.66Å; Y7-L96 HydrophobicContact CE1-CD2 3.9Å; Y7-L96 HydrophobicContact CE2-CD2 4.11Å; Y7-L96 HydrophobicContact CG-CD2 3.32Å; Y7-T102 HydrophobicContact CE2-CG2 4.26Å; Y7-S103 PolarHBondContact N-O 3.35Å; Y7-S103 VanDerWaalsContact N-O 3.12Å; Y7-F104 WeakPolarHBondContact O-CA 3.29Å; Y7-C105 PolarHBondContact O-N 3.49Å; Y7-C105 VanDerWaalsContact O-N 3.14Å
8	L	96.9	Very high	87.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.3	161.9	-66.3	179.2	0	0	0	109.8	P5 V37 V38 L40 C105 C107 F137 I188 F200	P5-L8 HydrophobicContact CG-CD2 3.84Å; L8-V37 CarbonylContact O-C 3.59Å; L8-V38 HydrophobicContact CB-CB 4.36Å; L8-V38 PolarHBondContact N-O 3.22Å; L8-V38 PolarHBondContact O-N 3.28Å; L8-L40 HydrophobicContact CD1-CD1 4.33Å; L8-L40 HydrophobicContact CD1-CD2 3.99Å; L8-L40 HydrophobicContact CD2-CD1 4.49Å; L8-L40 HydrophobicContact CG-CD1 3.87Å; L8-L40 HydrophobicContact CG-CD2 4.05Å; L8-L40 HydrophobicContact CG-CG 4.25Å; L8-C105 CarbonylContact C-O 3.57Å; L8-C105 WeakPolarHBondContact CA-O 3.46Å; L8-C105 HydrophobicContact CD2-CB 4.13Å; L8-C107 HydrophobicContact CB-CB 4.37Å; L8-C107 HydrophobicContact CD1-CB 4.27Å; L8-F137 HydrophobicContact CD2-CD2 3.74Å; L8-F137 HydrophobicContact CD2-CE2 4.1Å; L8-I188 HydrophobicContact CD1-CD1 4.18Å; L8-I188 HydrophobicContact CD1-CG2 4.03Å; L8-F200 HydrophobicContact CD1-CD1 4.03Å; L8-F200 HydrophobicContact CD1-CD2 3.8Å; L8-F200 HydrophobicContact CD1-CE1 3.93Å; L8-F200 HydrophobicContact CD1-CE2 3.71Å; L8-F200 HydrophobicContact CD1-CG 3.96Å; L8-F200 HydrophobicContact CD1-CZ 3.78Å
9	V	97.3	Very high	87.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	104	167.7	-178.5	0	0	0	0	107.2	L11 W35 K36 V37 F88 V92 F104 C105 L106 C107	V9-L11 PolarHBondContact O-N 2.95Å; V9-W35 HydrophobicContact CG1-CB 4.09Å; V9-K36 CarbonylContact C-O 3.56Å; V9-K36 WeakPolarHBondContact CA-O 3.25Å; V9-V37 HydrophobicContact CG2-CG2 4.4Å; V9-F88 HydrophobicContact CG1-CE2 3.82Å; V9-F88 HydrophobicContact CG1-CZ 3.94Å; V9-V92 HydrophobicContact CG1-CG2 4.11Å; V9-V92 HydrophobicContact CG2-CG1 3.94Å; V9-V92 HydrophobicContact CG2-CG2 4.31Å; V9-F104 HydrophobicContact CB-CD2 4.4Å; V9-F104 HydrophobicContact CG2-CD2 3.54Å; V9-F104 HydrophobicContact CG2-CE2 4.03Å; V9-F104 HydrophobicContact CG2-CG 4.26Å; V9-C105 PolarHBondContact N-O 3.16Å; V9-L106 HydrophobicContact CB-CD2 3.9Å; V9-L106 HydrophobicContact CG1-CD2 4.18Å; V9-L106 CarbonylContact O-C 3.59Å; V9-L106 WeakPolarHBondContact O-CA 3.48Å; V9-C107 PolarHBondContact O-N 3.43Å
10	V	97.9	Very high	87.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	127	171.6	177	0	0	0	0	107.4	W35 K36 V38 C107 V181 M184 I188	V10-W35 CarbonylContact O-C 3.57Å; V10-W35 WeakPolarHBondContact O-CA 3.13Å; V10-W35 VanDerWaalsContact O-CB 3.32Å; V10-W35 WeakPolarHBondContact O-CB 3.38Å; V10-K36 HydrophobicContact CB-CB 4.49Å; V10-K36 PolarHBondContact N-O 2.69Å; V10-K36 PolarHBondContact O-N 2.96Å; V10-V38 HydrophobicContact CG2-CG2 3.77Å; V10-C107 WeakPolarHBondContact CA-O 3.26Å; V10-V181 HydrophobicContact CB-CG1 4.4Å; V10-V181 HydrophobicContact CG1-CG1 3.89Å; V10-M184 HydrophobicContact CG1-CB 3.68Å; V10-M184 HydrophobicContact CG1-CE 3.7Å; V10-M184 HydrophobicContact CG1-CG 4.38Å; V10-M184 HydrophobicContact CG1-SD 3.77Å; V10-I188 HydrophobicContact CG2-CD1 3.49Å; V10-I188 VanDerWaalsContact CG2-CD1 3.49Å
11	L	97.4	Very high	87.4	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.3	-178	-173.2	78.6	0	0	0	109.8	V9 L33 W35 F88 L106 C107 T108 I114 L118 F133	V9-L11 PolarHBondContact O-N 2.95Å; L11-L33 HydrophobicContact CD1-CD1 3.7Å; L11-L33 HydrophobicContact CD1-CD2 4.33Å; L11-L33 HydrophobicContact CD1-CG 4.02Å; L11-L33 HydrophobicContact CD2-CD1 4.48Å; L11-L33 HydrophobicContact CG-CD1 4.1Å; L11-W35 HydrophobicContact CD1-CB 3.98Å; L11-F88 HydrophobicContact CD1-CD2 4.23Å; L11-F88 HydrophobicContact CD1-CE2 3.81Å; L11-F88 HydrophobicContact CD1-CZ 4.45Å; L11-L106 HydrophobicContact CD2-CD1 4.23Å; L11-C107 PolarHBondContact N-O 3.45Å; L11-T108 HydrophobicContact CB-CG2 4.03Å; L11-T108 HydrophobicContact CD2-CG2 4.42Å; L11-I114 HydrophobicContact CD2-CD1 4.12Å; L11-L118 HydrophobicContact CD2-CD1 3.77Å; L11-F133 HydrophobicContact CD2-CD1 4.34Å; L11-F133 HydrophobicContact CD2-CE1 3.67Å
12	F	96.6	Very high	89.9	Confident	21 Å²	21	33.4 Å²	33.4	9%	0.092	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.1	177.5	-166.3	-92.3	0	0	0	109.9	I14 L34 H113 Q180 V181 M184	F12-I14 HydrophobicContact CD1-CG1 4.16Å; F12-I14 HydrophobicContact CE1-CD1 4.25Å; F12-I14 HydrophobicContact CE1-CG1 3.97Å; F12-L34 HydrophobicContact CD1-CD1 4.13Å; F12-L34 PolarHBondContact N-O 3.44Å; F12-L34 PolarHBondContact O-N 3.11Å; F12-H113 AromaticContact CD2-CE1 3.76Å; F12-H113 AromaticContact CD2-NE2 3.55Å; F12-H113 AromaticContact CE2-CE1 3.81Å; F12-H113 AromaticContact CE2-NE2 3.68Å; F12-H113 AromaticContact CG-NE2 3.93Å; F12-Q180 HydrophobicContact CD2-CB 4.18Å; F12-Q180 HydrophobicContact CE2-CB 3.98Å; F12-Q180 HydrophobicContact CE2-CG 4.18Å; F12-Q180 HydrophobicContact CZ-CB 4.17Å; F12-Q180 HydrophobicContact CZ-CG 4.04Å; F12-V181 HydrophobicContact CB-CG2 3.49Å; F12-V181 VanDerWaalsContact CB-CG2 3.49Å; F12-V181 HydrophobicContact CG-CG2 4.29Å; F12-M184 HydrophobicContact CD2-SD 4.34Å
13	G	94.9	Very high	91.6	Very high	4 Å²	4	30.7 Å²	30.7	4%	0.041	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.3	-172.2	0	0	0	0	0	111.1	L32 H113	G13-L32 WeakPolarHBondContact CA-O 3.43Å; G13-H113 PolarHBondContact N-CD2 3.34Å; G13-H113 PolarHBondContact N-NE2 3.24Å; G13-H113 PolarHBondContact O-NE2 2.94Å
14	I	93.5	Very high	92.6	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.3	-178.2	-45	-167.1	0	0	0	108.5	F12 L30 I31 L32 L34 T68 Y176	F12-I14 HydrophobicContact CD1-CG1 4.16Å; F12-I14 HydrophobicContact CE1-CD1 4.25Å; F12-I14 HydrophobicContact CE1-CG1 3.97Å; I14-L30 WeakPolarHBondContact O-CD1 3.39Å; I14-I31 HydrophobicContact CB-CG1 4.47Å; I14-I31 HydrophobicContact CG2-CD1 4.48Å; I14-I31 HydrophobicContact CG2-CG1 4.41Å; I14-I31 VanDerWaalsContact O-CG1 3.32Å; I14-I31 WeakPolarHBondContact O-CG1 3.26Å; I14-I31 PolarHBondContact O-N 3.38Å; I14-L32 HydrophobicContact CB-CB 4.15Å; I14-L32 HydrophobicContact CD1-CD2 3.86Å; I14-L32 HydrophobicContact CG1-CB 4.32Å; I14-L32 HydrophobicContact CG1-CD2 4.47Å; I14-L32 PolarHBondContact N-O 2.93Å; I14-L32 PolarHBondContact O-N 3.47Å; I14-L34 HydrophobicContact CD1-CD1 4.16Å; I14-L34 HydrophobicContact CG1-CD1 4.24Å; I14-T68 HydrophobicContact CG2-CG2 3.7Å; I14-Y176 HydrophobicContact CD1-CD1 3.56Å; I14-Y176 HydrophobicContact CD1-CE1 3.87Å; I14-Y176 HydrophobicContact CG2-CE1 4.27Å
15	T	94	Very high	93.1	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	164.2	178.2	75.2	0	0	0	0	111.2	G17 A18 L23 E29 C64 I117	T15-G17 PolarHBondContact O-N 3.48Å; T15-G17 VanDerWaalsContact O-N 3.11Å; T15-G17 PolarHBondContact OG1-N 3.26Å; T15-A18 PolarHBondContact OG1-O 2.89Å; T15-L23 HydrophobicContact CG2-CD1 3.92Å; T15-E29 CarbonylContact C-O 3.49Å; T15-E29 WeakPolarHBondContact CA-O 2.76Å; T15-E29 WeakPolarHBondContact CB-O 3.43Å; T15-C64 PolarHBondContact O-SG 3.23Å; T15-C64 VanDerWaalsContact O-SG 3.35Å; T15-I117 HydrophobicContact CG2-CD1 3.68Å; T15-I117 HydrophobicContact CG2-CG1 3.82Å; T15-I117 HydrophobicContact CG2-CG2 4.14Å
16	A	92.2	Very high	93.2	Very high	2 Å²	2	28 Å²	28	2%	0.017	17%	0.171	C	C	.	.	S	Bend	trans	-66.7	1.3	170.4	0	0	0	0	0	114.1	K28 E29 I31 L60 T61	A16-K28 HydrophobicContact CB-CB 4.21Å; A16-E29 PolarHBondContact N-O 2.95Å; A16-I31 HydrophobicContact CB-CG2 3.76Å; A16-L60 HydrophobicContact CB-CD2 3.74Å; A16-T61 PolarHBondContact O-N 3.41Å; A16-T61 PolarHBondContact O-OG1 2.81Å
17	G	91.4	Very high	93.3	Very high	2 Å²	2	27.7 Å²	27.7	2%	0.021	17%	0.167	C	C	.	.	S	Bend	trans	-135.6	-130.5	-170.3	0	0	0	0	0	112.8	T15 D26	T15-G17 PolarHBondContact O-N 3.48Å; T15-G17 VanDerWaalsContact O-N 3.11Å; T15-G17 PolarHBondContact OG1-N 3.26Å; G17-D26 WeakPolarHBondContact CA-OD2 3.3Å
18	A	90.9	Very high	93.2	Very high	22 Å²	22	28 Å²	28	18%	0.182	17%	0.169	C	C	.	.			trans	-64.5	144.2	-173.9	0	0	0	0	0	113.1	T15 K22 L23 D26	T15-A18 PolarHBondContact OG1-O 2.89Å; A18-K22 HydrophobicContact CB-CB 3.8Å; A18-K22 VanDerWaalsContact CB-O 3.23Å; A18-K22 WeakPolarHBondContact CB-O 3.22Å; A18-L23 WeakPolarHBondContact O-CD1 3.29Å; A18-D26 PolarHBondContact N-OD2 3.27Å
19	T	89.3	Confident	93.1	Very high	40 Å²	40	28.9 Å²	28.9	25%	0.245	17%	0.174	C	C	.	.			trans	-117.2	174.6	179.4	60.3	0	0	0	0	111.5	A21 K22 E67	T19-A21 PolarHBondContact O-N 2.83Å; T19-K22 PolarHBondContact O-N 3.09Å; T19-K22 VanDerWaalsContact O-N 3.17Å; T19-E67 PolarHBondContact OG1-OE2 3.2Å
20	G	88.1	Confident	93	Very high	46 Å²	46	29 Å²	29	47%	0.474	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	58	-129.9	175.2	0	0	0	0	0	113.9	K22 L23 L112	G20-K22 PolarHBondContact O-N 2.99Å; G20-K22 VanDerWaalsContact O-N 3.14Å; G20-L23 WeakPolarHBondContact O-CB 3.38Å; G20-L23 PolarHBondContact O-N 3Å; G20-L23 VanDerWaalsContact O-N 3.15Å; G20-L112 WeakPolarHBondContact O-CD1 3.41Å
21	A	89.4	Confident	92.8	Very high	81 Å²	81	29 Å²	29	67%	0.669	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-66.1	-13.8	-178.2	0	0	0	0	0	114.4	T19	T19-A21 PolarHBondContact O-N 2.83Å
22	K	91.5	Very high	92.7	Very high	149 Å²	149	29.6 Å²	29.6	65%	0.648	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-103.7	7.7	178.3	-66.8	-176.8	-178.6	175.3	0	112.8	A18 T19 G20 G24 S25	A18-K22 HydrophobicContact CB-CB 3.8Å; A18-K22 VanDerWaalsContact CB-O 3.23Å; A18-K22 WeakPolarHBondContact CB-O 3.22Å; T19-K22 PolarHBondContact O-N 3.09Å; T19-K22 VanDerWaalsContact O-N 3.17Å; G20-K22 PolarHBondContact O-N 2.99Å; G20-K22 VanDerWaalsContact O-N 3.14Å; K22-G24 PolarHBondContact O-N 2.93Å; K22-S25 VanDerWaalsContact O-CB 3.26Å; K22-S25 WeakPolarHBondContact O-CB 3.24Å; K22-S25 PolarHBondContact O-N 2.75Å; K22-S25 PolarHBondContact O-OG 3.22Å
23	L	93.3	Very high	92.7	Very high	9 Å²	9	28.7 Å²	28.7	5%	0.047	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	121	-176.8	-172.8	68.2	0	0	0	112	T15 A18 G20 S25 L112 I117	T15-L23 HydrophobicContact CG2-CD1 3.92Å; A18-L23 WeakPolarHBondContact O-CD1 3.29Å; G20-L23 WeakPolarHBondContact O-CB 3.38Å; G20-L23 PolarHBondContact O-N 3Å; G20-L23 VanDerWaalsContact O-N 3.15Å; L23-S25 VanDerWaalsContact C-N 3.33Å; L23-L112 HydrophobicContact CB-CB 4.22Å; L23-L112 HydrophobicContact CB-CD1 3.96Å; L23-L112 HydrophobicContact CD2-CB 4.08Å; L23-I117 HydrophobicContact CD1-CD1 3.65Å; L23-I117 HydrophobicContact CD2-CD1 3.49Å; L23-I117 VanDerWaalsContact CD2-CD1 3.49Å; L23-I117 HydrophobicContact CG-CD1 3.35Å; L23-I117 HydrophobicContact CG-CG1 4.11Å
24	G	91.8	Very high	92.7	Very high	6 Å²	6	28.5 Å²	28.5	6%	0.062	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	9.1	-178.9	0	0	0	0	0	115.6	K22 D26	K22-G24 PolarHBondContact O-N 2.93Å; G24-D26 VanDerWaalsContact C-N 3.34Å
25	S	93.8	Very high	92.9	Very high	34 Å²	34	28.7 Å²	28.7	24%	0.238	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-10.2	179	64.5	0	0	0	0	114.7	K22 L23 H288	K22-S25 VanDerWaalsContact O-CB 3.26Å; K22-S25 WeakPolarHBondContact O-CB 3.24Å; K22-S25 PolarHBondContact O-N 2.75Å; K22-S25 PolarHBondContact O-OG 3.22Å; L23-S25 VanDerWaalsContact C-N 3.33Å; S25-H288 PolarHBondContact O-NE2 2.92Å
26	D	92.6	Very high	93	Very high	55 Å²	55	29.4 Å²	29.4	29%	0.294	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	14.2	-171.8	61.1	-6.6	0	0	0	114.1	G17 A18 G24 K28	G17-D26 WeakPolarHBondContact CA-OD2 3.3Å; A18-D26 PolarHBondContact N-OD2 3.27Å; G24-D26 VanDerWaalsContact C-N 3.34Å; D26-K28 HydrophobicContact CB-CG 4.37Å; D26-K28 PolarHBondContact O-N 3.12Å; D26-K28 VanDerWaalsContact O-N 3.09Å; D26-K28 WeakPolarHBondContact OD1-CB 3.19Å; D26-K28 PolarHBondContact OD1-N 3.29Å; D26-K28 WeakPolarHBondContact OD2-CG 3.29Å
27	E	91.7	Very high	93.2	Very high	57 Å²	57	29.6 Å²	29.6	27%	0.266	18%	0.176	S	C	.	.			trans	59.3	12.1	-177.4	-56.4	-172.8	89.9	0	0	115.2	H288 H289	E27-H288 VanDerWaalsContact CD-CA 3.43Å; E27-H288 HydrophobicContact CG-CB 3.91Å; E27-H288 WeakPolarHBondContact CG-CD2 3.5Å; E27-H288 VanDerWaalsContact OE2-CA 3.24Å; E27-H288 WeakPolarHBondContact OE2-CA 3.43Å; E27-H289 PolarHBondContact OE1-N 2.81Å; E27-H289 IonicContact OE1-ND1 2.7Å; E27-H289 IonicContact OE2-CE1 3.5Å; E27-H289 IonicContact OE2-CG 2.92Å; E27-H289 PolarHBondContact OE2-N 3.33Å; E27-H289 IonicContact OE2-ND1 2.81Å; E27-H289 PolarHBondContact OE2-ND1 3.49Å
28	K	93.5	Very high	93.4	Very high	54 Å²	54	29.5 Å²	29.5	24%	0.235	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-75.8	143.2	178.5	-66.4	-64.7	-176.1	172.8	0	111.2	A16 D26 E59	A16-K28 HydrophobicContact CB-CB 4.21Å; D26-K28 HydrophobicContact CB-CG 4.37Å; D26-K28 PolarHBondContact O-N 3.12Å; D26-K28 VanDerWaalsContact O-N 3.09Å; D26-K28 WeakPolarHBondContact OD1-CB 3.19Å; D26-K28 PolarHBondContact OD1-N 3.29Å; D26-K28 WeakPolarHBondContact OD2-CG 3.29Å; K28-E59 VanDerWaalsContact NZ-CB 3.33Å; K28-E59 PolarHBondContact NZ-O 3.16Å; K28-E59 IonicContact NZ-OE2 3.45Å; K28-E59 PolarHBondContact NZ-OE2 3.3Å
29	E	94.3	Very high	93.6	Very high	20 Å²	20	29.5 Å²	29.5	9%	0.093	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-82.3	153.3	-169.1	-60.3	176.4	78.6	0	0	112	T15 A16 P55 D56 Q57 K125	T15-E29 CarbonylContact C-O 3.49Å; T15-E29 WeakPolarHBondContact CA-O 2.76Å; T15-E29 WeakPolarHBondContact CB-O 3.43Å; A16-E29 PolarHBondContact N-O 2.95Å; E29-P55 HydrophobicContact CB-CB 3.84Å; E29-P55 HydrophobicContact CG-CB 4.34Å; E29-P55 WeakPolarHBondContact OE2-CB 3.49Å; E29-D56 VanDerWaalsContact CD-N 3.27Å; E29-D56 PolarHBondContact OE1-N 2.91Å; E29-D56 PolarHBondContact OE2-N 3.35Å; E29-Q57 PolarHBondContact OE2-N 2.74Å; E29-K125 WeakPolarHBondContact OE1-CE 3.47Å; E29-K125 IonicContact OE1-NZ 3.28Å; E29-K125 PolarHBondContact OE1-NZ 2.66Å
30	L	95.1	Very high	93.7	Very high	1 Å²	1	29 Å²	29	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	131.5	171.1	-173.4	76.9	0	0	0	110.2	I14 L32 L33 V53 L81 I117 L118 E121	I14-L30 WeakPolarHBondContact O-CD1 3.39Å; L30-L32 WeakPolarHBondContact CD1-O 3.28Å; L30-L33 HydrophobicContact CD2-CB 4.27Å; L30-L33 HydrophobicContact CD2-CD1 4.26Å; L30-V53 HydrophobicContact CD2-CG2 4.09Å; L30-V53 HydrophobicContact CG-CG2 4.39Å; L30-V53 WeakPolarHBondContact O-CB 3.34Å; L30-L81 HydrophobicContact CD2-CD1 3.9Å; L30-I117 HydrophobicContact CB-CG2 4Å; L30-I117 HydrophobicContact CD1-CG2 4.02Å; L30-L118 HydrophobicContact CD2-CD2 4.1Å; L30-E121 WeakPolarHBondContact CB-OE2 3.47Å; L30-E121 PolarHBondContact N-OE2 2.95Å
31	I	94.7	Very high	93.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-21.5	179.7	59.6	169.2	0	0	0	113.4	I14 A16 L52 V53 P55 L60 I70 L75	I14-I31 HydrophobicContact CB-CG1 4.47Å; I14-I31 HydrophobicContact CG2-CD1 4.48Å; I14-I31 HydrophobicContact CG2-CG1 4.41Å; I14-I31 VanDerWaalsContact O-CG1 3.32Å; I14-I31 WeakPolarHBondContact O-CG1 3.26Å; I14-I31 PolarHBondContact O-N 3.38Å; A16-I31 HydrophobicContact CB-CG2 3.76Å; I31-L52 WeakPolarHBondContact O-CA 3.47Å; I31-V53 WeakPolarHBondContact CA-O 3.42Å; I31-V53 PolarHBondContact O-N 3.06Å; I31-P55 HydrophobicContact CG2-CG 4.41Å; I31-L60 HydrophobicContact CD1-CD2 3.88Å; I31-L60 HydrophobicContact CG2-CD2 4.23Å; I31-I70 HydrophobicContact CD1-CD1 4.18Å; I31-L75 HydrophobicContact CB-CD1 4.46Å; I31-L75 HydrophobicContact CB-CD2 3.88Å; I31-L75 HydrophobicContact CG2-CD1 4.34Å; I31-L75 HydrophobicContact CG2-CD2 4.34Å
32	L	93.9	Very high	93.9	Very high	14 Å²	14	31.7 Å²	31.7	7%	0.073	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	132.1	177.7	179.5	64	0	0	0	109.3	G13 I14 L30 L34 E50 L52 I70	G13-L32 WeakPolarHBondContact CA-O 3.43Å; I14-L32 HydrophobicContact CB-CB 4.15Å; I14-L32 HydrophobicContact CD1-CD2 3.86Å; I14-L32 HydrophobicContact CG1-CB 4.32Å; I14-L32 HydrophobicContact CG1-CD2 4.47Å; I14-L32 PolarHBondContact N-O 2.93Å; I14-L32 PolarHBondContact O-N 3.47Å; L30-L32 WeakPolarHBondContact CD1-O 3.28Å; L32-L34 HydrophobicContact CD2-CD1 3.76Å; L32-L34 HydrophobicContact CD2-CG 4.29Å; L32-L34 HydrophobicContact CG-CD1 3.73Å; L32-L34 HydrophobicContact CG-CG 4.17Å; L32-E50 HydrophobicContact CD1-CB 4.21Å; L32-L52 HydrophobicContact CD1-CD2 3.97Å; L32-L52 HydrophobicContact CD1-CG 4.47Å; L32-I70 HydrophobicContact CB-CD1 4.16Å; L32-I70 HydrophobicContact CD2-CD1 4.07Å
33	L	96.2	Very high	94	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.6	173.2	-172.1	69.1	0	0	0	108.8	L11 L30 W35 E50 V51 L85	L11-L33 HydrophobicContact CD1-CD1 3.7Å; L11-L33 HydrophobicContact CD1-CD2 4.33Å; L11-L33 HydrophobicContact CD1-CG 4.02Å; L11-L33 HydrophobicContact CD2-CD1 4.48Å; L11-L33 HydrophobicContact CG-CD1 4.1Å; L30-L33 HydrophobicContact CD2-CB 4.27Å; L30-L33 HydrophobicContact CD2-CD1 4.26Å; L33-W35 HydrophobicContact CG-CE3 4.46Å; L33-E50 CarbonylContact O-C 3.54Å; L33-E50 VanDerWaalsContact O-CA 3.32Å; L33-E50 WeakPolarHBondContact O-CA 3.46Å; L33-V51 HydrophobicContact CB-CG1 3.91Å; L33-V51 PolarHBondContact N-O 3.25Å; L33-V51 PolarHBondContact O-N 3.29Å; L33-L85 HydrophobicContact CD2-CD2 4.43Å
34	L	96.6	Very high	94	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.3	176.6	-55.1	100.5	0	0	0	110	F12 I14 L32 L48 H49 E50 A178 V181	F12-L34 HydrophobicContact CD1-CD1 4.13Å; F12-L34 PolarHBondContact N-O 3.44Å; F12-L34 PolarHBondContact O-N 3.11Å; I14-L34 HydrophobicContact CD1-CD1 4.16Å; I14-L34 HydrophobicContact CG1-CD1 4.24Å; L32-L34 HydrophobicContact CD2-CD1 3.76Å; L32-L34 HydrophobicContact CD2-CG 4.29Å; L32-L34 HydrophobicContact CG-CD1 3.73Å; L32-L34 HydrophobicContact CG-CG 4.17Å; L34-L48 HydrophobicContact CB-CD1 4.49Å; L34-L48 HydrophobicContact CD2-CD1 4.42Å; L34-H49 VanDerWaalsContact CA-O 3.29Å; L34-H49 WeakPolarHBondContact CA-O 3.35Å; L34-E50 HydrophobicContact CD2-CB 4.24Å; L34-E50 HydrophobicContact CG-CB 4.2Å; L34-A178 HydrophobicContact CD2-CB 4.27Å; L34-V181 HydrophobicContact CB-CG2 3.72Å
35	W	97.2	Very high	94	Very high	8 Å²	8	36.7 Å²	36.7	3%	0.03	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	158.5	174.2	68	98.3	0	0	0	113.4	V9 V10 L11 L33 H49 V51 F88 S91	V9-W35 HydrophobicContact CG1-CB 4.09Å; V10-W35 CarbonylContact O-C 3.57Å; V10-W35 WeakPolarHBondContact O-CA 3.13Å; V10-W35 VanDerWaalsContact O-CB 3.32Å; V10-W35 WeakPolarHBondContact O-CB 3.38Å; L11-W35 HydrophobicContact CD1-CB 3.98Å; L33-W35 HydrophobicContact CG-CE3 4.46Å; W35-H49 AromaticContact CD1-CD2 3.86Å; W35-H49 HydrophobicContact CD2-CB 3.58Å; W35-H49 AromaticContact CE2-CG 3.75Å; W35-H49 HydrophobicContact CE3-CB 4.08Å; W35-H49 HydrophobicContact CG-CB 4.1Å; W35-H49 HydrophobicContact CH2-CB 3.89Å; W35-H49 HydrophobicContact CZ2-CB 3.38Å; W35-H49 AromaticContact CZ2-CG 3.98Å; W35-H49 HydrophobicContact CZ3-CB 4.2Å; W35-H49 PolarHBondContact N-O 3.43Å; W35-H49 AromaticContact NE1-CD2 3.51Å; W35-H49 AromaticContact NE1-CG 3.52Å; W35-H49 PolarHBondContact O-N 2.7Å; W35-V51 HydrophobicContact CH2-CB 4.22Å; W35-V51 HydrophobicContact CH2-CG1 4.17Å; W35-V51 HydrophobicContact CZ3-CB 4.08Å; W35-V51 HydrophobicContact CZ3-CG1 3.72Å; W35-F88 HydrophobicContact CB-CD2 4.14Å; W35-F88 HydrophobicContact CB-CE2 3.83Å; W35-F88 AromaticContact CD1-CD2 3.98Å; W35-F88 AromaticContact CD1-CE2 3.92Å; W35-F88 AromaticContact CD2-CD2 3.51Å; W35-F88 HydrophobicContact CD2-CD2 3.51Å; W35-F88 HydrophobicContact CD2-CE2 4.08Å; W35-F88 AromaticContact CE2-CD2 3.82Å; W35-F88 AromaticContact CE3-CD2 3.93Å; W35-F88 HydrophobicContact CE3-CD2 3.93Å; W35-F88 AromaticContact CG-CD2 3.62Å; W35-F88 HydrophobicContact CG-CD2 3.62Å; W35-F88 AromaticContact CG-CE2 3.66Å; W35-F88 HydrophobicContact CG-CE2 3.66Å; W35-F88 HydrophobicContact CH2-CB 4.5Å; W35-F88 HydrophobicContact CZ2-CB 4.47Å; W35-F88 HydrophobicContact CZ2-CD2 4.48Å; W35-S91 PolarHBondContact NE1-OG 3.47Å
36	K	95.8	Very high	93.9	Very high	14 Å²	14	36.5 Å²	36.5	6%	0.061	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	137.1	178.2	-167.3	167.2	-164.7	-178.9	0	110.8	V9 V10 V45 G46 V181 E182	V9-K36 CarbonylContact C-O 3.56Å; V9-K36 WeakPolarHBondContact CA-O 3.25Å; V10-K36 HydrophobicContact CB-CB 4.49Å; V10-K36 PolarHBondContact N-O 2.69Å; V10-K36 PolarHBondContact O-N 2.96Å; K36-V45 HydrophobicContact CD-CG1 3.39Å; K36-V45 HydrophobicContact CG-CG1 3.73Å; K36-G46 WeakPolarHBondContact CE-O 3.39Å; K36-V181 HydrophobicContact CB-CG1 3.5Å; K36-V181 VanDerWaalsContact CB-CG1 3.5Å; K36-V181 HydrophobicContact CD-CG1 4.3Å; K36-E182 IonicContact NZ-OE1 2.92Å; K36-E182 PolarHBondContact NZ-OE1 3.45Å; K36-E182 IonicContact NZ-OE2 3.98Å; K36-E182 PolarHBondContact NZ-OE2 3.44Å
37	V	96.3	Very high	93.9	Very high	6 Å²	6	40.4 Å²	40.4	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	136.5	177.3	179.9	0	0	0	0	109.9	Y7 L8 V9 G46 E95 L96	Y7-V37 HydrophobicContact CD1-CG1 3.97Å; L8-V37 CarbonylContact O-C 3.59Å; V9-V37 HydrophobicContact CG2-CG2 4.4Å; V37-G46 PolarHBondContact O-N 2.84Å; V37-E95 HydrophobicContact CB-CG 4.42Å; V37-E95 HydrophobicContact CG2-CB 4.42Å; V37-E95 HydrophobicContact CG2-CG 4.1Å; V37-E95 WeakPolarHBondContact CG2-OE2 3.38Å; V37-L96 HydrophobicContact CG1-CD2 3.5Å; V37-L96 HydrophobicContact CG1-CG 4.41Å
38	V	96.3	Very high	94	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.2	173.4	-171.7	0	0	0	0	108.4	Y7 L8 V10 L40 V45 I188 L189	Y7-V38 CarbonylContact C-O 3.52Å; Y7-V38 VanDerWaalsContact CA-O 3.29Å; Y7-V38 WeakPolarHBondContact CA-O 3.4Å; L8-V38 HydrophobicContact CB-CB 4.36Å; L8-V38 PolarHBondContact N-O 3.22Å; L8-V38 PolarHBondContact O-N 3.28Å; V10-V38 HydrophobicContact CG2-CG2 3.77Å; V38-L40 HydrophobicContact CG1-CD2 4.26Å; V38-L40 PolarHBondContact O-N 2.96Å; V38-V45 HydrophobicContact CG2-CG1 4.18Å; V38-I188 HydrophobicContact CG1-CG2 3.89Å; V38-I188 HydrophobicContact CG2-CD1 4.38Å; V38-L189 HydrophobicContact CG1-CD2 3.97Å
39	D	93.8	Very high	94.1	Very high	23 Å²	23	39.2 Å²	39.2	12%	0.123	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	108.7	173.5	-173.7	-33.6	0	0	0	109.2	Y7 A41 N42 K43 K44	Y7-D39 HydrophobicContact CD1-CB 3.94Å; Y7-D39 HydrophobicContact CE1-CB 3.69Å; Y7-D39 VanDerWaalsContact CE1-CG 3.48Å; Y7-D39 WeakPolarHBondContact CE1-OD2 3.22Å; D39-A41 VanDerWaalsContact C-N 3.35Å; D39-A41 PolarHBondContact OD1-N 3.48Å; D39-N42 HydrophobicContact CB-CB 4.43Å; D39-N42 PolarHBondContact OD1-N 3Å; D39-N42 PolarHBondContact OD1-ND2 3.5Å; D39-N42 PolarHBondContact OD2-ND2 3.12Å; D39-K43 VanDerWaalsContact O-CA 3.26Å; D39-K43 WeakPolarHBondContact O-CA 3.34Å; D39-K43 PolarHBondContact O-N 3.14Å; D39-K44 HydrophobicContact CB-CB 4.46Å; D39-K44 PolarHBondContact N-O 2.77Å; D39-K44 PolarHBondContact O-N 2.75Å
40	L	93	Very high	94.1	Very high	29 Å²	29	41.8 Å²	41.8	15%	0.152	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-27.8	-176.3	-59.8	-179.7	0	0	0	112.1	P5 D6 L8 V38 I188 I192 F200	P5-L40 HydrophobicContact CG-CD1 4.15Å; P5-L40 VanDerWaalsContact O-CD1 3.25Å; P5-L40 WeakPolarHBondContact O-CD1 3.5Å; D6-L40 WeakPolarHBondContact O-CB 3.22Å; D6-L40 PolarHBondContact O-N 3.47Å; D6-L40 VanDerWaalsContact O-N 3.09Å; L8-L40 HydrophobicContact CD1-CD1 4.33Å; L8-L40 HydrophobicContact CD1-CD2 3.99Å; L8-L40 HydrophobicContact CD2-CD1 4.49Å; L8-L40 HydrophobicContact CG-CD1 3.87Å; L8-L40 HydrophobicContact CG-CD2 4.05Å; L8-L40 HydrophobicContact CG-CG 4.25Å; V38-L40 HydrophobicContact CG1-CD2 4.26Å; V38-L40 PolarHBondContact O-N 2.96Å; L40-I188 HydrophobicContact CD2-CG2 3.97Å; L40-I192 HydrophobicContact CD2-CD1 4.05Å; L40-I192 HydrophobicContact CD2-CG2 4.23Å; L40-F200 HydrophobicContact CD1-CD2 4.31Å; L40-F200 HydrophobicContact CD2-CE2 4.49Å
41	A	89.1	Confident	94.1	Very high	80 Å²	80	42.1 Å²	42.1	66%	0.661	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-45.6	-179.6	0	0	0	0	0	111.3	D39	D39-A41 VanDerWaalsContact C-N 3.35Å; D39-A41 PolarHBondContact OD1-N 3.48Å
42	N	91.3	Very high	94.1	Very high	104 Å²	104	44.6 Å²	44.6	56%	0.556	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-5.5	-177.9	-63.8	-60.6	0	0	0	113.6	D39 K44	D39-N42 HydrophobicContact CB-CB 4.43Å; D39-N42 PolarHBondContact OD1-N 3Å; D39-N42 PolarHBondContact OD1-ND2 3.5Å; D39-N42 PolarHBondContact OD2-ND2 3.12Å; N42-K44 HydrophobicContact CB-CD 4.42Å; N42-K44 HydrophobicContact CB-CG 4.4Å; N42-K44 PolarHBondContact O-N 2.81Å
43	K	93.5	Very high	94.2	Very high	89 Å²	89	43.9 Å²	43.9	39%	0.387	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	49	-178.5	-55.4	-177.6	172.9	-168.9	0	112.1	D39 L189 I192 S193	D39-K43 VanDerWaalsContact O-CA 3.26Å; D39-K43 WeakPolarHBondContact O-CA 3.34Å; D39-K43 PolarHBondContact O-N 3.14Å; K43-L189 VanDerWaalsContact C-CD2 3.43Å; K43-L189 HydrophobicContact CB-CD2 4.21Å; K43-I192 HydrophobicContact CB-CD1 4.38Å; K43-I192 HydrophobicContact CG-CD1 3.92Å; K43-I192 HydrophobicContact CG-CG1 4.3Å; K43-I192 PolarHBondContact NZ-O 2.93Å; K43-S193 PolarHBondContact NZ-OG 3.49Å
44	K	93.4	Very high	94.1	Very high	141 Å²	141	48.1 Å²	48.1	61%	0.613	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.6	-179.1	-70.8	-178.2	-177.8	178.4	0	111.1	D39 N42	D39-K44 HydrophobicContact CB-CB 4.46Å; D39-K44 PolarHBondContact N-O 2.77Å; D39-K44 PolarHBondContact O-N 2.75Å; N42-K44 HydrophobicContact CB-CD 4.42Å; N42-K44 HydrophobicContact CB-CG 4.4Å; N42-K44 PolarHBondContact O-N 2.81Å
45	V	92.8	Very high	93.9	Very high	39 Å²	39	48.3 Å²	48.3	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	134	171.7	-151.3	0	0	0	0	108.5	K36 V38 L189	K36-V45 HydrophobicContact CD-CG1 3.39Å; K36-V45 HydrophobicContact CG-CG1 3.73Å; V38-V45 HydrophobicContact CG2-CG1 4.18Å; V45-L189 HydrophobicContact CG2-CD1 3.32Å; V45-L189 HydrophobicContact CG2-CD2 4.36Å; V45-L189 HydrophobicContact CG2-CG 3.76Å
46	G	91.3	Very high	93.5	Very high	29 Å²	29	52.9 Å²	52.9	30%	0.299	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-153.3	-178.7	0	0	0	0	0	113.5	K36 V37 E95	K36-G46 WeakPolarHBondContact CE-O 3.39Å; V37-G46 PolarHBondContact O-N 2.84Å; G46-E95 WeakPolarHBondContact CA-OE1 3.32Å
47	Q	92.6	Very high	93	Very high	138 Å²	138	58.3 Å²	58.3	65%	0.645	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	144	176.6	-174.1	175.1	2.7	0	0	111	H49 E95	Q47-H49 PolarHBondContact O-CD2 3.42Å; Q47-E95 PolarHBondContact N-OE1 3.06Å
48	L	94.4	Very high	92.2	Very high	46 Å²	46	62 Å²	62	24%	0.241	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.3	168.1	178.7	68.4	0	0	0	109.8	L34 A178 V181	L34-L48 HydrophobicContact CB-CD1 4.49Å; L34-L48 HydrophobicContact CD2-CD1 4.42Å; L48-A178 HydrophobicContact CD2-CB 3.59Å; L48-V181 HydrophobicContact CD1-CB 3.78Å; L48-V181 HydrophobicContact CD1-CG1 3.54Å; L48-V181 HydrophobicContact CD1-CG2 4.31Å
49	H	95.3	Very high	91.5	Very high	39 Å²	39	67.3 Å²	67.3	18%	0.181	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	149.7	173.4	-59.3	-92.5	0	0	0	110.3	L34 W35 Q47 S91 E95	L34-H49 VanDerWaalsContact CA-O 3.29Å; L34-H49 WeakPolarHBondContact CA-O 3.35Å; W35-H49 AromaticContact CD1-CD2 3.86Å; W35-H49 HydrophobicContact CD2-CB 3.58Å; W35-H49 AromaticContact CE2-CG 3.75Å; W35-H49 HydrophobicContact CE3-CB 4.08Å; W35-H49 HydrophobicContact CG-CB 4.1Å; W35-H49 HydrophobicContact CH2-CB 3.89Å; W35-H49 HydrophobicContact CZ2-CB 3.38Å; W35-H49 AromaticContact CZ2-CG 3.98Å; W35-H49 HydrophobicContact CZ3-CB 4.2Å; W35-H49 PolarHBondContact N-O 3.43Å; W35-H49 AromaticContact NE1-CD2 3.51Å; W35-H49 AromaticContact NE1-CG 3.52Å; W35-H49 PolarHBondContact O-N 2.7Å; Q47-H49 PolarHBondContact O-CD2 3.42Å; H49-S91 PolarHBondContact CE1-OG 2.76Å; H49-S91 PolarHBondContact ND1-OG 3.39Å; H49-S91 PolarHBondContact NE2-OG 3.01Å; H49-E95 IonicContact CD2-OE2 2.72Å; H49-E95 IonicContact CE1-OE2 3.3Å; H49-E95 IonicContact NE2-OE2 2.58Å; H49-E95 PolarHBondContact NE2-OE2 2.95Å
50	E	94.4	Very high	91	Very high	74 Å²	74	67.2 Å²	67.2	35%	0.346	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	148.8	177.7	65.4	-177.7	-163.5	0	0	110.5	L32 L33 L34 R175	L32-E50 HydrophobicContact CD1-CB 4.21Å; L33-E50 CarbonylContact O-C 3.54Å; L33-E50 VanDerWaalsContact O-CA 3.32Å; L33-E50 WeakPolarHBondContact O-CA 3.46Å; L34-E50 HydrophobicContact CD2-CB 4.24Å; L34-E50 HydrophobicContact CG-CB 4.2Å; E50-R175 IonicContact OE1-CZ 2.67Å; E50-R175 IonicContact OE1-NH1 2.84Å; E50-R175 PolarHBondContact OE1-NH1 3.2Å; E50-R175 IonicContact OE1-NH2 3.92Å; E50-R175 PolarHBondContact OE1-NH2 2.95Å; E50-R175 IonicContact OE2-CZ 3.44Å; E50-R175 VanDerWaalsContact OE2-CZ 3.28Å; E50-R175 IonicContact OE2-NE 2.72Å; E50-R175 IonicContact OE2-NH1 2.62Å; E50-R175 PolarHBondContact OE2-NH1 3.42Å; E50-R175 IonicContact OE2-NH2 3.05Å; E50-R175 PolarHBondContact OE2-NH2 3.01Å
51	V	95.2	Very high	90.5	Very high	9 Å²	9	67.9 Å²	67.9	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	127.2	172.3	69.4	0	0	0	0	109.8	L33 W35 P79 A84 Q87	L33-V51 HydrophobicContact CB-CG1 3.91Å; L33-V51 PolarHBondContact N-O 3.25Å; L33-V51 PolarHBondContact O-N 3.29Å; W35-V51 HydrophobicContact CH2-CB 4.22Å; W35-V51 HydrophobicContact CH2-CG1 4.17Å; W35-V51 HydrophobicContact CZ3-CB 4.08Å; W35-V51 HydrophobicContact CZ3-CG1 3.72Å; V51-P79 HydrophobicContact CG2-CG 3.82Å; V51-A84 HydrophobicContact CG1-CB 3.83Å; V51-A84 HydrophobicContact CG2-CB 4.1Å; V51-Q87 VanDerWaalsContact CG2-OE1 3.22Å
52	L	94.4	Very high	90.2	Very high	51 Å²	51	69.5 Å²	69.5	27%	0.267	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	144.5	169.4	-70.1	170.8	0	0	0	109.5	I31 L32 I70 N74 L75 A78 P79	I31-L52 WeakPolarHBondContact O-CA 3.47Å; L32-L52 HydrophobicContact CD1-CD2 3.97Å; L32-L52 HydrophobicContact CD1-CG 4.47Å; L52-I70 HydrophobicContact CD2-CD1 4.22Å; L52-I70 HydrophobicContact CD2-CG2 4.14Å; L52-N74 HydrophobicContact CD1-CB 4Å; L52-L75 HydrophobicContact CD2-CD2 4.04Å; L52-A78 HydrophobicContact CB-CB 3.65Å; L52-P79 WeakPolarHBondContact O-CD 3.21Å; L52-P79 WeakPolarHBondContact O-CG 3.34Å
53	V	95.1	Very high	89.6	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.347	C	S	.	.			trans	-122.5	125.7	179.8	-175.1	0	0	0	0	108.4	L30 I31 P55 L81 A84	L30-V53 HydrophobicContact CD2-CG2 4.09Å; L30-V53 HydrophobicContact CG-CG2 4.39Å; L30-V53 WeakPolarHBondContact O-CB 3.34Å; I31-V53 WeakPolarHBondContact CA-O 3.42Å; I31-V53 PolarHBondContact O-N 3.06Å; V53-P55 WeakPolarHBondContact O-CD 3.28Å; V53-L81 HydrophobicContact CG1-CB 4.1Å; V53-L81 HydrophobicContact CG1-CD1 4.23Å; V53-A84 HydrophobicContact CG2-CB 3.74Å
54	R	94.5	Very high	89.1	Confident	91 Å²	91	65.9 Å²	65.9	34%	0.343	33%	0.328	S	S	.	.			trans	-77.8	120	178.3	-174.7	177.5	73.2	176.5	1.7	110.3	L75 S76 A78 P79 Q80	R54-L75 WeakPolarHBondContact CB-O 3.48Å; R54-L75 WeakPolarHBondContact CG-O 3.22Å; R54-S76 WeakPolarHBondContact CD-O 3.48Å; R54-A78 HydrophobicContact CB-CB 4.18Å; R54-A78 WeakPolarHBondContact CB-O 3.47Å; R54-P79 PolarHBondContact N-O 2.87Å; R54-Q80 VanDerWaalsContact NH2-NE2 3.16Å
55	P	92.2	Very high	88.6	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.032	32%	0.317	C	S	.	.			trans	-73.3	152.7	172.3	33.4	-36.4	0	0	0	110.8	E29 I31 V53 Q57 L58	E29-P55 HydrophobicContact CB-CB 3.84Å; E29-P55 HydrophobicContact CG-CB 4.34Å; E29-P55 WeakPolarHBondContact OE2-CB 3.49Å; I31-P55 HydrophobicContact CG2-CG 4.41Å; V53-P55 WeakPolarHBondContact O-CD 3.28Å; P55-Q57 VanDerWaalsContact C-N 3.33Å; P55-L58 HydrophobicContact CG-CG 3.99Å
56	D	89.9	Confident	87.9	Confident	103 Å²	103	68.5 Å²	68.5	55%	0.551	34%	0.339	S	S	*	.	S	Bend	trans	-71.6	-33.5	173.6	-69.3	-21.3	0	0	0	110.7	E29 K125	E29-D56 VanDerWaalsContact CD-N 3.27Å; E29-D56 PolarHBondContact OE1-N 2.91Å; E29-D56 PolarHBondContact OE2-N 3.35Å; D56-K125 VanDerWaalsContact OD2-CE 3.31Å; D56-K125 WeakPolarHBondContact OD2-CE 3.43Å
57	Q	84.6	Confident	87.3	Confident	128 Å²	128	71 Å²	71	60%	0.598	34%	0.343	S	S	*	.	S	Bend	trans	-115.8	107.3	172.5	-69.1	-178.3	-41	0	0	109.9	E29 P55 E59	E29-Q57 PolarHBondContact OE2-N 2.74Å; P55-Q57 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 3.3Å
58	L	79.3	Confident	86.7	Confident	83 Å²	83	65 Å²	65	44%	0.435	32%	0.316	S	S	.	.			trans	-77.3	68.9	-177.4	-127.8	150.4	0	0	0	110.8	P55 A72 L75	P55-L58 HydrophobicContact CG-CG 3.99Å; L58-A72 HydrophobicContact CD2-CB 3.99Å; L58-L75 HydrophobicContact CD2-CB 4.5Å
59	E	80.6	Confident	86	Confident	113 Å²	113	70.9 Å²	70.9	53%	0.528	34%	0.34	S	S	.	.			trans	-123.9	88.1	178.6	-71.1	-173.6	177.8	0	0	110.6	K28 Q57	K28-E59 VanDerWaalsContact NZ-CB 3.33Å; K28-E59 PolarHBondContact NZ-O 3.16Å; K28-E59 IonicContact NZ-OE2 3.45Å; K28-E59 PolarHBondContact NZ-OE2 3.3Å; Q57-E59 PolarHBondContact O-N 3.3Å
60	L	83.1	Confident	85.2	Confident	20 Å²	20	70.2 Å²	70.2	11%	0.105	34%	0.337	C	S	.	.			trans	-78.6	131.5	171.9	-61.2	170.7	0	0	0	110.1	A16 I31 K65 L75	A16-L60 HydrophobicContact CB-CD2 3.74Å; I31-L60 HydrophobicContact CD1-CD2 3.88Å; I31-L60 HydrophobicContact CG2-CD2 4.23Å; L60-K65 HydrophobicContact CB-CD 4.42Å; L60-K65 HydrophobicContact CB-CG 3.88Å; L60-K65 HydrophobicContact CD1-CG 4.14Å; L60-L75 HydrophobicContact CD1-CD1 3.93Å; L60-L75 HydrophobicContact CD2-CD1 3.92Å; L60-L75 HydrophobicContact CG-CD1 4.32Å
61	T	83.8	Confident	84.3	Confident	43 Å²	43	71.8 Å²	71.8	26%	0.264	35%	0.348	S	S	.	.			trans	-66.3	152.8	167.9	58.9	0	0	0	0	110.4	A16 D63 C64 K65	A16-T61 PolarHBondContact O-N 3.41Å; A16-T61 PolarHBondContact O-OG1 2.81Å; T61-D63 VanDerWaalsContact C-N 3.32Å; T61-D63 PolarHBondContact O-N 2.67Å; T61-C64 WeakPolarHBondContact O-CB 3.5Å; T61-C64 PolarHBondContact O-N 2.91Å; T61-C64 WeakPolarHBondContact OG1-CB 3.36Å; T61-C64 PolarHBondContact OG1-N 3.35Å; T61-K65 PolarHBondContact O-N 2.87Å; T61-K65 VanDerWaalsContact O-N 3.11Å
62	E	81.9	Confident	83.5	Confident	114 Å²	114	73.8 Å²	73.8	53%	0.533	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-43.1	178.7	-62.1	-53.9	122.8	0	0	111.2	C64 K65 E66	E62-C64 VanDerWaalsContact C-N 3.27Å; E62-C64 PolarHBondContact O-N 2.95Å; E62-K65 WeakPolarHBondContact O-CB 3.34Å; E62-K65 PolarHBondContact O-N 3.33Å; E62-K65 IonicContact OE1-NZ 3.31Å; E62-K65 PolarHBondContact OE1-NZ 3.32Å; E62-K65 IonicContact OE2-NZ 3.92Å; E62-E66 PolarHBondContact O-N 2.96Å
63	D	79.3	Confident	82.8	Confident	116 Å²	116	79 Å²	79	62%	0.62	39%	0.389	S	S	*	.	H	α-helix	trans	-53.8	-43.4	174.1	-56.1	-11	0	0	0	111.9	T61 E66 E67	T61-D63 VanDerWaalsContact C-N 3.32Å; T61-D63 PolarHBondContact O-N 2.67Å; D63-E66 PolarHBondContact O-N 3.39Å; D63-E67 WeakPolarHBondContact O-CG 3.38Å; D63-E67 PolarHBondContact O-N 3.15Å
64	C	82.9	Confident	82.2	Confident	1 Å²	1	83 Å²	83	1%	0.007	41%	0.409	C	S	.	.	H	α-helix	trans	-65.2	-40.6	177.7	177.2	0	0	0	0	111.7	T15 T61 E62 T68	T15-C64 PolarHBondContact O-SG 3.23Å; T15-C64 VanDerWaalsContact O-SG 3.35Å; T61-C64 WeakPolarHBondContact O-CB 3.5Å; T61-C64 PolarHBondContact O-N 2.91Å; T61-C64 WeakPolarHBondContact OG1-CB 3.36Å; T61-C64 PolarHBondContact OG1-N 3.35Å; E62-C64 VanDerWaalsContact C-N 3.27Å; E62-C64 PolarHBondContact O-N 2.95Å; C64-T68 VanDerWaalsContact O-CB 3.3Å; C64-T68 WeakPolarHBondContact O-CB 3.39Å; C64-T68 VanDerWaalsContact O-CG2 3.28Å; C64-T68 WeakPolarHBondContact O-CG2 3.26Å; C64-T68 PolarHBondContact O-N 3.24Å; C64-T68 PolarHBondContact O-OG1 3.48Å
65	K	82.7	Confident	81.8	Confident	86 Å²	86	78.6 Å²	78.6	37%	0.374	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-42.8	178.9	-66.9	173.8	-169.6	164.5	0	111.3	L60 T61 E62 K69	L60-K65 HydrophobicContact CB-CD 4.42Å; L60-K65 HydrophobicContact CB-CG 3.88Å; L60-K65 HydrophobicContact CD1-CG 4.14Å; T61-K65 PolarHBondContact O-N 2.87Å; T61-K65 VanDerWaalsContact O-N 3.11Å; E62-K65 WeakPolarHBondContact O-CB 3.34Å; E62-K65 PolarHBondContact O-N 3.33Å; E62-K65 IonicContact OE1-NZ 3.31Å; E62-K65 PolarHBondContact OE1-NZ 3.32Å; E62-K65 IonicContact OE2-NZ 3.92Å; K65-K69 WeakPolarHBondContact O-CA 3.45Å; K65-K69 PolarHBondContact O-N 2.91Å; K65-K69 VanDerWaalsContact O-N 3.08Å
66	E	79.1	Confident	81.5	Confident	149 Å²	149	81.5 Å²	81.5	70%	0.696	41%	0.413	S	S	*	.	H	α-helix	trans	-65	-44.3	179.6	-70.1	-175.5	-179.5	0	0	112	E62 D63	E62-E66 PolarHBondContact O-N 2.96Å; D63-E66 PolarHBondContact O-N 3.39Å
67	E	78.8	Confident	81.5	Confident	81 Å²	81	81.4 Å²	81.4	38%	0.379	42%	0.421	S	S	.	.	H	α-helix	trans	-73.3	-48.1	-179.3	-74.1	-172.6	-176.2	0	0	112.8	T19 D63 Y176	T19-E67 PolarHBondContact OG1-OE2 3.2Å; D63-E67 WeakPolarHBondContact O-CG 3.38Å; D63-E67 PolarHBondContact O-N 3.15Å; E67-Y176 HydrophobicContact CB-CD2 4.4Å; E67-Y176 HydrophobicContact CB-CE2 4.09Å; E67-Y176 WeakPolarHBondContact O-CB 3.32Å; E67-Y176 VanDerWaalsContact OE2-CZ 3.27Å; E67-Y176 PolarHBondContact OE2-OH 2.86Å
68	T	78.7	Confident	81.9	Confident	14 Å²	14	75.8 Å²	75.8	9%	0.086	40%	0.396	C	S	.	.	H	α-helix	trans	-85.7	-26.7	-168.8	67.2	0	0	0	0	113.4	I14 C64 I70 Y176	I14-T68 HydrophobicContact CG2-CG2 3.7Å; C64-T68 VanDerWaalsContact O-CB 3.3Å; C64-T68 WeakPolarHBondContact O-CB 3.39Å; C64-T68 VanDerWaalsContact O-CG2 3.28Å; C64-T68 WeakPolarHBondContact O-CG2 3.26Å; C64-T68 PolarHBondContact O-N 3.24Å; C64-T68 PolarHBondContact O-OG1 3.48Å; T68-I70 PolarHBondContact O-N 3.31Å; T68-I70 VanDerWaalsContact O-N 3.16Å; T68-I70 PolarHBondContact OG1-N 3.16Å; T68-Y176 HydrophobicContact CG2-CD1 3.86Å; T68-Y176 HydrophobicContact CG2-CE1 4.11Å
69	K	79.8	Confident	82.7	Confident	169 Å²	169	73.1 Å²	73.1	74%	0.735	38%	0.384	S	S	*	.			trans	52.8	27.3	-171.6	-53.5	-179.5	-177.9	176.6	0	113.3	K65	K65-K69 WeakPolarHBondContact O-CA 3.45Å; K65-K69 PolarHBondContact O-N 2.91Å; K65-K69 VanDerWaalsContact O-N 3.08Å
70	I	79.9	Confident	83.4	Confident	25 Å²	25	71.1 Å²	71.1	13%	0.128	37%	0.374	C	S	.	.			trans	-85.6	118.9	177.4	-64.3	172.1	0	0	0	108.9	I31 L32 L52 T68 L75	I31-I70 HydrophobicContact CD1-CD1 4.18Å; L32-I70 HydrophobicContact CB-CD1 4.16Å; L32-I70 HydrophobicContact CD2-CD1 4.07Å; L52-I70 HydrophobicContact CD2-CD1 4.22Å; L52-I70 HydrophobicContact CD2-CG2 4.14Å; T68-I70 PolarHBondContact O-N 3.31Å; T68-I70 VanDerWaalsContact O-N 3.16Å; T68-I70 PolarHBondContact OG1-N 3.16Å; I70-L75 HydrophobicContact CG2-CD1 3.9Å; I70-L75 HydrophobicContact CG2-CD2 4.03Å; I70-L75 HydrophobicContact CG2-CG 3.74Å
71	D	75.4	Confident	84	Confident	107 Å²	107	70.2 Å²	70.2	57%	0.572	37%	0.37	S	S	*	.			trans	-72.5	140.4	176.3	-60.5	-45.4	0	0	0	112	E73 N74 L75	D71-E73 PolarHBondContact O-N 2.82Å; D71-N74 PolarHBondContact O-N 2.72Å; D71-L75 PolarHBondContact O-N 2.62Å
72	A	77.6	Confident	84.6	Confident	51 Å²	51	70.2 Å²	70.2	42%	0.421	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-28.4	179.4	0	0	0	0	0	113.3	L58 L75 S76	L58-A72 HydrophobicContact CD2-CB 3.99Å; A72-L75 PolarHBondContact O-N 3.39Å; A72-S76 PolarHBondContact O-N 2.79Å; A72-S76 VanDerWaalsContact O-N 3.16Å
73	E	79	Confident	85.3	Confident	161 Å²	161	68.9 Å²	68.9	75%	0.752	36%	0.362	S	S	*	.	H	α-helix	trans	-64.9	-41.6	177.6	-65.7	-172.7	176.1	0	0	111.8	D71 L75 S76	D71-E73 PolarHBondContact O-N 2.82Å; E73-L75 VanDerWaalsContact C-N 3.31Å; E73-L75 PolarHBondContact O-N 3.4Å; E73-S76 PolarHBondContact O-N 2.87Å; E73-S76 PolarHBondContact O-OG 2.96Å
74	N	82.6	Confident	86.1	Confident	82 Å²	82	63.4 Å²	63.4	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-36.3	178.1	-67.8	-27.7	0	0	0	111.5	L52 D71 S77 A78	L52-N74 HydrophobicContact CD1-CB 4Å; D71-N74 PolarHBondContact O-N 2.72Å; N74-S77 PolarHBondContact O-OG 3.15Å; N74-A78 PolarHBondContact O-N 3.06Å
75	L	86.7	Confident	86.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.9	-32.7	176.2	-69.3	171.2	0	0	0	112.8	I31 L52 R54 L58 L60 I70 D71 A72 E73 S77 A78	I31-L75 HydrophobicContact CB-CD1 4.46Å; I31-L75 HydrophobicContact CB-CD2 3.88Å; I31-L75 HydrophobicContact CG2-CD1 4.34Å; I31-L75 HydrophobicContact CG2-CD2 4.34Å; L52-L75 HydrophobicContact CD2-CD2 4.04Å; R54-L75 WeakPolarHBondContact CB-O 3.48Å; R54-L75 WeakPolarHBondContact CG-O 3.22Å; L58-L75 HydrophobicContact CD2-CB 4.5Å; L60-L75 HydrophobicContact CD1-CD1 3.93Å; L60-L75 HydrophobicContact CD2-CD1 3.92Å; L60-L75 HydrophobicContact CG-CD1 4.32Å; I70-L75 HydrophobicContact CG2-CD1 3.9Å; I70-L75 HydrophobicContact CG2-CD2 4.03Å; I70-L75 HydrophobicContact CG2-CG 3.74Å; D71-L75 PolarHBondContact O-N 2.62Å; A72-L75 PolarHBondContact O-N 3.39Å; E73-L75 VanDerWaalsContact C-N 3.31Å; E73-L75 PolarHBondContact O-N 3.4Å; L75-S77 VanDerWaalsContact C-N 3.26Å; L75-S77 PolarHBondContact O-N 3.39Å; L75-A78 WeakPolarHBondContact O-CB 3.35Å; L75-A78 PolarHBondContact O-N 3.44Å
76	S	86.1	Confident	87.3	Confident	65 Å²	65	66.6 Å²	66.6	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-64.6	-32	-179.3	76.2	0	0	0	0	113.2	R54 A72 E73	R54-S76 WeakPolarHBondContact CD-O 3.48Å; A72-S76 PolarHBondContact O-N 2.79Å; A72-S76 VanDerWaalsContact O-N 3.16Å; E73-S76 PolarHBondContact O-N 2.87Å; E73-S76 PolarHBondContact O-OG 2.96Å
77	S	89.3	Confident	88	Confident	101 Å²	101	63.7 Å²	63.7	71%	0.706	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-4.8	178.8	65.4	0	0	0	0	113.8	N74 L75	N74-S77 PolarHBondContact O-OG 3.15Å; L75-S77 VanDerWaalsContact C-N 3.26Å; L75-S77 PolarHBondContact O-N 3.39Å
78	A	93.5	Very high	88.8	Confident	10 Å²	10	59.9 Å²	59.9	8%	0.083	31%	0.311	C	S	.	.	S	Bend	trans	-69.7	155.3	-178.5	0	0	0	0	0	112.8	L52 R54 N74 L75	L52-A78 HydrophobicContact CB-CB 3.65Å; R54-A78 HydrophobicContact CB-CB 4.18Å; R54-A78 WeakPolarHBondContact CB-O 3.47Å; N74-A78 PolarHBondContact O-N 3.06Å; L75-A78 WeakPolarHBondContact O-CB 3.35Å; L75-A78 PolarHBondContact O-N 3.44Å
79	P	95.7	Very high	89.5	Confident	27 Å²	27	61.4 Å²	61.4	18%	0.175	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-64.1	154.2	173	26.2	-34.1	0	0	0	112.2	V51 L52 R54 Q83	V51-P79 HydrophobicContact CG2-CG 3.82Å; L52-P79 WeakPolarHBondContact O-CD 3.21Å; L52-P79 WeakPolarHBondContact O-CG 3.34Å; R54-P79 PolarHBondContact N-O 2.87Å; P79-Q83 HydrophobicContact CB-CB 3.72Å
80	Q	95.5	Very high	90.1	Very high	71 Å²	71	59.3 Å²	59.3	33%	0.332	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-70.1	162.9	168.7	-74.4	-177.6	-43.3	0	0	111.3	R54 D82 Q83 A84	R54-Q80 VanDerWaalsContact NH2-NE2 3.16Å; Q80-D82 VanDerWaalsContact C-N 3.25Å; Q80-D82 VanDerWaalsContact CB-OD1 3.23Å; Q80-D82 WeakPolarHBondContact CB-OD1 3.41Å; Q80-D82 PolarHBondContact O-N 3.23Å; Q80-Q83 WeakPolarHBondContact O-CB 3.43Å; Q80-Q83 PolarHBondContact O-N 2.99Å; Q80-A84 PolarHBondContact O-N 2.82Å
81	L	96.1	Very high	90.7	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-51.1	-42.6	-177.7	179.8	66	0	0	0	113	L30 V53 Q83 A84 L85 E121 A122 K125	L30-L81 HydrophobicContact CD2-CD1 3.9Å; V53-L81 HydrophobicContact CG1-CB 4.1Å; V53-L81 HydrophobicContact CG1-CD1 4.23Å; L81-Q83 VanDerWaalsContact C-N 3.31Å; L81-Q83 PolarHBondContact O-N 3.44Å; L81-A84 PolarHBondContact O-N 3.16Å; L81-L85 HydrophobicContact CD1-CD1 4.24Å; L81-L85 HydrophobicContact CD1-CG 4.19Å; L81-L85 HydrophobicContact CG-CD1 4.05Å; L81-L85 HydrophobicContact CG-CG 4.4Å; L81-L85 WeakPolarHBondContact O-CB 3.37Å; L81-L85 VanDerWaalsContact O-CG 3.25Å; L81-L85 WeakPolarHBondContact O-CG 3.46Å; L81-L85 PolarHBondContact O-N 2.72Å; L81-E121 HydrophobicContact CD2-CB 4.29Å; L81-E121 HydrophobicContact CD2-CG 3.89Å; L81-A122 HydrophobicContact CD2-CB 4.34Å; L81-K125 HydrophobicContact CB-CD 4.22Å; L81-K125 HydrophobicContact CD2-CD 4.15Å
82	D	96.1	Very high	91.4	Very high	43 Å²	43	54.1 Å²	54.1	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-34.3	179.7	73.3	-50.5	0	0	0	113.2	Q80 R86 V127	Q80-D82 VanDerWaalsContact C-N 3.25Å; Q80-D82 VanDerWaalsContact CB-OD1 3.23Å; Q80-D82 WeakPolarHBondContact CB-OD1 3.41Å; Q80-D82 PolarHBondContact O-N 3.23Å; D82-R86 VanDerWaalsContact O-CG 3.29Å; D82-R86 WeakPolarHBondContact O-CG 2.98Å; D82-R86 PolarHBondContact O-N 2.99Å; D82-R86 PolarHBondContact O-NE 3.05Å; D82-R86 IonicContact OD2-CZ 2.72Å; D82-R86 IonicContact OD2-NH2 2.62Å; D82-R86 PolarHBondContact OD2-NH2 3.34Å; D82-V127 HydrophobicContact CB-CG1 3.78Å; D82-V127 HydrophobicContact CB-CG2 3.9Å
83	Q	96.1	Very high	92	Very high	85 Å²	85	54.1 Å²	54.1	40%	0.397	28%	0.283	S	S	.	.	H	α-helix	trans	-77	-41.9	176.6	-68	173.9	25.4	0	0	110.7	P79 Q80 L81 L85 R86 Q87	P79-Q83 HydrophobicContact CB-CB 3.72Å; Q80-Q83 WeakPolarHBondContact O-CB 3.43Å; Q80-Q83 PolarHBondContact O-N 2.99Å; L81-Q83 VanDerWaalsContact C-N 3.31Å; L81-Q83 PolarHBondContact O-N 3.44Å; Q83-L85 PolarHBondContact O-N 3.1Å; Q83-R86 WeakPolarHBondContact O-CB 3.25Å; Q83-R86 PolarHBondContact O-N 3.01Å; Q83-Q87 WeakPolarHBondContact O-CG 3.41Å; Q83-Q87 PolarHBondContact O-N 3.44Å
84	A	96.3	Very high	92.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-44.2	174.6	0	0	0	0	0	111.9	V51 V53 Q80 L81 R86 Q87 F88	V51-A84 HydrophobicContact CG1-CB 3.83Å; V51-A84 HydrophobicContact CG2-CB 4.1Å; V53-A84 HydrophobicContact CG2-CB 3.74Å; Q80-A84 PolarHBondContact O-N 2.82Å; L81-A84 PolarHBondContact O-N 3.16Å; A84-R86 VanDerWaalsContact C-N 3.33Å; A84-R86 PolarHBondContact O-N 3.44Å; A84-Q87 WeakPolarHBondContact O-CB 3.38Å; A84-Q87 PolarHBondContact O-N 3.49Å; A84-F88 PolarHBondContact O-N 2.8Å
85	L	96.1	Very high	92.7	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-33.8	175.4	-70.1	175.1	0	0	0	112.8	L33 L81 Q83 N89 L118 V127 L129 F133	L33-L85 HydrophobicContact CD2-CD2 4.43Å; L81-L85 HydrophobicContact CD1-CD1 4.24Å; L81-L85 HydrophobicContact CD1-CG 4.19Å; L81-L85 HydrophobicContact CG-CD1 4.05Å; L81-L85 HydrophobicContact CG-CG 4.4Å; L81-L85 WeakPolarHBondContact O-CB 3.37Å; L81-L85 VanDerWaalsContact O-CG 3.25Å; L81-L85 WeakPolarHBondContact O-CG 3.46Å; L81-L85 PolarHBondContact O-N 2.72Å; Q83-L85 PolarHBondContact O-N 3.1Å; L85-N89 PolarHBondContact O-N 3.32Å; L85-L118 HydrophobicContact CD2-CD2 4.33Å; L85-V127 HydrophobicContact CD1-CG1 4.05Å; L85-L129 HydrophobicContact CD1-CD2 3.72Å; L85-F133 HydrophobicContact CD2-CE1 4.31Å; L85-F133 HydrophobicContact CD2-CE2 4Å; L85-F133 HydrophobicContact CD2-CZ 3.67Å
86	R	94.5	Very high	92.7	Very high	151 Å²	151	51 Å²	51	57%	0.57	27%	0.269	S	S	*	.	H	α-helix	trans	-66.5	-42.6	172.4	-80.3	-176.1	-82.4	178.3	-5.2	111.8	D82 Q83 A84 N89 Q90	D82-R86 VanDerWaalsContact O-CG 3.29Å; D82-R86 WeakPolarHBondContact O-CG 2.98Å; D82-R86 PolarHBondContact O-N 2.99Å; D82-R86 PolarHBondContact O-NE 3.05Å; D82-R86 IonicContact OD2-CZ 2.72Å; D82-R86 IonicContact OD2-NH2 2.62Å; D82-R86 PolarHBondContact OD2-NH2 3.34Å; Q83-R86 WeakPolarHBondContact O-CB 3.25Å; Q83-R86 PolarHBondContact O-N 3.01Å; A84-R86 VanDerWaalsContact C-N 3.33Å; A84-R86 PolarHBondContact O-N 3.44Å; R86-N89 PolarHBondContact O-N 3.25Å; R86-Q90 WeakPolarHBondContact O-CB 3.29Å; R86-Q90 PolarHBondContact O-N 3.15Å
87	Q	94.9	Very high	92	Very high	88 Å²	88	54.5 Å²	54.5	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-43.8	174.9	-70.5	178.7	17	0	0	111.6	V51 Q83 A84 Q90 S91	V51-Q87 VanDerWaalsContact CG2-OE1 3.22Å; Q83-Q87 WeakPolarHBondContact O-CG 3.41Å; Q83-Q87 PolarHBondContact O-N 3.44Å; A84-Q87 WeakPolarHBondContact O-CB 3.38Å; A84-Q87 PolarHBondContact O-N 3.49Å; Q87-Q90 PolarHBondContact O-N 3.49Å; Q87-S91 WeakPolarHBondContact O-CB 3.45Å; Q87-S91 PolarHBondContact O-N 3.25Å
88	F	95.4	Very high	90.8	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.5	-55.6	172.7	166.9	-94.5	0	0	0	111.4	V9 L11 W35 A84 Q90 S91 V92 L106 F133	V9-F88 HydrophobicContact CG1-CE2 3.82Å; V9-F88 HydrophobicContact CG1-CZ 3.94Å; L11-F88 HydrophobicContact CD1-CD2 4.23Å; L11-F88 HydrophobicContact CD1-CE2 3.81Å; L11-F88 HydrophobicContact CD1-CZ 4.45Å; W35-F88 HydrophobicContact CB-CD2 4.14Å; W35-F88 HydrophobicContact CB-CE2 3.83Å; W35-F88 AromaticContact CD1-CD2 3.98Å; W35-F88 AromaticContact CD1-CE2 3.92Å; W35-F88 AromaticContact CD2-CD2 3.51Å; W35-F88 HydrophobicContact CD2-CD2 3.51Å; W35-F88 HydrophobicContact CD2-CE2 4.08Å; W35-F88 AromaticContact CE2-CD2 3.82Å; W35-F88 AromaticContact CE3-CD2 3.93Å; W35-F88 HydrophobicContact CE3-CD2 3.93Å; W35-F88 AromaticContact CG-CD2 3.62Å; W35-F88 HydrophobicContact CG-CD2 3.62Å; W35-F88 AromaticContact CG-CE2 3.66Å; W35-F88 HydrophobicContact CG-CE2 3.66Å; W35-F88 HydrophobicContact CH2-CB 4.5Å; W35-F88 HydrophobicContact CZ2-CB 4.47Å; W35-F88 HydrophobicContact CZ2-CD2 4.48Å; A84-F88 PolarHBondContact O-N 2.8Å; F88-Q90 VanDerWaalsContact C-N 3.31Å; F88-Q90 PolarHBondContact O-N 3.08Å; F88-S91 PolarHBondContact O-N 3.46Å; F88-V92 HydrophobicContact CD2-CG2 4.17Å; F88-V92 HydrophobicContact CE1-CG2 4.3Å; F88-V92 HydrophobicContact CE2-CG2 3.73Å; F88-V92 HydrophobicContact CZ-CG2 3.79Å; F88-V92 WeakPolarHBondContact O-CG2 3.49Å; F88-V92 PolarHBondContact O-N 3.23Å; F88-L106 HydrophobicContact CZ-CD2 3.84Å; F88-F133 AromaticContact CD1-CE2 3.9Å; F88-F133 HydrophobicContact CD1-CE2 3.9Å; F88-F133 AromaticContact CD1-CZ 3.72Å; F88-F133 HydrophobicContact CD1-CZ 3.72Å; F88-F133 AromaticContact CE1-CE2 3.75Å; F88-F133 HydrophobicContact CE1-CE2 3.75Å; F88-F133 AromaticContact CE1-CZ 3.59Å; F88-F133 HydrophobicContact CE1-CZ 3.59Å; F88-F133 HydrophobicContact CG-CZ 4.43Å; F88-F133 HydrophobicContact CZ-CZ 4.2Å
89	N	92.6	Very high	89.1	Confident	47 Å²	47	54.7 Å²	54.7	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-59.6	-41.8	-179.4	-83.1	-18.4	0	0	0	112.4	L85 R86 S93 P130	L85-N89 PolarHBondContact O-N 3.32Å; R86-N89 PolarHBondContact O-N 3.25Å; N89-S93 VanDerWaalsContact O-CB 3.22Å; N89-S93 WeakPolarHBondContact O-CB 3.24Å; N89-S93 PolarHBondContact O-N 3.3Å; N89-S93 PolarHBondContact O-OG 3.03Å; N89-P130 WeakPolarHBondContact ND2-CB 2.99Å; N89-P130 WeakPolarHBondContact ND2-CG 3.46Å
90	Q	91.7	Very high	87.1	Confident	125 Å²	125	61.4 Å²	61.4	58%	0.584	32%	0.324	S	S	*	.	H	α-helix	trans	-65.8	-43.9	179.4	-173.8	175.9	14	0	0	111.3	R86 Q87 F88 S93 N94	R86-Q90 WeakPolarHBondContact O-CB 3.29Å; R86-Q90 PolarHBondContact O-N 3.15Å; Q87-Q90 PolarHBondContact O-N 3.49Å; F88-Q90 VanDerWaalsContact C-N 3.31Å; F88-Q90 PolarHBondContact O-N 3.08Å; Q90-S93 PolarHBondContact O-N 2.98Å; Q90-N94 WeakPolarHBondContact O-CB 3.39Å; Q90-N94 PolarHBondContact O-N 3.13Å; Q90-N94 PolarHBondContact O-ND2 3.39Å; Q90-N94 PolarHBondContact O-OD1 2.89Å
91	S	92.6	Very high	85.5	Confident	21 Å²	21	61.3 Å²	61.3	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-52.7	176.7	171.8	0	0	0	0	111.3	W35 H49 Q87 F88 S93 N94 E95	W35-S91 PolarHBondContact NE1-OG 3.47Å; H49-S91 PolarHBondContact CE1-OG 2.76Å; H49-S91 PolarHBondContact ND1-OG 3.39Å; H49-S91 PolarHBondContact NE2-OG 3.01Å; Q87-S91 WeakPolarHBondContact O-CB 3.45Å; Q87-S91 PolarHBondContact O-N 3.25Å; F88-S91 PolarHBondContact O-N 3.46Å; S91-S93 VanDerWaalsContact C-N 3.3Å; S91-S93 PolarHBondContact O-N 3.37Å; S91-N94 PolarHBondContact O-N 3.06Å; S91-E95 PolarHBondContact O-N 3.24Å
92	V	92.1	Very high	84.5	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.012	36%	0.356	C	S	.	.	H	α-helix	trans	-60.1	-41.7	178.2	172.7	0	0	0	0	111.2	V9 F88 N94 E95 L96 F104	V9-V92 HydrophobicContact CG1-CG2 4.11Å; V9-V92 HydrophobicContact CG2-CG1 3.94Å; V9-V92 HydrophobicContact CG2-CG2 4.31Å; F88-V92 HydrophobicContact CD2-CG2 4.17Å; F88-V92 HydrophobicContact CE1-CG2 4.3Å; F88-V92 HydrophobicContact CE2-CG2 3.73Å; F88-V92 HydrophobicContact CZ-CG2 3.79Å; F88-V92 WeakPolarHBondContact O-CG2 3.49Å; F88-V92 PolarHBondContact O-N 3.23Å; V92-N94 PolarHBondContact O-N 3.03Å; V92-E95 PolarHBondContact O-N 3.18Å; V92-L96 HydrophobicContact CG1-CD1 3.56Å; V92-L96 HydrophobicContact CG1-CG 4.22Å; V92-L96 VanDerWaalsContact O-CB 3.3Å; V92-L96 WeakPolarHBondContact O-CB 3.08Å; V92-L96 VanDerWaalsContact O-CG 3.29Å; V92-L96 WeakPolarHBondContact O-CG 3.37Å; V92-L96 PolarHBondContact O-N 2.89Å; V92-F104 HydrophobicContact CG1-CD2 4.44Å; V92-F104 HydrophobicContact CG1-CE1 4.16Å; V92-F104 HydrophobicContact CG1-CE2 4.06Å; V92-F104 HydrophobicContact CG1-CZ 3.91Å
93	S	89.1	Confident	83.9	Confident	51 Å²	51	63.9 Å²	63.9	36%	0.357	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-39.5	179.4	-58.9	0	0	0	0	113	N89 Q90 S91 N97 I98	N89-S93 VanDerWaalsContact O-CB 3.22Å; N89-S93 WeakPolarHBondContact O-CB 3.24Å; N89-S93 PolarHBondContact O-N 3.3Å; N89-S93 PolarHBondContact O-OG 3.03Å; Q90-S93 PolarHBondContact O-N 2.98Å; S91-S93 VanDerWaalsContact C-N 3.3Å; S91-S93 PolarHBondContact O-N 3.37Å; S93-N97 PolarHBondContact O-N 3.4Å; S93-I98 PolarHBondContact O-N 2.95Å
94	N	88	Confident	83.8	Confident	106 Å²	106	62.4 Å²	62.4	57%	0.567	35%	0.354	S	S	*	.	H	α-helix	trans	-69.6	-41.9	178.2	-69.7	-15.3	0	0	0	111.7	Q90 S91 V92 N97	Q90-N94 WeakPolarHBondContact O-CB 3.39Å; Q90-N94 PolarHBondContact O-N 3.13Å; Q90-N94 PolarHBondContact O-ND2 3.39Å; Q90-N94 PolarHBondContact O-OD1 2.89Å; S91-N94 PolarHBondContact O-N 3.06Å; V92-N94 PolarHBondContact O-N 3.03Å; N94-N97 PolarHBondContact O-N 3.05Å
95	E	89.1	Confident	83.8	Confident	63 Å²	63	62.9 Å²	62.9	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-70.3	-40.7	-178.7	-173.2	166.9	176.3	0	0	111.9	V37 G46 Q47 H49 S91 V92 N97	V37-E95 HydrophobicContact CB-CG 4.42Å; V37-E95 HydrophobicContact CG2-CB 4.42Å; V37-E95 HydrophobicContact CG2-CG 4.1Å; V37-E95 WeakPolarHBondContact CG2-OE2 3.38Å; G46-E95 WeakPolarHBondContact CA-OE1 3.32Å; Q47-E95 PolarHBondContact N-OE1 3.06Å; H49-E95 IonicContact CD2-OE2 2.72Å; H49-E95 IonicContact CE1-OE2 3.3Å; H49-E95 IonicContact NE2-OE2 2.58Å; H49-E95 PolarHBondContact NE2-OE2 2.95Å; S91-E95 PolarHBondContact O-N 3.24Å; V92-E95 PolarHBondContact O-N 3.18Å; E95-N97 VanDerWaalsContact C-N 3.27Å; E95-N97 PolarHBondContact O-N 3.07Å
96	L	85.8	Confident	83.8	Confident	9 Å²	9	62.7 Å²	62.7	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-78.8	-8.6	179.5	-66	-179.5	0	0	0	113.7	Y7 V37 V92 I98 F104	Y7-L96 HydrophobicContact CD1-CD2 3.43Å; Y7-L96 VanDerWaalsContact CD1-CD2 3.43Å; Y7-L96 HydrophobicContact CD2-CD2 3.66Å; Y7-L96 HydrophobicContact CE1-CD2 3.9Å; Y7-L96 HydrophobicContact CE2-CD2 4.11Å; Y7-L96 HydrophobicContact CG-CD2 3.32Å; V37-L96 HydrophobicContact CG1-CD2 3.5Å; V37-L96 HydrophobicContact CG1-CG 4.41Å; V92-L96 HydrophobicContact CG1-CD1 3.56Å; V92-L96 HydrophobicContact CG1-CG 4.22Å; V92-L96 VanDerWaalsContact O-CB 3.3Å; V92-L96 WeakPolarHBondContact O-CB 3.08Å; V92-L96 VanDerWaalsContact O-CG 3.29Å; V92-L96 WeakPolarHBondContact O-CG 3.37Å; V92-L96 PolarHBondContact O-N 2.89Å; L96-I98 HydrophobicContact CB-CD1 4.36Å; L96-I98 HydrophobicContact CB-CG1 3.57Å; L96-I98 HydrophobicContact CD1-CD1 4.28Å; L96-I98 HydrophobicContact CD1-CG1 4.28Å; L96-I98 PolarHBondContact O-N 2.91Å; L96-F104 HydrophobicContact CD1-CB 3.81Å; L96-F104 HydrophobicContact CD1-CD1 3.54Å; L96-F104 HydrophobicContact CD1-CE1 4.24Å; L96-F104 HydrophobicContact CD1-CG 3.72Å
97	N	72.7	Confident	84	Confident	138 Å²	138	55.5 Å²	55.5	74%	0.738	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	48.5	-169.4	-70.6	-64.3	0	0	0	111.3	S93 N94 E95 G99	S93-N97 PolarHBondContact O-N 3.4Å; N94-N97 PolarHBondContact O-N 3.05Å; E95-N97 VanDerWaalsContact C-N 3.27Å; E95-N97 PolarHBondContact O-N 3.07Å; N97-G99 VanDerWaalsContact C-N 3.33Å; N97-G99 PolarHBondContact O-N 2.96Å
98	I	62.1	Low	84.1	Confident	72 Å²	72	51.3 Å²	51.3	37%	0.369	31%	0.309	S	S	.	.			trans	-53.9	95.7	-166.5	-56.7	179.7	0	0	0	110.1	S93 L96 T102 F104	S93-I98 PolarHBondContact O-N 2.95Å; L96-I98 HydrophobicContact CB-CD1 4.36Å; L96-I98 HydrophobicContact CB-CG1 3.57Å; L96-I98 HydrophobicContact CD1-CD1 4.28Å; L96-I98 HydrophobicContact CD1-CG1 4.28Å; L96-I98 PolarHBondContact O-N 2.91Å; I98-T102 WeakPolarHBondContact CA-OG1 3.21Å; I98-F104 HydrophobicContact CD1-CD1 4.28Å; I98-F104 HydrophobicContact CD1-CE1 3.85Å
99	G	58.3	Low	84.1	Confident	43 Å²	43	52 Å²	52	44%	0.443	31%	0.313	S	S	.	.			trans	-95.1	-176.1	172.5	0	0	0	0	0	109.9	N97 G101 T102	N97-G99 VanDerWaalsContact C-N 3.33Å; N97-G99 PolarHBondContact O-N 2.96Å; G99-G101 PolarHBondContact O-N 2.74Å; G99-T102 PolarHBondContact N-OG1 2.97Å; G99-T102 PolarHBondContact O-OG1 2.66Å
100	V	53.9	Low	84.2	Confident	167 Å²	167	50.1 Å²	50.1	100%	1.012	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	98.6	172.1	-172.8	0	0	0	0	108.4
101	G	62.1	Low	84.4	Confident	70 Å²	70	45 Å²	45	72%	0.722	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.1	-12.9	170.6	0	0	0	0	0	116.8	G99	G99-G101 PolarHBondContact O-N 2.74Å
102	T	74.3	Confident	84.6	Confident	49 Å²	49	45.2 Å²	45.2	30%	0.301	28%	0.28	S	S	.	.			trans	-82	122.9	175.9	43.7	0	0	0	0	110.9	Y7 I98 G99	Y7-T102 HydrophobicContact CE2-CG2 4.26Å; I98-T102 WeakPolarHBondContact CA-OG1 3.21Å; G99-T102 PolarHBondContact N-OG1 2.97Å; G99-T102 PolarHBondContact O-OG1 2.66Å
103	S	85.3	Confident	84.8	Confident	49 Å²	49	45.5 Å²	45.5	34%	0.343	28%	0.281	S	S	.	.			trans	-109.1	135.8	178.1	64.6	0	0	0	0	111.3	P5 D6 Y7	P5-S103 WeakPolarHBondContact CA-OG 3.33Å; D6-S103 WeakPolarHBondContact CB-O 3.37Å; D6-S103 PolarHBondContact N-O 3.45Å; D6-S103 PolarHBondContact N-OG 3.02Å; D6-S103 PolarHBondContact OD2-N 2.96Å; D6-S103 PolarHBondContact OD2-OG 3.24Å; Y7-S103 PolarHBondContact N-O 3.35Å; Y7-S103 VanDerWaalsContact N-O 3.12Å
104	F	92.9	Very high	85.2	Confident	55 Å²	55	43 Å²	43	24%	0.241	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	157.3	171.6	78.8	-88.9	0	0	0	111.5	Y7 V9 V92 L96 I98 L106 C132	Y7-F104 WeakPolarHBondContact O-CA 3.29Å; V9-F104 HydrophobicContact CB-CD2 4.4Å; V9-F104 HydrophobicContact CG2-CD2 3.54Å; V9-F104 HydrophobicContact CG2-CE2 4.03Å; V9-F104 HydrophobicContact CG2-CG 4.26Å; V92-F104 HydrophobicContact CG1-CD2 4.44Å; V92-F104 HydrophobicContact CG1-CE1 4.16Å; V92-F104 HydrophobicContact CG1-CE2 4.06Å; V92-F104 HydrophobicContact CG1-CZ 3.91Å; L96-F104 HydrophobicContact CD1-CB 3.81Å; L96-F104 HydrophobicContact CD1-CD1 3.54Å; L96-F104 HydrophobicContact CD1-CE1 4.24Å; L96-F104 HydrophobicContact CD1-CG 3.72Å; I98-F104 HydrophobicContact CD1-CD1 4.28Å; I98-F104 HydrophobicContact CD1-CE1 3.85Å; F104-L106 HydrophobicContact CE2-CD2 4.38Å; F104-C132 HydrophobicContact CE2-CB 3.75Å; F104-C132 HydrophobicContact CZ-CB 3.83Å
105	C	95.6	Very high	85.6	Confident	10 Å²	10	38.2 Å²	38.2	7%	0.068	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150	173.1	-170.8	0	0	0	0	109.9	P5 Y7 L8 V9 S135 F137	P5-C105 HydrophobicContact CB-CB 4.25Å; P5-C105 HydrophobicContact CG-CB 4.18Å; Y7-C105 PolarHBondContact O-N 3.49Å; Y7-C105 VanDerWaalsContact O-N 3.14Å; L8-C105 CarbonylContact C-O 3.57Å; L8-C105 WeakPolarHBondContact CA-O 3.46Å; L8-C105 HydrophobicContact CD2-CB 4.13Å; V9-C105 PolarHBondContact N-O 3.16Å; C105-S135 PolarHBondContact SG-O 2.9Å; C105-S135 VanDerWaalsContact SG-O 3.39Å; C105-F137 HydrophobicContact CB-CD2 4Å; C105-F137 HydrophobicContact CB-CE2 3.79Å
106	L	97.4	Very high	85.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	150.5	173	-58.2	-176.2	0	0	0	110.3	V9 L11 F88 F104 I114 C132 F133 F136 F137	V9-L106 HydrophobicContact CB-CD2 3.9Å; V9-L106 HydrophobicContact CG1-CD2 4.18Å; V9-L106 CarbonylContact O-C 3.59Å; V9-L106 WeakPolarHBondContact O-CA 3.48Å; L11-L106 HydrophobicContact CD2-CD1 4.23Å; F88-L106 HydrophobicContact CZ-CD2 3.84Å; F104-L106 HydrophobicContact CE2-CD2 4.38Å; L106-I114 HydrophobicContact CD1-CD1 3.87Å; L106-C132 VanDerWaalsContact CD1-O 3.24Å; L106-C132 WeakPolarHBondContact CD1-O 3.39Å; L106-C132 HydrophobicContact CG-CB 4.49Å; L106-C132 WeakPolarHBondContact CG-O 3.46Å; L106-F133 HydrophobicContact CD1-CB 4.47Å; L106-F133 HydrophobicContact CD1-CD1 3.57Å; L106-F133 HydrophobicContact CD1-CE1 3.89Å; L106-F133 HydrophobicContact CD1-CG 4.01Å; L106-F136 HydrophobicContact CB-CB 3.9Å; L106-F136 CarbonylContact O-C 3.59Å; L106-F136 VanDerWaalsContact O-CA 3.28Å; L106-F136 WeakPolarHBondContact O-CA 3.45Å; L106-F137 PolarHBondContact O-N 3.38Å
107	C	98.1	Very high	86.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.2	170.2	-170.3	0	0	0	0	109.1	L8 V9 V10 L11 F137 I188	L8-C107 HydrophobicContact CB-CB 4.37Å; L8-C107 HydrophobicContact CD1-CB 4.27Å; V9-C107 PolarHBondContact O-N 3.43Å; V10-C107 WeakPolarHBondContact CA-O 3.26Å; L11-C107 PolarHBondContact N-O 3.45Å; C107-F137 WeakPolarHBondContact CA-O 3.33Å; C107-F137 HydrophobicContact CB-CB 4.39Å; C107-I188 HydrophobicContact CB-CD1 4.35Å
108	T	97.5	Very high	87.5	Confident	0 Å²	0	29 Å²	29	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	155.5	-175.6	53.9	0	0	0	0	111.7	L11 G110 H113 I114 F137 L139 M184	L11-T108 HydrophobicContact CB-CG2 4.03Å; L11-T108 HydrophobicContact CD2-CG2 4.42Å; T108-G110 WeakPolarHBondContact CB-O 3.14Å; T108-G110 PolarHBondContact O-N 3.21Å; T108-G110 PolarHBondContact OG1-O 3.45Å; T108-H113 HydrophobicContact CG2-CB 4.05Å; T108-I114 HydrophobicContact CG2-CD1 4.26Å; T108-I114 HydrophobicContact CG2-CG1 3.97Å; T108-F137 PolarHBondContact N-O 3.37Å; T108-L139 WeakPolarHBondContact O-CB 3.03Å; T108-L139 PolarHBondContact O-N 3.24Å; T108-M184 VanDerWaalsContact C-CE 3.41Å
109	D	94.6	Very high	89.2	Confident	16 Å²	16	25.7 Å²	25.7	9%	0.086	17%	0.173	C	C	.	.	S	Bend	trans	-75.5	93.4	170.3	177.6	37.1	0	0	0	108.8	H113 R140 V158 M184	D109-H113 PolarHBondContact O-ND1 3.48Å; D109-R140 VanDerWaalsContact CG-NH2 3.33Å; D109-R140 IonicContact OD1-CZ 3.81Å; D109-R140 IonicContact OD1-NE 2.83Å; D109-R140 PolarHBondContact OD1-NE 2.73Å; D109-R140 IonicContact OD1-NH2 3.78Å; D109-R140 PolarHBondContact OD1-NH2 2.9Å; D109-R140 IonicContact OD2-CZ 2.89Å; D109-R140 IonicContact OD2-NE 3.8Å; D109-R140 IonicContact OD2-NH2 2.72Å; D109-R140 PolarHBondContact OD2-NH2 2.71Å; D109-V158 HydrophobicContact CB-CG2 3.86Å; D109-V158 VanDerWaalsContact CG-CG2 3.44Å; D109-M184 HydrophobicContact CB-CE 3.95Å; D109-M184 HydrophobicContact CB-SD 3.87Å
110	G	94.8	Very high	91	Very high	6 Å²	6	25.1 Å²	25.1	6%	0.062	16%	0.162	C	C	.	.	S	Bend	trans	71.4	176.8	-169.5	0	0	0	0	0	113.2	T108 D138	T108-G110 WeakPolarHBondContact CB-O 3.14Å; T108-G110 PolarHBondContact O-N 3.21Å; T108-G110 PolarHBondContact OG1-O 3.45Å; G110-D138 WeakPolarHBondContact CA-OD1 3.34Å; G110-D138 WeakPolarHBondContact CA-OD2 3.48Å
111	Q	95.6	Very high	93	Very high	19 Å²	19	17.9 Å²	17.9	9%	0.089	12%	0.117	C	C	.	.	S	Bend	trans	-82.8	-10.8	-178.9	67.8	-167	-40.6	0	0	116.1	H113 I114 R115 F136 D138 E277 L281	Q111-H113 PolarHBondContact O-N 3.17Å; Q111-I114 PolarHBondContact O-N 3.06Å; Q111-R115 HydrophobicContact CB-CG 4.26Å; Q111-R115 WeakPolarHBondContact O-CB 3.36Å; Q111-R115 WeakPolarHBondContact O-CG 3.43Å; Q111-R115 PolarHBondContact O-N 2.96Å; Q111-F136 HydrophobicContact CB-CE2 3.98Å; Q111-F136 HydrophobicContact CB-CZ 3.94Å; Q111-D138 PolarHBondContact N-OD2 2.87Å; Q111-E277 VanDerWaalsContact CD-OE1 3.3Å; Q111-E277 VanDerWaalsContact NE2-CD 3.28Å; Q111-E277 VanDerWaalsContact NE2-CG 3.32Å; Q111-E277 PolarHBondContact NE2-OE1 3.28Å; Q111-E277 PolarHBondContact OE1-OE1 3.23Å; Q111-L281 HydrophobicContact CG-CD1 4.01Å
112	L	96.6	Very high	94.6	Very high	25 Å²	25	14.6 Å²	14.6	13%	0.131	8%	0.083	C	C	.	.	H	α-helix	trans	-64.5	-39.4	-167.6	-59	-176	0	0	0	113	G20 L23 I114 R115 Q116 I117 L281	G20-L112 WeakPolarHBondContact O-CD1 3.41Å; L23-L112 HydrophobicContact CB-CB 4.22Å; L23-L112 HydrophobicContact CB-CD1 3.96Å; L23-L112 HydrophobicContact CD2-CB 4.08Å; L112-I114 VanDerWaalsContact C-N 3.31Å; L112-I114 PolarHBondContact O-N 3.2Å; L112-R115 PolarHBondContact O-N 3.2Å; L112-Q116 HydrophobicContact CD2-CG 3.84Å; L112-Q116 WeakPolarHBondContact O-CA 3.32Å; L112-Q116 WeakPolarHBondContact O-CB 3.33Å; L112-Q116 PolarHBondContact O-N 2.9Å; L112-I117 PolarHBondContact O-N 2.95Å; L112-L281 HydrophobicContact CD2-CD2 3.4Å; L112-L281 VanDerWaalsContact CD2-CD2 3.4Å
113	H	96.6	Very high	95.5	Very high	7 Å²	7	13.3 Å²	13.3	3%	0.032	8%	0.076	C	C	.	.	I	π-helix	trans	-52.5	-47.3	177.4	-66	97.5	0	0	0	112.7	F12 G13 T108 D109 Q111 I117 L118	F12-H113 AromaticContact CD2-CE1 3.76Å; F12-H113 AromaticContact CD2-NE2 3.55Å; F12-H113 AromaticContact CE2-CE1 3.81Å; F12-H113 AromaticContact CE2-NE2 3.68Å; F12-H113 AromaticContact CG-NE2 3.93Å; G13-H113 PolarHBondContact N-CD2 3.34Å; G13-H113 PolarHBondContact N-NE2 3.24Å; G13-H113 PolarHBondContact O-NE2 2.94Å; T108-H113 HydrophobicContact CG2-CB 4.05Å; D109-H113 PolarHBondContact O-ND1 3.48Å; Q111-H113 PolarHBondContact O-N 3.17Å; H113-I117 WeakPolarHBondContact O-CB 3.5Å; H113-L118 WeakPolarHBondContact O-CG 3.46Å; H113-L118 PolarHBondContact O-N 3.47Å; H113-L118 VanDerWaalsContact O-N 3.13Å
114	I	97.3	Very high	95.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-78.7	-52.8	179.6	-58.7	-67.3	0	0	0	109.8	L11 L106 T108 Q111 L112 L118 H119 F133 F136 V206	L11-I114 HydrophobicContact CD2-CD1 4.12Å; L106-I114 HydrophobicContact CD1-CD1 3.87Å; T108-I114 HydrophobicContact CG2-CD1 4.26Å; T108-I114 HydrophobicContact CG2-CG1 3.97Å; Q111-I114 PolarHBondContact O-N 3.06Å; L112-I114 VanDerWaalsContact C-N 3.31Å; L112-I114 PolarHBondContact O-N 3.2Å; I114-L118 HydrophobicContact CD1-CD1 3.97Å; I114-H119 PolarHBondContact O-CD2 3.29Å; I114-H119 VanDerWaalsContact O-CD2 3.24Å; I114-H119 PolarHBondContact O-N 3.38Å; I114-F133 HydrophobicContact CD1-CD1 3.97Å; I114-F136 HydrophobicContact CB-CD1 4.07Å; I114-F136 HydrophobicContact CB-CE1 4Å; I114-F136 HydrophobicContact CB-CG 4.42Å; I114-F136 HydrophobicContact CB-CZ 4.3Å; I114-F136 HydrophobicContact CG1-CB 4.24Å; I114-F136 HydrophobicContact CG1-CD1 3.91Å; I114-F136 HydrophobicContact CG1-CD2 4.11Å; I114-F136 HydrophobicContact CG1-CE1 4.3Å; I114-F136 HydrophobicContact CG1-CE2 4.5Å; I114-F136 HydrophobicContact CG1-CG 3.81Å; I114-F136 HydrophobicContact CG2-CD1 3.78Å; I114-F136 HydrophobicContact CG2-CE1 3.76Å; I114-V206 HydrophobicContact CG2-CG2 3.96Å
115	R	97.1	Very high	95.9	Very high	4 Å²	4	16.5 Å²	16.5	2%	0.015	8%	0.084	C	C	.	.	I	π-helix	trans	-81.5	-31.8	-165.8	-62.4	-170.7	-179.4	-79.5	1.2	114.8	Q111 L112 P120 F136 E204 R205 G247 L248 H278 L281 R285	Q111-R115 HydrophobicContact CB-CG 4.26Å; Q111-R115 WeakPolarHBondContact O-CB 3.36Å; Q111-R115 WeakPolarHBondContact O-CG 3.43Å; Q111-R115 PolarHBondContact O-N 2.96Å; L112-R115 PolarHBondContact O-N 3.2Å; R115-P120 WeakPolarHBondContact O-CD 3.47Å; R115-F136 HydrophobicContact CG-CZ 4.29Å; R115-E204 IonicContact CZ-OE2 3.33Å; R115-E204 IonicContact NE-OE2 3.99Å; R115-E204 PolarHBondContact NE-OE2 3.03Å; R115-E204 IonicContact NH2-OE2 3.48Å; R115-E204 PolarHBondContact NH2-OE2 3.31Å; R115-R205 PolarHBondContact NH2-O 2.74Å; R115-R205 VanDerWaalsContact NH2-O 3.11Å; R115-G247 WeakPolarHBondContact CG-O 3.42Å; R115-G247 PolarHBondContact NH1-O 2.78Å; R115-L248 HydrophobicContact CB-CD2 4.13Å; R115-H278 PolarHBondContact NH1-NE2 3.14Å; R115-H278 PolarHBondContact NH2-NE2 2.89Å; R115-L281 HydrophobicContact CB-CD1 4.26Å; R115-R285 PolarHBondContact O-NH2 3.21Å
116	Q	96.1	Very high	95.8	Very high	8 Å²	8	22.2 Å²	22.2	4%	0.037	11%	0.113	C	C	.	.	I	π-helix	trans	-104.5	-22.3	-177.2	-64.4	-68.3	32.4	0	0	114.2	L112 P120 L281 Q284	L112-Q116 HydrophobicContact CD2-CG 3.84Å; L112-Q116 WeakPolarHBondContact O-CA 3.32Å; L112-Q116 WeakPolarHBondContact O-CB 3.33Å; L112-Q116 PolarHBondContact O-N 2.9Å; Q116-P120 WeakPolarHBondContact O-CG 3.36Å; Q116-L281 HydrophobicContact CG-CD2 4.29Å; Q116-L281 PolarHBondContact NE2-O 3.42Å; Q116-Q284 VanDerWaalsContact NE2-OE1 3.11Å
117	I	95.6	Very high	95.7	Very high	6 Å²	6	23.6 Å²	23.6	3%	0.031	12%	0.122	C	C	.	.	I	π-helix	trans	-107	-70.8	-179.2	-54.4	163.7	0	0	0	111.1	T15 L23 L30 L112 H113 H119 P120 E121	T15-I117 HydrophobicContact CG2-CD1 3.68Å; T15-I117 HydrophobicContact CG2-CG1 3.82Å; T15-I117 HydrophobicContact CG2-CG2 4.14Å; L23-I117 HydrophobicContact CD1-CD1 3.65Å; L23-I117 HydrophobicContact CD2-CD1 3.49Å; L23-I117 VanDerWaalsContact CD2-CD1 3.49Å; L23-I117 HydrophobicContact CG-CD1 3.35Å; L23-I117 HydrophobicContact CG-CG1 4.11Å; L30-I117 HydrophobicContact CB-CG2 4Å; L30-I117 HydrophobicContact CD1-CG2 4.02Å; L112-I117 PolarHBondContact O-N 2.95Å; H113-I117 WeakPolarHBondContact O-CB 3.5Å; I117-H119 PolarHBondContact O-N 3.29Å; I117-P120 WeakPolarHBondContact O-CD 3.34Å; I117-E121 WeakPolarHBondContact O-CB 3.29Å; I117-E121 PolarHBondContact O-N 3Å
118	L	96.6	Very high	95.4	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.021	16%	0.163	C	C	.	.	I	π-helix	trans	-64.7	-47	-165.7	-73.5	162.9	0	0	0	112.9	L11 L30 L85 H113 I114 A122 F133	L11-L118 HydrophobicContact CD2-CD1 3.77Å; L30-L118 HydrophobicContact CD2-CD2 4.1Å; L85-L118 HydrophobicContact CD2-CD2 4.33Å; H113-L118 WeakPolarHBondContact O-CG 3.46Å; H113-L118 PolarHBondContact O-N 3.47Å; H113-L118 VanDerWaalsContact O-N 3.13Å; I114-L118 HydrophobicContact CD1-CD1 3.97Å; L118-A122 WeakPolarHBondContact O-CB 3.46Å; L118-A122 PolarHBondContact O-N 3.34Å; L118-F133 HydrophobicContact CD1-CD1 3.79Å; L118-F133 HydrophobicContact CD1-CE1 3.7Å
119	H	97.1	Very high	95.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-49.4	179	-86.2	-88.8	0	0	0	113.2	I114 I117 S123 L129 F133 Y134 K246 G247	I114-H119 PolarHBondContact O-CD2 3.29Å; I114-H119 VanDerWaalsContact O-CD2 3.24Å; I114-H119 PolarHBondContact O-N 3.38Å; I117-H119 PolarHBondContact O-N 3.29Å; H119-S123 VanDerWaalsContact O-CB 3.24Å; H119-S123 WeakPolarHBondContact O-CB 3.39Å; H119-S123 PolarHBondContact O-N 2.78Å; H119-S123 VanDerWaalsContact O-N 3.13Å; H119-L129 HydrophobicContact CB-CD1 4.37Å; H119-F133 PolarHBondContact NE2-O 2.96Å; H119-Y134 AromaticContact CE1-CD1 3.65Å; H119-Y134 AromaticContact CE1-CE1 3.47Å; H119-Y134 VanDerWaalsContact CE1-CE1 3.47Å; H119-Y134 WeakPolarHBondContact CE1-CE1 3.4Å; H119-Y134 AromaticContact CE1-CZ 3.84Å; H119-K246 HydrophobicContact CB-CG 4.2Å; H119-G247 VanDerWaalsContact CB-CA 3.45Å
120	P	95.7	Very high	95.1	Very high	31 Å²	31	32.7 Å²	32.7	20%	0.201	17%	0.171	C	C	.	.	H	α-helix	trans	-60	-48.8	174.5	-29.7	39.2	0	0	0	113.8	R115 Q116 I117 S123 K124 K246 R285	R115-P120 WeakPolarHBondContact O-CD 3.47Å; Q116-P120 WeakPolarHBondContact O-CG 3.36Å; I117-P120 WeakPolarHBondContact O-CD 3.34Å; P120-S123 PolarHBondContact O-N 2.94Å; P120-K124 WeakPolarHBondContact O-CB 3.43Å; P120-K124 PolarHBondContact O-N 2.76Å; P120-K246 WeakPolarHBondContact CG-O 3.43Å; P120-R285 VanDerWaalsContact CG-NH2 3.35Å
121	E	95.6	Very high	94.9	Very high	15 Å²	15	39.6 Å²	39.6	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-67.4	-45.5	-175.2	-168.7	-177.5	150.8	0	0	111.7	L30 L81 I117 S123 K124 K125	L30-E121 WeakPolarHBondContact CB-OE2 3.47Å; L30-E121 PolarHBondContact N-OE2 2.95Å; L81-E121 HydrophobicContact CD2-CB 4.29Å; L81-E121 HydrophobicContact CD2-CG 3.89Å; I117-E121 WeakPolarHBondContact O-CB 3.29Å; I117-E121 PolarHBondContact O-N 3Å; E121-S123 VanDerWaalsContact C-N 3.26Å; E121-S123 PolarHBondContact O-N 2.64Å; E121-K124 PolarHBondContact O-N 2.98Å; E121-K124 VanDerWaalsContact O-N 3.15Å; E121-K125 HydrophobicContact CG-CD 4.08Å; E121-K125 WeakPolarHBondContact O-CB 3.32Å; E121-K125 PolarHBondContact O-N 2.71Å; E121-K125 WeakPolarHBondContact OE1-CE 3.47Å; E121-K125 IonicContact OE1-NZ 2.66Å; E121-K125 PolarHBondContact OE1-NZ 3.21Å
122	A	95.6	Very high	94.7	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-39.7	175.9	0	0	0	0	0	111.3	L81 L118 K125 N126 V127 L129	L81-A122 HydrophobicContact CD2-CB 4.34Å; L118-A122 WeakPolarHBondContact O-CB 3.46Å; L118-A122 PolarHBondContact O-N 3.34Å; A122-K125 PolarHBondContact O-N 2.97Å; A122-N126 CarbonylContact O-C 3.54Å; A122-N126 PolarHBondContact O-N 3.48Å; A122-V127 HydrophobicContact CB-CB 4.24Å; A122-V127 PolarHBondContact O-N 3.18Å; A122-L129 HydrophobicContact CB-CD1 3.95Å; A122-L129 HydrophobicContact CB-CD2 3.8Å; A122-L129 HydrophobicContact CB-CG 3.54Å
123	S	93.9	Very high	94.7	Very high	23 Å²	23	38.7 Å²	38.7	16%	0.161	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-41.1	175.2	-179.8	0	0	0	0	112.9	H119 P120 E121 N126 R243	H119-S123 VanDerWaalsContact O-CB 3.24Å; H119-S123 WeakPolarHBondContact O-CB 3.39Å; H119-S123 PolarHBondContact O-N 2.78Å; H119-S123 VanDerWaalsContact O-N 3.13Å; P120-S123 PolarHBondContact O-N 2.94Å; E121-S123 VanDerWaalsContact C-N 3.26Å; E121-S123 PolarHBondContact O-N 2.64Å; S123-N126 PolarHBondContact O-N 2.9Å; S123-R243 WeakPolarHBondContact OG-CG 3.21Å
124	K	92.9	Very high	94.6	Very high	131 Å²	131	39.8 Å²	39.8	57%	0.57	20%	0.203	S	C	*	.	H	α-helix	trans	-65	-40.1	177.5	-173.4	177.2	178.5	179.2	0	111.6	P120 E121 N126	P120-K124 WeakPolarHBondContact O-CB 3.43Å; P120-K124 PolarHBondContact O-N 2.76Å; E121-K124 PolarHBondContact O-N 2.98Å; E121-K124 VanDerWaalsContact O-N 3.15Å; K124-N126 VanDerWaalsContact C-N 3.32Å
125	K	93.7	Very high	94.5	Very high	39 Å²	39	41.4 Å²	41.4	17%	0.17	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	0.8	178.9	-66.1	-177.9	176	173.9	0	114	E29 D56 L81 E121 A122 V127	E29-K125 WeakPolarHBondContact OE1-CE 3.47Å; E29-K125 IonicContact OE1-NZ 3.28Å; E29-K125 PolarHBondContact OE1-NZ 2.66Å; D56-K125 VanDerWaalsContact OD2-CE 3.31Å; D56-K125 WeakPolarHBondContact OD2-CE 3.43Å; L81-K125 HydrophobicContact CB-CD 4.22Å; L81-K125 HydrophobicContact CD2-CD 4.15Å; E121-K125 HydrophobicContact CG-CD 4.08Å; E121-K125 WeakPolarHBondContact O-CB 3.32Å; E121-K125 PolarHBondContact O-N 2.71Å; E121-K125 WeakPolarHBondContact OE1-CE 3.47Å; E121-K125 IonicContact OE1-NZ 2.66Å; E121-K125 PolarHBondContact OE1-NZ 3.21Å; A122-K125 PolarHBondContact O-N 2.97Å; K125-V127 HydrophobicContact CB-CG2 3.81Å; K125-V127 PolarHBondContact O-N 3.22Å
126	N	93.5	Very high	94.6	Very high	130 Å²	130	41.2 Å²	41.2	70%	0.695	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	35.9	-173.6	-59.5	-72.3	0	0	0	113.6	A122 S123 K124	A122-N126 CarbonylContact O-C 3.54Å; A122-N126 PolarHBondContact O-N 3.48Å; S123-N126 PolarHBondContact O-N 2.9Å; K124-N126 VanDerWaalsContact C-N 3.32Å
127	V	94.9	Very high	94.6	Very high	30 Å²	30	41 Å²	41	18%	0.182	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-91.2	132.1	175.4	179.2	0	0	0	0	109.2	D82 L85 A122 K125 L129	D82-V127 HydrophobicContact CB-CG1 3.78Å; D82-V127 HydrophobicContact CB-CG2 3.9Å; L85-V127 HydrophobicContact CD1-CG1 4.05Å; A122-V127 HydrophobicContact CB-CB 4.24Å; A122-V127 PolarHBondContact O-N 3.18Å; K125-V127 HydrophobicContact CB-CG2 3.81Å; K125-V127 PolarHBondContact O-N 3.22Å; V127-L129 PolarHBondContact O-N 3.44Å
128	L	92.4	Very high	94.7	Very high	162 Å²	162	41 Å²	41	85%	0.848	21%	0.213	S	C	*	.	P	Polyproline II helix	trans	-78.2	117	174.7	-66.1	175.7	0	0	0	109.8
129	L	93.6	Very high	94.7	Very high	19 Å²	19	40.8 Å²	40.8	10%	0.099	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-72.1	134.8	173.3	-78.3	174.9	0	0	0	111.1	L85 H119 A122 V127 F133 Y134	L85-L129 HydrophobicContact CD1-CD2 3.72Å; H119-L129 HydrophobicContact CB-CD1 4.37Å; A122-L129 HydrophobicContact CB-CD1 3.95Å; A122-L129 HydrophobicContact CB-CD2 3.8Å; A122-L129 HydrophobicContact CB-CG 3.54Å; V127-L129 PolarHBondContact O-N 3.44Å; L129-F133 HydrophobicContact CB-CB 4.37Å; L129-F133 HydrophobicContact CD1-CB 4.46Å; L129-F133 HydrophobicContact CD2-CB 4.43Å; L129-F133 HydrophobicContact CD2-CD2 4.41Å; L129-F133 HydrophobicContact CD2-CG 4.27Å; L129-Y134 HydrophobicContact CB-CE2 3.91Å
130	P	91.6	Very high	94.7	Very high	25 Å²	25	42.9 Å²	42.9	16%	0.162	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-59.3	154.8	170.6	-22	32.1	0	0	0	112.8	N89 C132 F133	N89-P130 WeakPolarHBondContact ND2-CB 2.99Å; N89-P130 WeakPolarHBondContact ND2-CG 3.46Å; P130-C132 PolarHBondContact O-N 2.93Å; P130-F133 HydrophobicContact CB-CD2 3.88Å; P130-F133 HydrophobicContact CB-CE2 4.13Å; P130-F133 HydrophobicContact CG-CD2 3.91Å; P130-F133 HydrophobicContact CG-CE2 3.83Å; P130-F133 PolarHBondContact O-N 2.92Å
131	E	90.2	Very high	94.7	Very high	152 Å²	152	43.2 Å²	43.2	71%	0.71	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-57.4	-35.3	-175.1	-157.7	-178.7	163.6	0	0	113.1	F133 Y134 Y208	E131-F133 PolarHBondContact O-N 3.36Å; E131-F133 VanDerWaalsContact O-N 3.07Å; E131-Y134 PolarHBondContact O-N 2.87Å; E131-Y208 HydrophobicContact CG-CE1 4.46Å; E131-Y208 WeakPolarHBondContact CG-OH 3.39Å
132	C	92	Very high	94.7	Very high	24 Å²	24	42.8 Å²	42.8	16%	0.162	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22	179	61.2	0	0	0	0	113.8	F104 L106 P130 Y134	F104-C132 HydrophobicContact CE2-CB 3.75Å; F104-C132 HydrophobicContact CZ-CB 3.83Å; L106-C132 VanDerWaalsContact CD1-O 3.24Å; L106-C132 WeakPolarHBondContact CD1-O 3.39Å; L106-C132 HydrophobicContact CG-CB 4.49Å; L106-C132 WeakPolarHBondContact CG-O 3.46Å; P130-C132 PolarHBondContact O-N 2.93Å; C132-Y134 VanDerWaalsContact C-N 3.27Å; C132-Y134 PolarHBondContact O-N 3.06Å
133	F	95.6	Very high	94.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-81.6	-0.4	178.4	-68.7	-85.6	0	0	0	114.3	L11 L85 F88 L106 I114 L118 H119 L129 P130 E131	L11-F133 HydrophobicContact CD2-CD1 4.34Å; L11-F133 HydrophobicContact CD2-CE1 3.67Å; L85-F133 HydrophobicContact CD2-CE1 4.31Å; L85-F133 HydrophobicContact CD2-CE2 4Å; L85-F133 HydrophobicContact CD2-CZ 3.67Å; F88-F133 AromaticContact CD1-CE2 3.9Å; F88-F133 HydrophobicContact CD1-CE2 3.9Å; F88-F133 AromaticContact CD1-CZ 3.72Å; F88-F133 HydrophobicContact CD1-CZ 3.72Å; F88-F133 AromaticContact CE1-CE2 3.75Å; F88-F133 HydrophobicContact CE1-CE2 3.75Å; F88-F133 AromaticContact CE1-CZ 3.59Å; F88-F133 HydrophobicContact CE1-CZ 3.59Å; F88-F133 HydrophobicContact CG-CZ 4.43Å; F88-F133 HydrophobicContact CZ-CZ 4.2Å; L106-F133 HydrophobicContact CD1-CB 4.47Å; L106-F133 HydrophobicContact CD1-CD1 3.57Å; L106-F133 HydrophobicContact CD1-CE1 3.89Å; L106-F133 HydrophobicContact CD1-CG 4.01Å; I114-F133 HydrophobicContact CD1-CD1 3.97Å; L118-F133 HydrophobicContact CD1-CD1 3.79Å; L118-F133 HydrophobicContact CD1-CE1 3.7Å; H119-F133 PolarHBondContact NE2-O 2.96Å; L129-F133 HydrophobicContact CB-CB 4.37Å; L129-F133 HydrophobicContact CD1-CB 4.46Å; L129-F133 HydrophobicContact CD2-CB 4.43Å; L129-F133 HydrophobicContact CD2-CD2 4.41Å; L129-F133 HydrophobicContact CD2-CG 4.27Å; P130-F133 HydrophobicContact CB-CD2 3.88Å; P130-F133 HydrophobicContact CB-CE2 4.13Å; P130-F133 HydrophobicContact CG-CD2 3.91Å; P130-F133 HydrophobicContact CG-CE2 3.83Å; P130-F133 PolarHBondContact O-N 2.92Å; E131-F133 PolarHBondContact O-N 3.36Å; E131-F133 VanDerWaalsContact O-N 3.07Å
134	Y	95.8	Very high	94.8	Very high	30 Å²	30	44 Å²	44	12%	0.118	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-100.3	-3	177.3	-67.3	-96.4	0	0	0	113	H119 L129 E131 C132 R205 V206 Y208	H119-Y134 AromaticContact CE1-CD1 3.65Å; H119-Y134 AromaticContact CE1-CE1 3.47Å; H119-Y134 VanDerWaalsContact CE1-CE1 3.47Å; H119-Y134 WeakPolarHBondContact CE1-CE1 3.4Å; H119-Y134 AromaticContact CE1-CZ 3.84Å; L129-Y134 HydrophobicContact CB-CE2 3.91Å; E131-Y134 PolarHBondContact O-N 2.87Å; C132-Y134 VanDerWaalsContact C-N 3.27Å; C132-Y134 PolarHBondContact O-N 3.06Å; Y134-R205 WeakPolarHBondContact O-CA 3.46Å; Y134-V206 HydrophobicContact CD1-CB 4.25Å; Y134-V206 HydrophobicContact CD1-CG1 4.5Å; Y134-V206 WeakPolarHBondContact CD1-O 3.5Å; Y134-V206 PolarHBondContact O-N 3.43Å; Y134-Y208 WeakPolarHBondContact CB-OH 3.49Å; Y134-Y208 AromaticContact CD1-CD1 3.61Å; Y134-Y208 HydrophobicContact CD1-CD1 3.61Å; Y134-Y208 HydrophobicContact CD1-CD2 4.36Å; Y134-Y208 AromaticContact CD1-CE1 3.61Å; Y134-Y208 HydrophobicContact CD1-CE1 3.61Å; Y134-Y208 HydrophobicContact CD1-CE2 4.37Å; Y134-Y208 AromaticContact CD1-CG 3.98Å; Y134-Y208 HydrophobicContact CD1-CG 3.98Å; Y134-Y208 AromaticContact CD1-CZ 3.99Å; Y134-Y208 HydrophobicContact CD2-CD1 4.04Å; Y134-Y208 AromaticContact CD2-CE1 3.36Å; Y134-Y208 HydrophobicContact CD2-CE1 3.36Å; Y134-Y208 AromaticContact CD2-CZ 3.89Å; Y134-Y208 AromaticContact CE1-CD1 3.51Å; Y134-Y208 HydrophobicContact CE1-CD1 3.51Å; Y134-Y208 AromaticContact CE1-CE1 3.87Å; Y134-Y208 HydrophobicContact CE1-CE1 3.87Å; Y134-Y208 HydrophobicContact CE1-CG 4.06Å; Y134-Y208 AromaticContact CE2-CD1 3.95Å; Y134-Y208 HydrophobicContact CE2-CD1 3.95Å; Y134-Y208 AromaticContact CE2-CE1 3.62Å; Y134-Y208 HydrophobicContact CE2-CE1 3.62Å; Y134-Y208 AromaticContact CG-CD1 3.87Å; Y134-Y208 HydrophobicContact CG-CD1 3.87Å; Y134-Y208 AromaticContact CG-CE1 3.35Å; Y134-Y208 HydrophobicContact CG-CE1 3.35Å; Y134-Y208 HydrophobicContact CG-CE2 4.25Å; Y134-Y208 HydrophobicContact CG-CG 4.5Å; Y134-Y208 AromaticContact CG-CZ 3.55Å; Y134-Y208 AromaticContact CZ-CD1 3.68Å; Y134-Y208 AromaticContact CZ-CE1 3.86Å
135	S	95.5	Very high	94.8	Very high	35 Å²	35	43.2 Å²	43.2	25%	0.245	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	122.5	177.3	-175.6	0	0	0	0	110	C105 P203 E204	C105-S135 PolarHBondContact SG-O 2.9Å; C105-S135 VanDerWaalsContact SG-O 3.39Å; S135-P203 WeakPolarHBondContact OG-CB 3.04Å; S135-P203 WeakPolarHBondContact OG-CG 3.49Å; S135-E204 CarbonylContact C-O 3.48Å; S135-E204 VanDerWaalsContact CA-O 3.29Å; S135-E204 WeakPolarHBondContact CA-O 3.22Å
136	F	97.6	Very high	94.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	157.1	-177.7	69.5	-81.4	0	0	0	112.1	L106 Q111 I114 R115 P203 E204 V206	L106-F136 HydrophobicContact CB-CB 3.9Å; L106-F136 CarbonylContact O-C 3.59Å; L106-F136 VanDerWaalsContact O-CA 3.28Å; L106-F136 WeakPolarHBondContact O-CA 3.45Å; Q111-F136 HydrophobicContact CB-CE2 3.98Å; Q111-F136 HydrophobicContact CB-CZ 3.94Å; I114-F136 HydrophobicContact CB-CD1 4.07Å; I114-F136 HydrophobicContact CB-CE1 4Å; I114-F136 HydrophobicContact CB-CG 4.42Å; I114-F136 HydrophobicContact CB-CZ 4.3Å; I114-F136 HydrophobicContact CG1-CB 4.24Å; I114-F136 HydrophobicContact CG1-CD1 3.91Å; I114-F136 HydrophobicContact CG1-CD2 4.11Å; I114-F136 HydrophobicContact CG1-CE1 4.3Å; I114-F136 HydrophobicContact CG1-CE2 4.5Å; I114-F136 HydrophobicContact CG1-CG 3.81Å; I114-F136 HydrophobicContact CG2-CD1 3.78Å; I114-F136 HydrophobicContact CG2-CE1 3.76Å; R115-F136 HydrophobicContact CG-CZ 4.29Å; F136-P203 CarbonylContact O-C 3.41Å; F136-P203 WeakPolarHBondContact O-CA 3.41Å; F136-P203 WeakPolarHBondContact O-CB 3.47Å; F136-E204 HydrophobicContact CD1-CB 4.17Å; F136-E204 HydrophobicContact CD2-CB 4.44Å; F136-E204 HydrophobicContact CE1-CB 3.76Å; F136-E204 HydrophobicContact CE2-CB 4.04Å; F136-E204 HydrophobicContact CE2-CG 4.44Å; F136-E204 HydrophobicContact CG-CB 4.49Å; F136-E204 HydrophobicContact CZ-CB 3.68Å; F136-E204 HydrophobicContact CZ-CG 4.32Å; F136-E204 WeakPolarHBondContact CZ-OE2 3.22Å; F136-E204 PolarHBondContact N-O 3.45Å; F136-E204 WeakPolarHBondContact O-CA 3.35Å; F136-E204 WeakPolarHBondContact O-CB 3.41Å; F136-E204 PolarHBondContact O-N 2.73Å; F136-V206 HydrophobicContact CE1-CG2 4.14Å
137	F	97.9	Very high	94.6	Very high	3 Å²	3	36.9 Å²	36.9	1%	0.013	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131	168.3	-71.5	-78.3	0	0	0	110.2	P5 L8 C105 L106 C107 T108 L139 E142 F200 P203	P5-F137 HydrophobicContact CG-CE2 4.04Å; L8-F137 HydrophobicContact CD2-CD2 3.74Å; L8-F137 HydrophobicContact CD2-CE2 4.1Å; C105-F137 HydrophobicContact CB-CD2 4Å; C105-F137 HydrophobicContact CB-CE2 3.79Å; L106-F137 PolarHBondContact O-N 3.38Å; C107-F137 WeakPolarHBondContact CA-O 3.33Å; C107-F137 HydrophobicContact CB-CB 4.39Å; T108-F137 PolarHBondContact N-O 3.37Å; F137-L139 PolarHBondContact O-N 2.66Å; F137-E142 HydrophobicContact CB-CG 4.22Å; F137-E142 HydrophobicContact CD1-CG 3.95Å; F137-E142 HydrophobicContact CG-CG 4.5Å; F137-F200 HydrophobicContact CB-CD1 4.22Å; F137-F200 HydrophobicContact CD1-CB 4.31Å; F137-F200 AromaticContact CD1-CD1 3.82Å; F137-F200 HydrophobicContact CD1-CD1 3.82Å; F137-F200 HydrophobicContact CD2-CB 4.3Å; F137-F200 HydrophobicContact CD2-CD1 4.19Å; F137-F200 HydrophobicContact CE1-CB 3.86Å; F137-F200 HydrophobicContact CE1-CD1 4.21Å; F137-F200 HydrophobicContact CE2-CB 3.86Å; F137-F200 AromaticContact CG-CD1 3.8Å; F137-F200 HydrophobicContact CG-CD1 3.8Å; F137-F200 HydrophobicContact CZ-CB 3.62Å; F137-P203 HydrophobicContact CD1-CB 4.27Å; F137-P203 HydrophobicContact CD2-CB 4.24Å; F137-P203 HydrophobicContact CE1-CB 3.95Å; F137-P203 HydrophobicContact CE2-CB 3.9Å; F137-P203 HydrophobicContact CE2-CG 4.49Å; F137-P203 HydrophobicContact CG-CB 4.42Å; F137-P203 HydrophobicContact CZ-CB 3.74Å; F137-P203 HydrophobicContact CZ-CG 4.12Å
138	D	97	Very high	94.2	Very high	6 Å²	6	40.1 Å²	40.1	3%	0.032	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	109.3	166.2	-178.4	-35.2	0	0	0	108.3	G110 Q111 R140 K141 E142 E204	G110-D138 WeakPolarHBondContact CA-OD1 3.34Å; G110-D138 WeakPolarHBondContact CA-OD2 3.48Å; Q111-D138 PolarHBondContact N-OD2 2.87Å; D138-R140 PolarHBondContact O-N 3.36Å; D138-R140 WeakPolarHBondContact OD1-CA 3.17Å; D138-R140 WeakPolarHBondContact OD1-CB 3.4Å; D138-R140 PolarHBondContact OD1-N 3.48Å; D138-K141 HydrophobicContact CB-CB 4.1Å; D138-K141 HydrophobicContact CB-CD 3.94Å; D138-K141 HydrophobicContact CB-CG 4.02Å; D138-K141 PolarHBondContact O-N 3.42Å; D138-K141 PolarHBondContact OD1-N 3.39Å; D138-E142 WeakPolarHBondContact O-CG 3.25Å; D138-E142 PolarHBondContact O-N 2.88Å; D138-E204 WeakPolarHBondContact CB-OE1 3.39Å
139	L	97.1	Very high	93.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-33.8	-175.8	-175	59.5	0	0	0	112.3	T108 F137 E142 F143 M161 M184 I187 I188 M191	T108-L139 WeakPolarHBondContact O-CB 3.03Å; T108-L139 PolarHBondContact O-N 3.24Å; F137-L139 PolarHBondContact O-N 2.66Å; L139-E142 PolarHBondContact O-N 3.33Å; L139-F143 WeakPolarHBondContact O-CB 3.34Å; L139-F143 PolarHBondContact O-N 2.82Å; L139-M161 HydrophobicContact CD2-CE 3.96Å; L139-M161 HydrophobicContact CG-CE 4.02Å; L139-M161 HydrophobicContact CG-SD 4.24Å; L139-M184 HydrophobicContact CB-CE 4.48Å; L139-M184 HydrophobicContact CD2-CB 3.96Å; L139-M184 HydrophobicContact CD2-CE 3.85Å; L139-M184 HydrophobicContact CD2-CG 3.76Å; L139-I187 HydrophobicContact CD1-CG2 4.26Å; L139-I187 HydrophobicContact CD2-CG2 4.35Å; L139-I188 HydrophobicContact CD1-CD1 4.4Å; L139-I188 HydrophobicContact CD1-CG1 3.74Å; L139-M191 HydrophobicContact CD1-SD 3.92Å
140	R	95.8	Very high	93.6	Very high	44 Å²	44	36.3 Å²	36.3	17%	0.166	21%	0.209	C	C	.	.	H	α-helix	trans	-68.3	-42.1	-179.8	-58	173.2	-177.4	-160	4.7	110.5	D109 D138 F143 K144 L156 M161	D109-R140 VanDerWaalsContact CG-NH2 3.33Å; D109-R140 IonicContact OD1-CZ 3.81Å; D109-R140 IonicContact OD1-NE 2.83Å; D109-R140 PolarHBondContact OD1-NE 2.73Å; D109-R140 IonicContact OD1-NH2 3.78Å; D109-R140 PolarHBondContact OD1-NH2 2.9Å; D109-R140 IonicContact OD2-CZ 2.89Å; D109-R140 IonicContact OD2-NE 3.8Å; D109-R140 IonicContact OD2-NH2 2.72Å; D109-R140 PolarHBondContact OD2-NH2 2.71Å; D138-R140 PolarHBondContact O-N 3.36Å; D138-R140 WeakPolarHBondContact OD1-CA 3.17Å; D138-R140 WeakPolarHBondContact OD1-CB 3.4Å; D138-R140 PolarHBondContact OD1-N 3.48Å; R140-F143 PolarHBondContact O-N 3.11Å; R140-K144 WeakPolarHBondContact O-CB 3.23Å; R140-K144 PolarHBondContact O-N 2.82Å; R140-L156 HydrophobicContact CB-CB 4.24Å; R140-L156 WeakPolarHBondContact CD-O 3.44Å; R140-L156 HydrophobicContact CG-CB 4.37Å; R140-L156 PolarHBondContact NE-O 3.32Å; R140-L156 PolarHBondContact NH1-O 2.85Å; R140-M161 HydrophobicContact CG-CE 4.25Å
141	K	95.8	Very high	93.5	Very high	38 Å²	38	37.7 Å²	37.7	17%	0.165	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-44	175.6	-66.1	-178.6	-172	171.5	0	111.3	D138 F143 K144 K145 I153 E204 E277	D138-K141 HydrophobicContact CB-CB 4.1Å; D138-K141 HydrophobicContact CB-CD 3.94Å; D138-K141 HydrophobicContact CB-CG 4.02Å; D138-K141 PolarHBondContact O-N 3.42Å; D138-K141 PolarHBondContact OD1-N 3.39Å; K141-F143 VanDerWaalsContact C-N 3.35Å; K141-K144 PolarHBondContact O-N 3.14Å; K141-K145 WeakPolarHBondContact O-CG 3.48Å; K141-K145 PolarHBondContact O-N 2.92Å; K141-I153 HydrophobicContact CG-CD1 4.47Å; K141-E204 WeakPolarHBondContact CD-OE1 3.31Å; K141-E204 WeakPolarHBondContact CE-OE1 2.91Å; K141-E204 IonicContact NZ-OE1 3.5Å; K141-E204 PolarHBondContact NZ-OE1 2.85Å; K141-E204 IonicContact NZ-OE2 3.98Å; K141-E277 WeakPolarHBondContact CE-OE1 3.35Å; K141-E277 IonicContact NZ-OE1 2.81Å; K141-E277 PolarHBondContact NZ-OE1 3.22Å; K141-E277 IonicContact NZ-OE2 3.79Å; K141-E277 PolarHBondContact NZ-OE2 2.85Å
142	E	96.3	Very high	93.5	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.028	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-40.2	177.4	-66.4	-60.5	119.2	0	0	111.5	F137 D138 L139 K145 C146 M191 H198 F200	F137-E142 HydrophobicContact CB-CG 4.22Å; F137-E142 HydrophobicContact CD1-CG 3.95Å; F137-E142 HydrophobicContact CG-CG 4.5Å; D138-E142 WeakPolarHBondContact O-CG 3.25Å; D138-E142 PolarHBondContact O-N 2.88Å; L139-E142 PolarHBondContact O-N 3.33Å; E142-K145 WeakPolarHBondContact O-CB 3.33Å; E142-K145 PolarHBondContact O-N 2.92Å; E142-K145 IonicContact OE1-NZ 3.81Å; E142-K145 PolarHBondContact OE1-NZ 3.31Å; E142-C146 WeakPolarHBondContact O-CB 3.39Å; E142-C146 PolarHBondContact O-N 2.85Å; E142-M191 VanDerWaalsContact C-CE 3.47Å; E142-M191 HydrophobicContact CB-CE 3.89Å; E142-M191 WeakPolarHBondContact O-CE 3.39Å; E142-H198 IonicContact OE2-CD2 2.74Å; E142-H198 IonicContact OE2-CE1 3.69Å; E142-H198 PolarHBondContact OE2-CE1 3.23Å; E142-H198 VanDerWaalsContact OE2-CE1 3.3Å; E142-H198 IonicContact OE2-NE2 2.81Å; E142-H198 PolarHBondContact OE2-NE2 3.33Å; E142-F200 HydrophobicContact CB-CD1 4.36Å; E142-F200 HydrophobicContact CB-CE1 3.81Å; E142-F200 HydrophobicContact CG-CD1 3.9Å; E142-F200 HydrophobicContact CG-CE1 3.79Å
143	F	95.9	Very high	93.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-43.2	174.4	-172.1	-94.3	0	0	0	111.9	L139 R140 K141 K145 C146 C147 L156 M161 L165 I187 M191	L139-F143 WeakPolarHBondContact O-CB 3.34Å; L139-F143 PolarHBondContact O-N 2.82Å; R140-F143 PolarHBondContact O-N 3.11Å; K141-F143 VanDerWaalsContact C-N 3.35Å; F143-K145 VanDerWaalsContact C-N 3.3Å; F143-K145 PolarHBondContact O-N 3.34Å; F143-C146 CarbonylContact O-C 3.49Å; F143-C146 WeakPolarHBondContact O-CB 3.43Å; F143-C146 PolarHBondContact O-N 2.92Å; F143-C146 VanDerWaalsContact O-N 3.16Å; F143-C147 HydrophobicContact CD1-CB 4.33Å; F143-C147 HydrophobicContact CE1-CB 3.98Å; F143-C147 HydrophobicContact CZ-CB 4.16Å; F143-C147 WeakPolarHBondContact O-CB 3.41Å; F143-C147 PolarHBondContact O-N 3.39Å; F143-L156 HydrophobicContact CD1-CD1 4.34Å; F143-L156 HydrophobicContact CD1-CD2 4.25Å; F143-L156 HydrophobicContact CE1-CD2 4.41Å; F143-M161 HydrophobicContact CB-CG 4.28Å; F143-M161 HydrophobicContact CB-SD 3.46Å; F143-M161 WeakPolarHBondContact CB-SD 3.35Å; F143-M161 HydrophobicContact CD1-CB 4.47Å; F143-M161 HydrophobicContact CD1-CG 3.68Å; F143-M161 HydrophobicContact CD1-SD 4.04Å; F143-M161 HydrophobicContact CD2-CB 4.3Å; F143-M161 HydrophobicContact CD2-CG 4.08Å; F143-M161 HydrophobicContact CD2-SD 3.98Å; F143-M161 HydrophobicContact CE1-CB 4.35Å; F143-M161 HydrophobicContact CE1-CG 3.95Å; F143-M161 HydrophobicContact CE2-CB 4.2Å; F143-M161 HydrophobicContact CE2-CG 4.35Å; F143-M161 HydrophobicContact CG-CB 4.44Å; F143-M161 HydrophobicContact CG-CG 3.74Å; F143-M161 HydrophobicContact CG-SD 3.56Å; F143-M161 VanDerWaalsContact CG-SD 3.56Å; F143-M161 HydrophobicContact CZ-CB 4.22Å; F143-M161 HydrophobicContact CZ-CG 4.28Å; F143-L165 HydrophobicContact CE2-CD1 3.9Å; F143-L165 HydrophobicContact CE2-CD2 3.96Å; F143-L165 HydrophobicContact CE2-CG 3.82Å; F143-L165 HydrophobicContact CZ-CD2 4.28Å; F143-L165 HydrophobicContact CZ-CG 4.12Å; F143-I187 HydrophobicContact CD2-CG2 3.96Å; F143-I187 HydrophobicContact CE2-CG2 4.35Å; F143-M191 HydrophobicContact CB-CE 4.49Å; F143-M191 HydrophobicContact CB-SD 4.29Å; F143-M191 HydrophobicContact CD2-CG 4.2Å; F143-M191 HydrophobicContact CD2-SD 3.92Å
144	K	94.9	Very high	93	Very high	49 Å²	49	43.3 Å²	43.3	21%	0.213	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-37.2	176.3	-174.7	59.6	169.4	-176.3	0	112.5	R140 K141 C147 P148 S150 P151 I153 L156	R140-K144 WeakPolarHBondContact O-CB 3.23Å; R140-K144 PolarHBondContact O-N 2.82Å; K141-K144 PolarHBondContact O-N 3.14Å; K144-C147 CarbonylContact O-C 3.56Å; K144-P148 PolarHBondContact NZ-O 3.46Å; K144-S150 WeakPolarHBondContact CD-OG 3.1Å; K144-S150 PolarHBondContact NZ-O 3.38Å; K144-P151 PolarHBondContact NZ-O 3.31Å; K144-I153 HydrophobicContact CB-CG1 4.12Å; K144-I153 HydrophobicContact CG-CD1 4.33Å; K144-I153 HydrophobicContact CG-CG1 3.96Å; K144-L156 HydrophobicContact CB-CD1 4.12Å; K144-L156 HydrophobicContact CD-CD1 4.48Å
145	K	93.4	Very high	92.6	Very high	115 Å²	115	48.2 Å²	48.2	50%	0.5	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-43.5	173.1	-69.5	171.2	-171.8	172.8	0	111.4	K141 E142 F143	K141-K145 WeakPolarHBondContact O-CG 3.48Å; K141-K145 PolarHBondContact O-N 2.92Å; E142-K145 WeakPolarHBondContact O-CB 3.33Å; E142-K145 PolarHBondContact O-N 2.92Å; E142-K145 IonicContact OE1-NZ 3.81Å; E142-K145 PolarHBondContact OE1-NZ 3.31Å; F143-K145 VanDerWaalsContact C-N 3.3Å; F143-K145 PolarHBondContact O-N 3.34Å
146	C	91.8	Very high	92.4	Very high	22 Å²	22	46.6 Å²	46.6	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-69.4	-37.8	179.8	178.9	0	0	0	0	112.8	E142 F143 M191 Y196 H198	E142-C146 WeakPolarHBondContact O-CB 3.39Å; E142-C146 PolarHBondContact O-N 2.85Å; F143-C146 CarbonylContact O-C 3.49Å; F143-C146 WeakPolarHBondContact O-CB 3.43Å; F143-C146 PolarHBondContact O-N 2.92Å; F143-C146 VanDerWaalsContact O-N 3.16Å; C146-M191 HydrophobicContact CB-CE 3.9Å; C146-Y196 VanDerWaalsContact SG-CB 3.51Å; C146-H198 HydrophobicContact CB-CB 4.31Å
147	C	90.4	Very high	92.2	Very high	14 Å²	14	49.9 Å²	49.9	10%	0.095	28%	0.279	C	S	.	.			trans	-128.3	78.6	-172.9	-60.6	0	0	0	0	110.3	F143 K144 G149 S150 Y196	F143-C147 HydrophobicContact CD1-CB 4.33Å; F143-C147 HydrophobicContact CE1-CB 3.98Å; F143-C147 HydrophobicContact CZ-CB 4.16Å; F143-C147 WeakPolarHBondContact O-CB 3.41Å; F143-C147 PolarHBondContact O-N 3.39Å; K144-C147 CarbonylContact O-C 3.56Å; C147-G149 PolarHBondContact O-N 3.29Å; C147-G149 VanDerWaalsContact O-N 3.13Å; C147-S150 VanDerWaalsContact O-CB 3.25Å; C147-S150 WeakPolarHBondContact O-CB 3.37Å; C147-S150 PolarHBondContact O-N 3.35Å; C147-S150 PolarHBondContact O-OG 2.81Å; C147-Y196 WeakPolarHBondContact SG-CE1 3.43Å
148	P	86.8	Confident	91.9	Very high	98 Å²	98	50.1 Å²	50.1	64%	0.636	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.3	-174.3	-26.9	35.5	0	0	0	114.6	K144 S150	K144-P148 PolarHBondContact NZ-O 3.46Å; P148-S150 VanDerWaalsContact C-N 3.25Å; P148-S150 PolarHBondContact O-N 3.44Å
149	G	85.4	Confident	91.6	Very high	87 Å²	87	52.5 Å²	52.5	90%	0.897	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-2.1	178.2	0	0	0	0	0	115.5	C147	C147-G149 PolarHBondContact O-N 3.29Å; C147-G149 VanDerWaalsContact O-N 3.13Å
150	S	89.4	Confident	91.3	Very high	15 Å²	15	53.3 Å²	53.3	11%	0.105	31%	0.308	C	S	.	.	S	Bend	trans	-66.8	167.5	172.8	62	0	0	0	0	111.9	K144 C147 P148	K144-S150 WeakPolarHBondContact CD-OG 3.1Å; K144-S150 PolarHBondContact NZ-O 3.38Å; C147-S150 VanDerWaalsContact O-CB 3.25Å; C147-S150 WeakPolarHBondContact O-CB 3.37Å; C147-S150 PolarHBondContact O-N 3.35Å; C147-S150 PolarHBondContact O-OG 2.81Å; P148-S150 VanDerWaalsContact C-N 3.25Å; P148-S150 PolarHBondContact O-N 3.44Å
151	P	89.6	Confident	91.2	Very high	54 Å²	54	51.2 Å²	51.2	35%	0.351	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-53	168.7	173.1	-27.2	35.5	0	0	0	114.3	K144 K155 L156	K144-P151 PolarHBondContact NZ-O 3.31Å; P151-K155 HydrophobicContact CB-CB 4.18Å; P151-L156 HydrophobicContact CB-CD2 4.29Å; P151-L156 HydrophobicContact CB-CG 4.47Å; P151-L156 HydrophobicContact CG-CD2 4.34Å
152	D	90.1	Very high	91	Very high	91 Å²	91	49.8 Å²	49.8	49%	0.487	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-64.4	153.6	171.9	-62.3	-42.9	0	0	0	111	D154 K155 L156	D152-D154 WeakPolarHBondContact CB-OD1 3.18Å; D152-D154 PolarHBondContact O-N 3.38Å; D152-K155 PolarHBondContact O-N 3.29Å; D152-L156 PolarHBondContact O-N 2.72Å
153	I	89.1	Confident	90.7	Very high	79 Å²	79	56.8 Å²	56.8	41%	0.405	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-58.3	-34.6	-171.8	-67.6	172	0	0	0	112.3	K141 K144 K155 L156	K141-I153 HydrophobicContact CG-CD1 4.47Å; K144-I153 HydrophobicContact CB-CG1 4.12Å; K144-I153 HydrophobicContact CG-CD1 4.33Å; K144-I153 HydrophobicContact CG-CG1 3.96Å; I153-K155 PolarHBondContact O-N 3.28Å; I153-L156 PolarHBondContact O-N 2.79Å
154	D	86.6	Confident	90.3	Very high	124 Å²	124	59.2 Å²	59.2	66%	0.663	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-66.4	-21.5	177.7	61.3	-50.2	0	0	0	113.6	D152	D152-D154 WeakPolarHBondContact CB-OD1 3.18Å; D152-D154 PolarHBondContact O-N 3.38Å
155	K	88.8	Confident	90	Very high	133 Å²	133	58 Å²	58	58%	0.578	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-104.5	-4.6	179	-61.5	173.6	-170.6	160	0	113	P151 D152 I153	P151-K155 HydrophobicContact CB-CB 4.18Å; D152-K155 PolarHBondContact O-N 3.29Å; I153-K155 PolarHBondContact O-N 3.28Å
156	L	91.7	Very high	89.5	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	35%	0.353	C	S	.	.			trans	-81.3	127.8	175.1	-76.6	175.2	0	0	0	109.9	R140 F143 K144 P151 D152 I153 A160 M161	R140-L156 HydrophobicContact CB-CB 4.24Å; R140-L156 WeakPolarHBondContact CD-O 3.44Å; R140-L156 HydrophobicContact CG-CB 4.37Å; R140-L156 PolarHBondContact NE-O 3.32Å; R140-L156 PolarHBondContact NH1-O 2.85Å; F143-L156 HydrophobicContact CD1-CD1 4.34Å; F143-L156 HydrophobicContact CD1-CD2 4.25Å; F143-L156 HydrophobicContact CE1-CD2 4.41Å; K144-L156 HydrophobicContact CB-CD1 4.12Å; K144-L156 HydrophobicContact CD-CD1 4.48Å; P151-L156 HydrophobicContact CB-CD2 4.29Å; P151-L156 HydrophobicContact CB-CG 4.47Å; P151-L156 HydrophobicContact CG-CD2 4.34Å; D152-L156 PolarHBondContact O-N 2.72Å; I153-L156 PolarHBondContact O-N 2.79Å; L156-A160 HydrophobicContact CD2-CB 4.5Å; L156-M161 HydrophobicContact CD2-CG 4.1Å
157	D	91.8	Very high	89	Confident	69 Å²	69	62.3 Å²	62.3	37%	0.369	36%	0.363	S	S	.	.			trans	-138.1	178.6	164	64.9	18	0	0	0	109.1	A159 A160 M161	D157-A159 PolarHBondContact O-N 2.73Å; D157-A159 WeakPolarHBondContact OD1-CB 3.43Å; D157-A159 PolarHBondContact OD1-N 2.85Å; D157-A159 VanDerWaalsContact OD1-N 3.08Å; D157-A160 PolarHBondContact O-N 2.68Å; D157-A160 WeakPolarHBondContact OD1-CB 3.4Å; D157-A160 PolarHBondContact OD1-N 3.08Å; D157-M161 WeakPolarHBondContact O-CG 3.48Å; D157-M161 PolarHBondContact O-N 3.3Å
158	V	92.2	Very high	87.9	Confident	8 Å²	8	70.7 Å²	70.7	5%	0.048	40%	0.401	C	S	.	.	H	α-helix	trans	-55.7	-41.2	179.9	-178.4	0	0	0	0	111.5	D109 M161 T162 D183 M184 I187	D109-V158 HydrophobicContact CB-CG2 3.86Å; D109-V158 VanDerWaalsContact CG-CG2 3.44Å; V158-M161 HydrophobicContact CG2-CE 4.38Å; V158-M161 PolarHBondContact O-N 3.19Å; V158-T162 WeakPolarHBondContact O-CB 3.41Å; V158-T162 PolarHBondContact O-N 3.41Å; V158-T162 PolarHBondContact O-OG1 3.3Å; V158-D183 HydrophobicContact CG1-CB 3.5Å; V158-D183 VanDerWaalsContact CG1-CB 3.5Å; V158-M184 HydrophobicContact CG1-CG 4.29Å; V158-M184 HydrophobicContact CG2-CG 3.78Å; V158-M184 HydrophobicContact CG2-SD 4.34Å; V158-I187 HydrophobicContact CG1-CD1 4.01Å
159	A	90.4	Very high	86.8	Confident	56 Å²	56	74.6 Å²	74.6	46%	0.463	41%	0.408	S	S	.	.	H	α-helix	trans	-66.2	-44.7	-178.6	0	0	0	0	0	112	D157 M161 T162 E163	D157-A159 PolarHBondContact O-N 2.73Å; D157-A159 WeakPolarHBondContact OD1-CB 3.43Å; D157-A159 PolarHBondContact OD1-N 2.85Å; D157-A159 VanDerWaalsContact OD1-N 3.08Å; A159-M161 VanDerWaalsContact C-N 3.33Å; A159-M161 PolarHBondContact O-N 3.32Å; A159-T162 PolarHBondContact O-N 3.15Å; A159-E163 WeakPolarHBondContact O-CB 3.49Å; A159-E163 PolarHBondContact O-N 3.19Å
160	A	91.4	Very high	85.4	Confident	17 Å²	17	74.9 Å²	74.9	14%	0.14	40%	0.396	C	S	.	.	H	α-helix	trans	-64.9	-35.9	177.4	0	0	0	0	0	112.3	L156 D157 S164	L156-A160 HydrophobicContact CD2-CB 4.5Å; D157-A160 PolarHBondContact O-N 2.68Å; D157-A160 WeakPolarHBondContact OD1-CB 3.4Å; D157-A160 PolarHBondContact OD1-N 3.08Å; A160-S164 WeakPolarHBondContact O-CB 3.32Å; A160-S164 PolarHBondContact O-N 2.8Å; A160-S164 PolarHBondContact O-OG 3.17Å
161	M	93.7	Very high	83.7	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-67.6	-44.9	174.7	-70.4	-172.9	-70.5	0	0	111.5	L139 R140 F143 L156 D157 V158 A159 E163 S164 L165 I187	L139-M161 HydrophobicContact CD2-CE 3.96Å; L139-M161 HydrophobicContact CG-CE 4.02Å; L139-M161 HydrophobicContact CG-SD 4.24Å; R140-M161 HydrophobicContact CG-CE 4.25Å; F143-M161 HydrophobicContact CB-CG 4.28Å; F143-M161 HydrophobicContact CB-SD 3.46Å; F143-M161 WeakPolarHBondContact CB-SD 3.35Å; F143-M161 HydrophobicContact CD1-CB 4.47Å; F143-M161 HydrophobicContact CD1-CG 3.68Å; F143-M161 HydrophobicContact CD1-SD 4.04Å; F143-M161 HydrophobicContact CD2-CB 4.3Å; F143-M161 HydrophobicContact CD2-CG 4.08Å; F143-M161 HydrophobicContact CD2-SD 3.98Å; F143-M161 HydrophobicContact CE1-CB 4.35Å; F143-M161 HydrophobicContact CE1-CG 3.95Å; F143-M161 HydrophobicContact CE2-CB 4.2Å; F143-M161 HydrophobicContact CE2-CG 4.35Å; F143-M161 HydrophobicContact CG-CB 4.44Å; F143-M161 HydrophobicContact CG-CG 3.74Å; F143-M161 HydrophobicContact CG-SD 3.56Å; F143-M161 VanDerWaalsContact CG-SD 3.56Å; F143-M161 HydrophobicContact CZ-CB 4.22Å; F143-M161 HydrophobicContact CZ-CG 4.28Å; L156-M161 HydrophobicContact CD2-CG 4.1Å; D157-M161 WeakPolarHBondContact O-CG 3.48Å; D157-M161 PolarHBondContact O-N 3.3Å; V158-M161 HydrophobicContact CG2-CE 4.38Å; V158-M161 PolarHBondContact O-N 3.19Å; A159-M161 VanDerWaalsContact C-N 3.33Å; A159-M161 PolarHBondContact O-N 3.32Å; M161-E163 PolarHBondContact O-N 2.94Å; M161-S164 PolarHBondContact O-N 3.18Å; M161-L165 WeakPolarHBondContact O-CG 3.43Å; M161-L165 PolarHBondContact O-N 2.98Å; M161-L165 VanDerWaalsContact O-N 3.08Å; M161-I187 HydrophobicContact CB-CD1 3.7Å; M161-I187 HydrophobicContact CB-CG1 4.33Å; M161-I187 HydrophobicContact CE-CD1 4.22Å
162	T	91.6	Very high	82.1	Confident	8 Å²	8	82.8 Å²	82.8	5%	0.049	44%	0.439	C	S	.	.	H	α-helix	trans	-60.9	-42.5	176.1	-62.3	0	0	0	0	111.7	V158 A159 L165 N166 F167	V158-T162 WeakPolarHBondContact O-CB 3.41Å; V158-T162 PolarHBondContact O-N 3.41Å; V158-T162 PolarHBondContact O-OG1 3.3Å; A159-T162 PolarHBondContact O-N 3.15Å; T162-L165 PolarHBondContact O-N 3.41Å; T162-N166 PolarHBondContact O-N 2.88Å; T162-F167 HydrophobicContact CG2-CB 3.56Å; T162-F167 HydrophobicContact CG2-CD2 4.09Å; T162-F167 HydrophobicContact CG2-CG 4.35Å; T162-F167 PolarHBondContact O-N 3.41Å; T162-F167 VanDerWaalsContact O-N 3.15Å
163	E	90.2	Very high	80.4	Confident	153 Å²	153	85.5 Å²	85.5	72%	0.715	46%	0.459	S	S	*	.	H	α-helix	trans	-63.4	-43.9	174.6	-175.7	175.3	-167.4	0	0	111.6	A159 M161 L165 N166	A159-E163 WeakPolarHBondContact O-CB 3.49Å; A159-E163 PolarHBondContact O-N 3.19Å; M161-E163 PolarHBondContact O-N 2.94Å; E163-L165 PolarHBondContact O-N 2.86Å; E163-N166 PolarHBondContact O-N 2.83Å
164	S	87.3	Confident	79.1	Confident	50 Å²	50	84.1 Å²	84.1	35%	0.35	46%	0.456	S	S	.	.	H	α-helix	trans	-62.4	-27.5	177.6	-61.2	0	0	0	0	113.1	A160 M161	A160-S164 WeakPolarHBondContact O-CB 3.32Å; A160-S164 PolarHBondContact O-N 2.8Å; A160-S164 PolarHBondContact O-OG 3.17Å; M161-S164 PolarHBondContact O-N 3.18Å
165	L	87.4	Confident	78.6	Confident	25 Å²	25	86 Å²	86	13%	0.131	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-1.2	176.7	-66.9	177.2	0	0	0	113.6	F143 M161 T162 E163 F167 I187 A190 Y196	F143-L165 HydrophobicContact CE2-CD1 3.9Å; F143-L165 HydrophobicContact CE2-CD2 3.96Å; F143-L165 HydrophobicContact CE2-CG 3.82Å; F143-L165 HydrophobicContact CZ-CD2 4.28Å; F143-L165 HydrophobicContact CZ-CG 4.12Å; M161-L165 WeakPolarHBondContact O-CG 3.43Å; M161-L165 PolarHBondContact O-N 2.98Å; M161-L165 VanDerWaalsContact O-N 3.08Å; T162-L165 PolarHBondContact O-N 3.41Å; E163-L165 PolarHBondContact O-N 2.86Å; L165-F167 VanDerWaalsContact C-N 3.32Å; L165-F167 HydrophobicContact CB-CD2 3.94Å; L165-F167 HydrophobicContact CB-CE2 4Å; L165-F167 HydrophobicContact CB-CG 4.47Å; L165-F167 HydrophobicContact CD1-CD2 4.22Å; L165-F167 HydrophobicContact CD1-CE2 3.62Å; L165-F167 HydrophobicContact CD1-CZ 4.33Å; L165-F167 HydrophobicContact CG-CE2 4.5Å; L165-F167 PolarHBondContact O-N 3.24Å; L165-I187 HydrophobicContact CD1-CB 4.28Å; L165-I187 HydrophobicContact CD1-CG1 4.02Å; L165-I187 HydrophobicContact CD1-CG2 4.17Å; L165-A190 HydrophobicContact CD1-CB 3.86Å; L165-A190 HydrophobicContact CD2-CB 4.49Å; L165-Y196 HydrophobicContact CD2-CE2 3.76Å
166	N	83.7	Confident	78	Confident	145 Å²	145	82.8 Å²	82.8	78%	0.775	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	38.1	-175.7	-55.6	-70.8	0	0	0	114	T162 E163	T162-N166 PolarHBondContact O-N 2.88Å; E163-N166 PolarHBondContact O-N 2.83Å
167	F	81.1	Confident	77.6	Confident	81 Å²	81	82.7 Å²	82.7	36%	0.355	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-76.5	133.1	172.3	-74.1	-43.9	0	0	0	111.2	T162 L165 K169 N186 I187 A190	T162-F167 HydrophobicContact CG2-CB 3.56Å; T162-F167 HydrophobicContact CG2-CD2 4.09Å; T162-F167 HydrophobicContact CG2-CG 4.35Å; T162-F167 PolarHBondContact O-N 3.41Å; T162-F167 VanDerWaalsContact O-N 3.15Å; L165-F167 VanDerWaalsContact C-N 3.32Å; L165-F167 HydrophobicContact CB-CD2 3.94Å; L165-F167 HydrophobicContact CB-CE2 4Å; L165-F167 HydrophobicContact CB-CG 4.47Å; L165-F167 HydrophobicContact CD1-CD2 4.22Å; L165-F167 HydrophobicContact CD1-CE2 3.62Å; L165-F167 HydrophobicContact CD1-CZ 4.33Å; L165-F167 HydrophobicContact CG-CE2 4.5Å; L165-F167 PolarHBondContact O-N 3.24Å; F167-K169 PolarHBondContact O-N 3.32Å; F167-N186 HydrophobicContact CE2-CB 4.12Å; F167-N186 HydrophobicContact CZ-CB 4.25Å; F167-I187 HydrophobicContact CE2-CG1 4.4Å; F167-A190 HydrophobicContact CE2-CB 4.36Å; F167-A190 HydrophobicContact CZ-CB 3.84Å
168	E	68.3	Low	77.5	Confident	191 Å²	191	79.9 Å²	79.9	89%	0.893	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-67.2	129.3	170.8	-67	-168.8	165.4	0	0	109.6	S170	E168-S170 PolarHBondContact O-N 3.46Å
169	K	63.1	Low	77.4	Confident	179 Å²	179	81.5 Å²	81.5	78%	0.778	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-63.4	120.9	173.4	-75.6	-176.8	177.7	178.1	0	108.8	F167 D171	F167-K169 PolarHBondContact O-N 3.32Å; K169-D171 PolarHBondContact O-N 3.29Å
170	S	56.2	Low	77.4	Confident	93 Å²	93	80.8 Å²	80.8	65%	0.65	42%	0.423	S	S	*	.			trans	-69.2	111.1	167.8	-178.9	0	0	0	0	108.6	E168 S172	E168-S170 PolarHBondContact O-N 3.46Å; S170-S172 PolarHBondContact O-N 3.29Å; S170-S172 PolarHBondContact OG-OG 2.99Å; S170-S172 VanDerWaalsContact OG-OG 3.1Å
171	D	52.4	Low	77.6	Confident	167 Å²	167	80 Å²	80	89%	0.893	42%	0.417	S	S	*	.			trans	-67.2	16.7	174.1	-91	-14.9	0	0	0	113.6	K169 V173	K169-D171 PolarHBondContact O-N 3.29Å; D171-V173 PolarHBondContact O-N 3.44Å
172	S	56.8	Low	77.6	Confident	68 Å²	68	82.8 Å²	82.8	48%	0.476	43%	0.43	S	S	.	.			trans	-70.2	130.2	174.5	63.1	0	0	0	0	110	S170 S174	S170-S172 PolarHBondContact O-N 3.29Å; S170-S172 PolarHBondContact OG-OG 2.99Å; S170-S172 VanDerWaalsContact OG-OG 3.1Å; S172-S174 PolarHBondContact O-N 3.19Å; S172-S174 PolarHBondContact OG-OG 3.13Å
173	V	55.5	Low	77.7	Confident	148 Å²	148	84.8 Å²	84.8	90%	0.897	44%	0.44	S	S	*	.			trans	-69.6	74.8	171.9	-174.9	0	0	0	0	108.4	D171	D171-V173 PolarHBondContact O-N 3.44Å
174	S	61.8	Low	77.9	Confident	50 Å²	50	77.5 Å²	77.5	35%	0.35	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-79.5	143	175.3	-69.1	0	0	0	0	109.2	S172	S172-S174 PolarHBondContact O-N 3.19Å; S172-S174 PolarHBondContact OG-OG 3.13Å
175	R	74.5	Confident	78.4	Confident	165 Å²	165	75.1 Å²	75.1	62%	0.623	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-59.1	142.6	175.4	-71.5	-176.6	-76.7	164.4	3.3	109.6	E50 G177 A178	E50-R175 IonicContact OE1-CZ 2.67Å; E50-R175 IonicContact OE1-NH1 2.84Å; E50-R175 PolarHBondContact OE1-NH1 3.2Å; E50-R175 IonicContact OE1-NH2 3.92Å; E50-R175 PolarHBondContact OE1-NH2 2.95Å; E50-R175 IonicContact OE2-CZ 3.44Å; E50-R175 VanDerWaalsContact OE2-CZ 3.28Å; E50-R175 IonicContact OE2-NE 2.72Å; E50-R175 IonicContact OE2-NH1 2.62Å; E50-R175 PolarHBondContact OE2-NH1 3.42Å; E50-R175 IonicContact OE2-NH2 3.05Å; E50-R175 PolarHBondContact OE2-NH2 3.01Å; R175-G177 PolarHBondContact O-N 2.91Å; R175-A178 WeakPolarHBondContact O-CB 3.26Å; R175-A178 PolarHBondContact O-N 3.16Å
176	Y	75.8	Confident	78.7	Confident	64 Å²	64	76.9 Å²	76.9	25%	0.251	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	129.8	-178.5	-177.2	-92.9	0	0	0	110.5	I14 E67 T68	I14-Y176 HydrophobicContact CD1-CD1 3.56Å; I14-Y176 HydrophobicContact CD1-CE1 3.87Å; I14-Y176 HydrophobicContact CG2-CE1 4.27Å; E67-Y176 HydrophobicContact CB-CD2 4.4Å; E67-Y176 HydrophobicContact CB-CE2 4.09Å; E67-Y176 WeakPolarHBondContact O-CB 3.32Å; E67-Y176 VanDerWaalsContact OE2-CZ 3.27Å; E67-Y176 PolarHBondContact OE2-OH 2.86Å; T68-Y176 HydrophobicContact CG2-CD1 3.86Å; T68-Y176 HydrophobicContact CG2-CE1 4.11Å
177	G	83.8	Confident	79.3	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	-36.5	-170.6	0	0	0	0	0	113.8	R175 Q180 V181	R175-G177 PolarHBondContact O-N 2.91Å; G177-Q180 PolarHBondContact O-N 2.65Å; G177-Q180 PolarHBondContact O-OE1 3.39Å; G177-V181 WeakPolarHBondContact O-CG2 3.44Å; G177-V181 PolarHBondContact O-N 3.46Å; G177-V181 VanDerWaalsContact O-N 3.16Å
178	A	89.6	Confident	80	Confident	9 Å²	9	66.1 Å²	66.1	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-67.7	-44.5	-177.5	0	0	0	0	0	111.8	L34 L48 R175 Q180 V181 E182	L34-A178 HydrophobicContact CD2-CB 4.27Å; L48-A178 HydrophobicContact CD2-CB 3.59Å; R175-A178 WeakPolarHBondContact O-CB 3.26Å; R175-A178 PolarHBondContact O-N 3.16Å; A178-Q180 VanDerWaalsContact C-N 3.27Å; A178-Q180 PolarHBondContact O-N 3.22Å; A178-V181 PolarHBondContact O-N 3.31Å; A178-E182 WeakPolarHBondContact O-CG 3.38Å; A178-E182 PolarHBondContact O-N 2.88Å
179	S	89.8	Confident	81.3	Confident	43 Å²	43	58.8 Å²	58.8	30%	0.301	31%	0.312	S	S	.	.	H	α-helix	trans	-61.7	-37.4	176.5	56.6	0	0	0	0	111.8	E182 D183	S179-E182 PolarHBondContact O-N 2.86Å; S179-D183 WeakPolarHBondContact O-CB 3.32Å; S179-D183 PolarHBondContact O-N 2.95Å
180	Q	91.8	Very high	82.8	Confident	41 Å²	41	51.3 Å²	51.3	19%	0.192	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-44.8	176.8	-67.7	81	-6.1	0	0	111.3	F12 G177 A178 D183 M184	F12-Q180 HydrophobicContact CD2-CB 4.18Å; F12-Q180 HydrophobicContact CE2-CB 3.98Å; F12-Q180 HydrophobicContact CE2-CG 4.18Å; F12-Q180 HydrophobicContact CZ-CB 4.17Å; F12-Q180 HydrophobicContact CZ-CG 4.04Å; G177-Q180 PolarHBondContact O-N 2.65Å; G177-Q180 PolarHBondContact O-OE1 3.39Å; A178-Q180 VanDerWaalsContact C-N 3.27Å; A178-Q180 PolarHBondContact O-N 3.22Å; Q180-D183 PolarHBondContact O-N 2.87Å; Q180-M184 WeakPolarHBondContact O-CB 3.43Å; Q180-M184 WeakPolarHBondContact O-CG 3.42Å; Q180-M184 PolarHBondContact O-N 2.92Å
181	V	94.9	Very high	84.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-39.3	177.9	179.2	0	0	0	0	111.8	V10 F12 L34 K36 L48 G177 A178 G185	V10-V181 HydrophobicContact CB-CG1 4.4Å; V10-V181 HydrophobicContact CG1-CG1 3.89Å; F12-V181 HydrophobicContact CB-CG2 3.49Å; F12-V181 VanDerWaalsContact CB-CG2 3.49Å; F12-V181 HydrophobicContact CG-CG2 4.29Å; L34-V181 HydrophobicContact CB-CG2 3.72Å; K36-V181 HydrophobicContact CB-CG1 3.5Å; K36-V181 VanDerWaalsContact CB-CG1 3.5Å; K36-V181 HydrophobicContact CD-CG1 4.3Å; L48-V181 HydrophobicContact CD1-CB 3.78Å; L48-V181 HydrophobicContact CD1-CG1 3.54Å; L48-V181 HydrophobicContact CD1-CG2 4.31Å; G177-V181 WeakPolarHBondContact O-CG2 3.44Å; G177-V181 PolarHBondContact O-N 3.46Å; G177-V181 VanDerWaalsContact O-N 3.16Å; A178-V181 PolarHBondContact O-N 3.31Å; V181-G185 PolarHBondContact O-N 2.9Å
182	E	93.1	Very high	86.7	Confident	59 Å²	59	39.7 Å²	39.7	28%	0.276	21%	0.214	S	C	.	.	H	α-helix	trans	-61.7	-50.8	174.4	-70.7	-61.3	154	0	0	111.7	K36 A178 S179 M184 G185 N186	K36-E182 IonicContact NZ-OE1 2.92Å; K36-E182 PolarHBondContact NZ-OE1 3.45Å; K36-E182 IonicContact NZ-OE2 3.98Å; K36-E182 PolarHBondContact NZ-OE2 3.44Å; A178-E182 WeakPolarHBondContact O-CG 3.38Å; A178-E182 PolarHBondContact O-N 2.88Å; S179-E182 PolarHBondContact O-N 2.86Å; E182-M184 PolarHBondContact O-N 3.27Å; E182-G185 PolarHBondContact O-N 2.85Å; E182-G185 VanDerWaalsContact O-N 3.15Å; E182-N186 PolarHBondContact O-N 3.25Å; E182-N186 PolarHBondContact O-ND2 3.06Å
183	D	93.8	Very high	88.4	Confident	50 Å²	50	38 Å²	38	27%	0.267	20%	0.202	S	C	.	.	H	α-helix	trans	-61.1	-43.9	179.1	-72	-16.6	0	0	0	111.5	V158 S179 Q180 G185 N186 I187	V158-D183 HydrophobicContact CG1-CB 3.5Å; V158-D183 VanDerWaalsContact CG1-CB 3.5Å; S179-D183 WeakPolarHBondContact O-CB 3.32Å; S179-D183 PolarHBondContact O-N 2.95Å; Q180-D183 PolarHBondContact O-N 2.87Å; D183-G185 VanDerWaalsContact C-N 3.32Å; D183-G185 PolarHBondContact O-N 3.31Å; D183-N186 PolarHBondContact O-N 3.42Å; D183-N186 VanDerWaalsContact O-N 3.16Å; D183-I187 WeakPolarHBondContact O-CB 3.47Å; D183-I187 WeakPolarHBondContact O-CD1 3.47Å; D183-I187 WeakPolarHBondContact O-CG1 3.2Å; D183-I187 PolarHBondContact O-N 2.64Å
184	M	96.1	Very high	90.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-43	174.5	-74.7	177.2	74.9	0	0	112.2	V10 F12 T108 D109 L139 V158 Q180 E182 I187 I188	V10-M184 HydrophobicContact CG1-CB 3.68Å; V10-M184 HydrophobicContact CG1-CE 3.7Å; V10-M184 HydrophobicContact CG1-CG 4.38Å; V10-M184 HydrophobicContact CG1-SD 3.77Å; F12-M184 HydrophobicContact CD2-SD 4.34Å; T108-M184 VanDerWaalsContact C-CE 3.41Å; D109-M184 HydrophobicContact CB-CE 3.95Å; D109-M184 HydrophobicContact CB-SD 3.87Å; L139-M184 HydrophobicContact CB-CE 4.48Å; L139-M184 HydrophobicContact CD2-CB 3.96Å; L139-M184 HydrophobicContact CD2-CE 3.85Å; L139-M184 HydrophobicContact CD2-CG 3.76Å; V158-M184 HydrophobicContact CG1-CG 4.29Å; V158-M184 HydrophobicContact CG2-CG 3.78Å; V158-M184 HydrophobicContact CG2-SD 4.34Å; Q180-M184 WeakPolarHBondContact O-CB 3.43Å; Q180-M184 WeakPolarHBondContact O-CG 3.42Å; Q180-M184 PolarHBondContact O-N 2.92Å; E182-M184 PolarHBondContact O-N 3.27Å; M184-I187 PolarHBondContact O-N 3.31Å; M184-I188 WeakPolarHBondContact O-CD1 3.43Å; M184-I188 VanDerWaalsContact O-CG1 3.26Å; M184-I188 WeakPolarHBondContact O-CG1 3.31Å; M184-I188 PolarHBondContact O-N 2.81Å
185	G	95.9	Very high	91.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-44.6	174.7	0	0	0	0	0	112.2	V181 E182 D183 I188 L189	V181-G185 PolarHBondContact O-N 2.9Å; E182-G185 PolarHBondContact O-N 2.85Å; E182-G185 VanDerWaalsContact O-N 3.15Å; D183-G185 VanDerWaalsContact C-N 3.32Å; D183-G185 PolarHBondContact O-N 3.31Å; G185-I188 PolarHBondContact O-N 2.83Å; G185-L189 WeakPolarHBondContact O-CG 3.21Å; G185-L189 PolarHBondContact O-N 3.25Å
186	N	94.4	Very high	92.2	Very high	62 Å²	62	38 Å²	38	33%	0.332	20%	0.2	S	C	.	.	H	α-helix	trans	-66	-40.5	178.1	-67.3	-33.4	0	0	0	112.5	F167 E182 D183 L189 A190	F167-N186 HydrophobicContact CE2-CB 4.12Å; F167-N186 HydrophobicContact CZ-CB 4.25Å; E182-N186 PolarHBondContact O-N 3.25Å; E182-N186 PolarHBondContact O-ND2 3.06Å; D183-N186 PolarHBondContact O-N 3.42Å; D183-N186 VanDerWaalsContact O-N 3.16Å; N186-L189 PolarHBondContact O-N 3.49Å; N186-A190 PolarHBondContact O-N 3.4Å
187	I	95.6	Very high	93	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-47.9	173.9	-69.7	160.2	0	0	0	109.9	L139 F143 V158 M161 L165 F167 D183 M184 L189 A190 M191	L139-I187 HydrophobicContact CD1-CG2 4.26Å; L139-I187 HydrophobicContact CD2-CG2 4.35Å; F143-I187 HydrophobicContact CD2-CG2 3.96Å; F143-I187 HydrophobicContact CE2-CG2 4.35Å; V158-I187 HydrophobicContact CG1-CD1 4.01Å; M161-I187 HydrophobicContact CB-CD1 3.7Å; M161-I187 HydrophobicContact CB-CG1 4.33Å; M161-I187 HydrophobicContact CE-CD1 4.22Å; L165-I187 HydrophobicContact CD1-CB 4.28Å; L165-I187 HydrophobicContact CD1-CG1 4.02Å; L165-I187 HydrophobicContact CD1-CG2 4.17Å; F167-I187 HydrophobicContact CE2-CG1 4.4Å; D183-I187 WeakPolarHBondContact O-CB 3.47Å; D183-I187 WeakPolarHBondContact O-CD1 3.47Å; D183-I187 WeakPolarHBondContact O-CG1 3.2Å; D183-I187 PolarHBondContact O-N 2.64Å; M184-I187 PolarHBondContact O-N 3.31Å; I187-L189 VanDerWaalsContact C-N 3.33Å; I187-L189 PolarHBondContact O-N 3.15Å; I187-A190 PolarHBondContact O-N 3.22Å; I187-M191 HydrophobicContact CG2-CG 4.33Å; I187-M191 HydrophobicContact CG2-SD 3.79Å; I187-M191 VanDerWaalsContact O-CG 3.28Å; I187-M191 WeakPolarHBondContact O-CG 3.31Å; I187-M191 PolarHBondContact O-N 3.18Å
188	I	96.7	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-45	177.8	-68.9	164.8	0	0	0	110.5	L8 V10 V38 L40 C107 L139 M184 G185 A190 M191 I192 F200	L8-I188 HydrophobicContact CD1-CD1 4.18Å; L8-I188 HydrophobicContact CD1-CG2 4.03Å; V10-I188 HydrophobicContact CG2-CD1 3.49Å; V10-I188 VanDerWaalsContact CG2-CD1 3.49Å; V38-I188 HydrophobicContact CG1-CG2 3.89Å; V38-I188 HydrophobicContact CG2-CD1 4.38Å; L40-I188 HydrophobicContact CD2-CG2 3.97Å; C107-I188 HydrophobicContact CB-CD1 4.35Å; L139-I188 HydrophobicContact CD1-CD1 4.4Å; L139-I188 HydrophobicContact CD1-CG1 3.74Å; M184-I188 WeakPolarHBondContact O-CD1 3.43Å; M184-I188 VanDerWaalsContact O-CG1 3.26Å; M184-I188 WeakPolarHBondContact O-CG1 3.31Å; M184-I188 PolarHBondContact O-N 2.81Å; G185-I188 PolarHBondContact O-N 2.83Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 3.17Å; I188-M191 PolarHBondContact O-N 3Å; I188-I192 WeakPolarHBondContact O-CG1 3.43Å; I188-I192 PolarHBondContact O-N 2.96Å; I188-F200 HydrophobicContact CG1-CZ 4.39Å; I188-F200 HydrophobicContact CG2-CE2 4.12Å; I188-F200 HydrophobicContact CG2-CZ 4.25Å
189	L	95.4	Very high	93.6	Very high	36 Å²	36	49 Å²	49	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-39.6	177.2	-73.1	-166.4	0	0	0	113	V38 K43 V45 G185 N186 I187 I192 S193	V38-L189 HydrophobicContact CG1-CD2 3.97Å; K43-L189 VanDerWaalsContact C-CD2 3.43Å; K43-L189 HydrophobicContact CB-CD2 4.21Å; V45-L189 HydrophobicContact CG2-CD1 3.32Å; V45-L189 HydrophobicContact CG2-CD2 4.36Å; V45-L189 HydrophobicContact CG2-CG 3.76Å; G185-L189 WeakPolarHBondContact O-CG 3.21Å; G185-L189 PolarHBondContact O-N 3.25Å; N186-L189 PolarHBondContact O-N 3.49Å; I187-L189 VanDerWaalsContact C-N 3.33Å; I187-L189 PolarHBondContact O-N 3.15Å; L189-I192 HydrophobicContact CD2-CD1 4Å; L189-I192 WeakPolarHBondContact O-CG1 3.36Å; L189-S193 VanDerWaalsContact O-CB 3.26Å; L189-S193 WeakPolarHBondContact O-CB 3.43Å; L189-S193 PolarHBondContact O-N 3.14Å; L189-S193 PolarHBondContact O-OG 2.67Å
190	A	94.6	Very high	93.9	Very high	22 Å²	22	47 Å²	47	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-44.9	174.9	0	0	0	0	0	111.6	L165 F167 N186 I187 I188 I192 S193	L165-A190 HydrophobicContact CD1-CB 3.86Å; L165-A190 HydrophobicContact CD2-CB 4.49Å; F167-A190 HydrophobicContact CE2-CB 4.36Å; F167-A190 HydrophobicContact CZ-CB 3.84Å; N186-A190 PolarHBondContact O-N 3.4Å; I187-A190 PolarHBondContact O-N 3.22Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 3.17Å; A190-I192 VanDerWaalsContact C-N 3.33Å; A190-I192 PolarHBondContact O-N 3.13Å; A190-S193 PolarHBondContact O-N 3.35Å; A190-S193 VanDerWaalsContact O-N 3.11Å
191	M	95.1	Very high	93.8	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-40.4	179.6	-71.1	171.7	63.3	0	0	112.5	L139 E142 F143 C146 I187 I188 S193 Y196 N197 H198 F200	L139-M191 HydrophobicContact CD1-SD 3.92Å; E142-M191 VanDerWaalsContact C-CE 3.47Å; E142-M191 HydrophobicContact CB-CE 3.89Å; E142-M191 WeakPolarHBondContact O-CE 3.39Å; F143-M191 HydrophobicContact CB-CE 4.49Å; F143-M191 HydrophobicContact CB-SD 4.29Å; F143-M191 HydrophobicContact CD2-CG 4.2Å; F143-M191 HydrophobicContact CD2-SD 3.92Å; C146-M191 HydrophobicContact CB-CE 3.9Å; I187-M191 HydrophobicContact CG2-CG 4.33Å; I187-M191 HydrophobicContact CG2-SD 3.79Å; I187-M191 VanDerWaalsContact O-CG 3.28Å; I187-M191 WeakPolarHBondContact O-CG 3.31Å; I187-M191 PolarHBondContact O-N 3.18Å; I188-M191 PolarHBondContact O-N 3Å; M191-S193 VanDerWaalsContact C-N 3.28Å; M191-S193 PolarHBondContact O-N 3.02Å; M191-Y196 VanDerWaalsContact O-CB 3.24Å; M191-Y196 WeakPolarHBondContact O-CB 3.26Å; M191-N197 PolarHBondContact O-N 3.49Å; M191-H198 HydrophobicContact CB-CB 4.08Å; M191-H198 VanDerWaalsContact O-CB 3.22Å; M191-H198 WeakPolarHBondContact O-CB 3.42Å; M191-H198 PolarHBondContact O-N 2.71Å; M191-F200 HydrophobicContact CE-CE1 4.45Å; M191-F200 HydrophobicContact CE-CZ 4.06Å
192	I	95.1	Very high	93.7	Very high	17 Å²	17	53.2 Å²	53.2	9%	0.087	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-5.1	179.2	68.9	-179.1	0	0	0	113.5	L40 K43 I188 L189 A190 F200	L40-I192 HydrophobicContact CD2-CD1 4.05Å; L40-I192 HydrophobicContact CD2-CG2 4.23Å; K43-I192 HydrophobicContact CB-CD1 4.38Å; K43-I192 HydrophobicContact CG-CD1 3.92Å; K43-I192 HydrophobicContact CG-CG1 4.3Å; K43-I192 PolarHBondContact NZ-O 2.93Å; I188-I192 WeakPolarHBondContact O-CG1 3.43Å; I188-I192 PolarHBondContact O-N 2.96Å; L189-I192 HydrophobicContact CD2-CD1 4Å; L189-I192 WeakPolarHBondContact O-CG1 3.36Å; A190-I192 VanDerWaalsContact C-N 3.33Å; A190-I192 PolarHBondContact O-N 3.13Å; I192-F200 HydrophobicContact CG2-CD2 4.35Å; I192-F200 HydrophobicContact CG2-CE2 3.81Å
193	S	93.9	Very high	93.8	Very high	31 Å²	31	51.2 Å²	51.2	22%	0.217	26%	0.264	C	S	.	.	S	Bend	trans	-99.6	166.5	178.9	-64.4	0	0	0	0	111.8	K43 L189 A190 M191 Y196 N197	K43-S193 PolarHBondContact NZ-OG 3.49Å; L189-S193 VanDerWaalsContact O-CB 3.26Å; L189-S193 WeakPolarHBondContact O-CB 3.43Å; L189-S193 PolarHBondContact O-N 3.14Å; L189-S193 PolarHBondContact O-OG 2.67Å; A190-S193 PolarHBondContact O-N 3.35Å; A190-S193 VanDerWaalsContact O-N 3.11Å; M191-S193 VanDerWaalsContact C-N 3.28Å; M191-S193 PolarHBondContact O-N 3.02Å; S193-Y196 PolarHBondContact O-N 2.86Å; S193-N197 PolarHBondContact O-N 2.86Å
194	E	89.6	Confident	93.9	Very high	165 Å²	165	50.3 Å²	50.3	77%	0.771	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	140.5	171.1	-68.7	-172.3	173.9	0	0	109.6
195	P	89.7	Confident	93.8	Very high	106 Å²	106	57.3 Å²	57.3	69%	0.688	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.4	-7	9.2	34.5	-36.2	0	0	0	115.4
196	Y	91.2	Very high	93.9	Very high	93 Å²	93	57.5 Å²	57.5	37%	0.365	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-42.8	-165.9	-62.3	-66.5	0	0	0	114.7	C146 C147 L165 M191 S193 H198	C146-Y196 VanDerWaalsContact SG-CB 3.51Å; C147-Y196 WeakPolarHBondContact SG-CE1 3.43Å; L165-Y196 HydrophobicContact CD2-CE2 3.76Å; M191-Y196 VanDerWaalsContact O-CB 3.24Å; M191-Y196 WeakPolarHBondContact O-CB 3.26Å; S193-Y196 PolarHBondContact O-N 2.86Å; Y196-H198 PolarHBondContact O-N 3.02Å; Y196-H198 VanDerWaalsContact O-N 3.12Å
197	N	92.5	Very high	93.8	Very high	88 Å²	88	58.1 Å²	58.1	47%	0.471	29%	0.289	S	S	.	.			trans	49.3	36.1	179.3	-62.7	-61.9	0	0	0	114.4	M191 S193	M191-N197 PolarHBondContact O-N 3.49Å; S193-N197 PolarHBondContact O-N 2.86Å
198	H	93.9	Very high	93.3	Very high	31 Å²	31	63.6 Å²	63.6	14%	0.144	31%	0.31	C	S	.	.			trans	-61.9	145.6	-177.9	-174.8	62.8	0	0	0	112	E142 C146 M191 Y196 F200	E142-H198 IonicContact OE2-CD2 2.74Å; E142-H198 IonicContact OE2-CE1 3.69Å; E142-H198 PolarHBondContact OE2-CE1 3.23Å; E142-H198 VanDerWaalsContact OE2-CE1 3.3Å; E142-H198 IonicContact OE2-NE2 2.81Å; E142-H198 PolarHBondContact OE2-NE2 3.33Å; C146-H198 HydrophobicContact CB-CB 4.31Å; M191-H198 HydrophobicContact CB-CB 4.08Å; M191-H198 VanDerWaalsContact O-CB 3.22Å; M191-H198 WeakPolarHBondContact O-CB 3.42Å; M191-H198 PolarHBondContact O-N 2.71Å; Y196-H198 PolarHBondContact O-N 3.02Å; Y196-H198 VanDerWaalsContact O-N 3.12Å; H198-F200 AromaticContact CD2-CE2 3.84Å; H198-F200 AromaticContact CD2-CZ 3.83Å
199	R	93.4	Very high	92.8	Very high	185 Å²	185	71.8 Å²	71.8	70%	0.698	35%	0.346	S	S	*	.			trans	-127	120.2	175.3	-74.2	-172.8	178.9	-93.1	-1.1	111.4	S201	R199-S201 PolarHBondContact O-N 3.36Å
200	F	94.4	Very high	92.5	Very high	2 Å²	2	71.2 Å²	71.2	1%	0.009	34%	0.342	C	S	.	.			trans	-72.1	119.7	172.2	-62.6	-87.6	0	0	0	109.9	S4 P5 L8 L40 F137 E142 I188 M191 I192 H198	S4-F200 WeakPolarHBondContact CA-O 3.45Å; S4-F200 WeakPolarHBondContact CB-O 3.48Å; P5-F200 WeakPolarHBondContact CD-O 3.5Å; L8-F200 HydrophobicContact CD1-CD1 4.03Å; L8-F200 HydrophobicContact CD1-CD2 3.8Å; L8-F200 HydrophobicContact CD1-CE1 3.93Å; L8-F200 HydrophobicContact CD1-CE2 3.71Å; L8-F200 HydrophobicContact CD1-CG 3.96Å; L8-F200 HydrophobicContact CD1-CZ 3.78Å; L40-F200 HydrophobicContact CD1-CD2 4.31Å; L40-F200 HydrophobicContact CD2-CE2 4.49Å; F137-F200 HydrophobicContact CB-CD1 4.22Å; F137-F200 HydrophobicContact CD1-CB 4.31Å; F137-F200 AromaticContact CD1-CD1 3.82Å; F137-F200 HydrophobicContact CD1-CD1 3.82Å; F137-F200 HydrophobicContact CD2-CB 4.3Å; F137-F200 HydrophobicContact CD2-CD1 4.19Å; F137-F200 HydrophobicContact CE1-CB 3.86Å; F137-F200 HydrophobicContact CE1-CD1 4.21Å; F137-F200 HydrophobicContact CE2-CB 3.86Å; F137-F200 AromaticContact CG-CD1 3.8Å; F137-F200 HydrophobicContact CG-CD1 3.8Å; F137-F200 HydrophobicContact CZ-CB 3.62Å; E142-F200 HydrophobicContact CB-CD1 4.36Å; E142-F200 HydrophobicContact CB-CE1 3.81Å; E142-F200 HydrophobicContact CG-CD1 3.9Å; E142-F200 HydrophobicContact CG-CE1 3.79Å; I188-F200 HydrophobicContact CG1-CZ 4.39Å; I188-F200 HydrophobicContact CG2-CE2 4.12Å; I188-F200 HydrophobicContact CG2-CZ 4.25Å; M191-F200 HydrophobicContact CE-CE1 4.45Å; M191-F200 HydrophobicContact CE-CZ 4.06Å; I192-F200 HydrophobicContact CG2-CD2 4.35Å; I192-F200 HydrophobicContact CG2-CE2 3.81Å; H198-F200 AromaticContact CD2-CE2 3.84Å; H198-F200 AromaticContact CD2-CZ 3.83Å
201	S	91.4	Very high	92.1	Very high	60 Å²	60	75.6 Å²	75.6	42%	0.42	36%	0.359	S	S	.	.			trans	-144.4	-25.7	-174.2	54.1	0	0	0	0	115.3	T2 R199 P203	T2-S201 PolarHBondContact OG1-O 2.76Å; R199-S201 PolarHBondContact O-N 3.36Å; S201-P203 WeakPolarHBondContact O-CD 3.42Å
202	D	91.6	Very high	91.5	Very high	111 Å²	111	78.1 Å²	78.1	59%	0.594	38%	0.376	S	S	*	.			trans	-121.8	81.2	-177.7	-170.7	35.8	0	0	0	111.1
203	P	95.1	Very high	90.7	Very high	17 Å²	17	78.3 Å²	78.3	11%	0.11	38%	0.383	C	S	.	.			trans	-72.7	146.9	179.3	30	-33.6	0	0	0	111	S135 F136 F137 S201	S135-P203 WeakPolarHBondContact OG-CB 3.04Å; S135-P203 WeakPolarHBondContact OG-CG 3.49Å; F136-P203 CarbonylContact O-C 3.41Å; F136-P203 WeakPolarHBondContact O-CA 3.41Å; F136-P203 WeakPolarHBondContact O-CB 3.47Å; F137-P203 HydrophobicContact CD1-CB 4.27Å; F137-P203 HydrophobicContact CD2-CB 4.24Å; F137-P203 HydrophobicContact CE1-CB 3.95Å; F137-P203 HydrophobicContact CE2-CB 3.9Å; F137-P203 HydrophobicContact CE2-CG 4.49Å; F137-P203 HydrophobicContact CG-CB 4.42Å; F137-P203 HydrophobicContact CZ-CB 3.74Å; F137-P203 HydrophobicContact CZ-CG 4.12Å; S201-P203 WeakPolarHBondContact O-CD 3.42Å
204	E	95.6	Very high	90	Very high	31 Å²	31	80.2 Å²	80.2	15%	0.145	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	147.5	167.1	-72.1	-161.2	-144.1	0	0	111.6	R115 S135 F136 D138 K141	R115-E204 IonicContact CZ-OE2 3.33Å; R115-E204 IonicContact NE-OE2 3.99Å; R115-E204 PolarHBondContact NE-OE2 3.03Å; R115-E204 IonicContact NH2-OE2 3.48Å; R115-E204 PolarHBondContact NH2-OE2 3.31Å; S135-E204 CarbonylContact C-O 3.48Å; S135-E204 VanDerWaalsContact CA-O 3.29Å; S135-E204 WeakPolarHBondContact CA-O 3.22Å; F136-E204 HydrophobicContact CD1-CB 4.17Å; F136-E204 HydrophobicContact CD2-CB 4.44Å; F136-E204 HydrophobicContact CE1-CB 3.76Å; F136-E204 HydrophobicContact CE2-CB 4.04Å; F136-E204 HydrophobicContact CE2-CG 4.44Å; F136-E204 HydrophobicContact CG-CB 4.49Å; F136-E204 HydrophobicContact CZ-CB 3.68Å; F136-E204 HydrophobicContact CZ-CG 4.32Å; F136-E204 WeakPolarHBondContact CZ-OE2 3.22Å; F136-E204 PolarHBondContact N-O 3.45Å; F136-E204 WeakPolarHBondContact O-CA 3.35Å; F136-E204 WeakPolarHBondContact O-CB 3.41Å; F136-E204 PolarHBondContact O-N 2.73Å; D138-E204 WeakPolarHBondContact CB-OE1 3.39Å; K141-E204 WeakPolarHBondContact CD-OE1 3.31Å; K141-E204 WeakPolarHBondContact CE-OE1 2.91Å; K141-E204 IonicContact NZ-OE1 3.5Å; K141-E204 PolarHBondContact NZ-OE1 2.85Å; K141-E204 IonicContact NZ-OE2 3.98Å
205	R	95.7	Very high	89.6	Confident	146 Å²	146	72.7 Å²	72.7	55%	0.551	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.3	-179.6	-62.9	-174.2	179.5	-166.8	-2.6	112.5	R115 Y134 N249	R115-R205 PolarHBondContact NH2-O 2.74Å; R115-R205 VanDerWaalsContact NH2-O 3.11Å; Y134-R205 WeakPolarHBondContact O-CA 3.46Å; R205-N249 PolarHBondContact O-ND2 3.03Å
206	V	96.4	Very high	89.1	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.03	35%	0.345	C	S	.	.			trans	-112	133.4	167	-174.3	0	0	0	0	108.6	I114 Y134 F136 Y208 N249	I114-V206 HydrophobicContact CG2-CG2 3.96Å; Y134-V206 HydrophobicContact CD1-CB 4.25Å; Y134-V206 HydrophobicContact CD1-CG1 4.5Å; Y134-V206 WeakPolarHBondContact CD1-O 3.5Å; Y134-V206 PolarHBondContact O-N 3.43Å; F136-V206 HydrophobicContact CE1-CG2 4.14Å; V206-Y208 PolarHBondContact O-N 3.36Å; V206-N249 WeakPolarHBondContact CA-OD1 3.41Å
207	N	93	Very high	88.5	Confident	74 Å²	74	72.2 Å²	72.2	40%	0.396	36%	0.355	S	S	.	.			trans	-71.2	130.6	179.6	-70	-8.3	0	0	0	111	K209 N249	N207-K209 VanDerWaalsContact C-N 3.32Å; N207-K209 PolarHBondContact O-N 3.28Å; N207-N249 PolarHBondContact N-OD1 3.41Å
208	Y	85.6	Confident	87.9	Confident	116 Å²	116	76.5 Å²	76.5	46%	0.455	37%	0.374	S	S	.	.	S	Bend	trans	-59.8	-43.5	176.9	-73.4	-82.8	0	0	0	112.5	E131 Y134 V206 K246	E131-Y208 HydrophobicContact CG-CE1 4.46Å; E131-Y208 WeakPolarHBondContact CG-OH 3.39Å; Y134-Y208 WeakPolarHBondContact CB-OH 3.49Å; Y134-Y208 AromaticContact CD1-CD1 3.61Å; Y134-Y208 HydrophobicContact CD1-CD1 3.61Å; Y134-Y208 HydrophobicContact CD1-CD2 4.36Å; Y134-Y208 AromaticContact CD1-CE1 3.61Å; Y134-Y208 HydrophobicContact CD1-CE1 3.61Å; Y134-Y208 HydrophobicContact CD1-CE2 4.37Å; Y134-Y208 AromaticContact CD1-CG 3.98Å; Y134-Y208 HydrophobicContact CD1-CG 3.98Å; Y134-Y208 AromaticContact CD1-CZ 3.99Å; Y134-Y208 HydrophobicContact CD2-CD1 4.04Å; Y134-Y208 AromaticContact CD2-CE1 3.36Å; Y134-Y208 HydrophobicContact CD2-CE1 3.36Å; Y134-Y208 AromaticContact CD2-CZ 3.89Å; Y134-Y208 AromaticContact CE1-CD1 3.51Å; Y134-Y208 HydrophobicContact CE1-CD1 3.51Å; Y134-Y208 AromaticContact CE1-CE1 3.87Å; Y134-Y208 HydrophobicContact CE1-CE1 3.87Å; Y134-Y208 HydrophobicContact CE1-CG 4.06Å; Y134-Y208 AromaticContact CE2-CD1 3.95Å; Y134-Y208 HydrophobicContact CE2-CD1 3.95Å; Y134-Y208 AromaticContact CE2-CE1 3.62Å; Y134-Y208 HydrophobicContact CE2-CE1 3.62Å; Y134-Y208 AromaticContact CG-CD1 3.87Å; Y134-Y208 HydrophobicContact CG-CD1 3.87Å; Y134-Y208 AromaticContact CG-CE1 3.35Å; Y134-Y208 HydrophobicContact CG-CE1 3.35Å; Y134-Y208 HydrophobicContact CG-CE2 4.25Å; Y134-Y208 HydrophobicContact CG-CG 4.5Å; Y134-Y208 AromaticContact CG-CZ 3.55Å; Y134-Y208 AromaticContact CZ-CD1 3.68Å; Y134-Y208 AromaticContact CZ-CE1 3.86Å; V206-Y208 PolarHBondContact O-N 3.36Å; Y208-K246 PolarHBondContact O-NZ 3.43Å
209	K	86.4	Confident	87.4	Confident	172 Å²	172	78.3 Å²	78.3	75%	0.748	38%	0.383	S	S	*	.	S	Bend	trans	-137.6	150.2	-175.9	-62.9	-176.1	-178.2	177.8	0	109.5	N207	N207-K209 VanDerWaalsContact C-N 3.32Å; N207-K209 PolarHBondContact O-N 3.28Å
210	F	89.4	Confident	87	Confident	24 Å²	24	77.3 Å²	77.3	11%	0.105	39%	0.391	C	S	.	.			trans	-78.2	131.8	168.8	167.3	-109.8	0	0	0	109.5	D238 A242 I250 A255	F210-D238 HydrophobicContact CE1-CB 3.8Å; F210-A242 HydrophobicContact CB-CB 3.45Å; F210-A242 VanDerWaalsContact CB-CB 3.45Å; F210-A242 HydrophobicContact CD1-CB 4.02Å; F210-A242 HydrophobicContact CD2-CB 4.43Å; F210-A242 HydrophobicContact CG-CB 3.71Å; F210-I250 HydrophobicContact CD2-CB 3.95Å; F210-I250 HydrophobicContact CD2-CG2 3.9Å; F210-I250 HydrophobicContact CE2-CB 4.15Å; F210-I250 HydrophobicContact CE2-CG2 3.55Å; F210-A255 HydrophobicContact CE1-CB 4.22Å; F210-A255 HydrophobicContact CE2-CB 4.24Å; F210-A255 HydrophobicContact CZ-CB 3.67Å
211	E	85.7	Confident	86.7	Confident	114 Å²	114	78 Å²	78	53%	0.533	39%	0.394	S	S	.	.			trans	-95.8	106.4	177.3	-64.6	-178.1	-174.4	0	0	109.6	K252 G253	E211-K252 HydrophobicContact CB-CB 4.28Å; E211-K252 HydrophobicContact CB-CG 3.98Å; E211-K252 WeakPolarHBondContact O-CA 3.34Å; E211-G253 PolarHBondContact O-N 3.34Å
212	S	82.1	Confident	86.7	Confident	53 Å²	53	79.9 Å²	79.9	37%	0.371	40%	0.399	S	S	.	.			trans	-63.6	147.5	168.5	-54.5	0	0	0	0	109.6	D238	S212-D238 PolarHBondContact OG-OD2 3.45Å
213	G	77.7	Confident	86.7	Confident	21 Å²	21	78.4 Å²	78.4	22%	0.216	39%	0.391	C	S	.	.			trans	-178.7	171.8	-176.9	0	0	0	0	0	112.8	G253 A406	G213-G253 WeakPolarHBondContact O-CA 3.46Å; G213-A406 VanDerWaalsContact O-CB 3.25Å; G213-A406 WeakPolarHBondContact O-CB 3.3Å
214	T	78.8	Confident	86.7	Confident	71 Å²	71	78.3 Å²	78.3	44%	0.436	39%	0.391	S	S	.	.			trans	-88.3	144.9	174.7	52.6	0	0	0	0	111.2	L320 A406	T214-L320 HydrophobicContact CG2-CB 3.76Å; T214-L320 HydrophobicContact CG2-CD1 3.32Å; T214-L320 HydrophobicContact CG2-CG 4.18Å; T214-A406 HydrophobicContact CG2-CB 4.07Å
215	C	81.1	Confident	86.7	Confident	6 Å²	6	77.3 Å²	77.3	4%	0.041	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.4	166.5	-178	0	0	0	0	109.6	E219 F305 A309 G311	C215-E219 PolarHBondContact SG-OE2 3.37Å; C215-F305 HydrophobicContact CB-CE1 4.02Å; C215-A309 HydrophobicContact CB-CB 4.32Å; C215-A309 WeakPolarHBondContact CB-O 3.48Å; C215-G311 PolarHBondContact O-N 3.15Å
216	S	79.3	Confident	86.8	Confident	60 Å²	60	70.4 Å²	70.4	42%	0.42	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	139.3	176.9	176.1	0	0	0	0	109.8	M218 E219	S216-M218 PolarHBondContact O-N 3.43Å; S216-M218 VanDerWaalsContact O-N 3.17Å; S216-M218 PolarHBondContact OG-N 2.89Å; S216-E219 WeakPolarHBondContact O-CB 3.36Å; S216-E219 PolarHBondContact O-N 3.47Å
217	K	79.5	Confident	86.9	Confident	129 Å²	129	70.1 Å²	70.1	56%	0.561	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.5	173.2	-165.9	173	-177.5	177.5	0	113.4	E219 G311 T312	K217-E219 VanDerWaalsContact C-N 3.33Å; K217-G311 PolarHBondContact N-O 3.17Å; K217-T312 HydrophobicContact CB-CG2 3.59Å; K217-T312 HydrophobicContact CD-CG2 3.63Å; K217-T312 HydrophobicContact CG-CG2 4.22Å
218	M	79.4	Confident	87.1	Confident	178 Å²	178	69.9 Å²	69.9	88%	0.877	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-3.6	176.8	-62.3	-178.7	120.7	0	0	113	S216	S216-M218 PolarHBondContact O-N 3.43Å; S216-M218 VanDerWaalsContact O-N 3.17Å; S216-M218 PolarHBondContact OG-N 2.89Å
219	E	83.1	Confident	87.7	Confident	70 Å²	70	64.5 Å²	64.5	33%	0.327	33%	0.333	S	S	.	.			trans	-71.9	133.9	179	-163.2	176.9	170.3	0	0	110.5	C215 S216 K217 R272 L306	C215-E219 PolarHBondContact SG-OE2 3.37Å; S216-E219 WeakPolarHBondContact O-CB 3.36Å; S216-E219 PolarHBondContact O-N 3.47Å; K217-E219 VanDerWaalsContact C-N 3.33Å; E219-R272 IonicContact OE1-CZ 3.98Å; E219-R272 IonicContact OE1-NH1 3.52Å; E219-R272 PolarHBondContact OE1-NH1 3.21Å; E219-R272 IonicContact OE1-NH2 3.82Å; E219-R272 PolarHBondContact OE1-NH2 3.23Å; E219-R272 IonicContact OE2-NH1 2.92Å; E219-R272 PolarHBondContact OE2-NH1 3.21Å; E219-L306 WeakPolarHBondContact O-CD1 3.12Å
220	L	85	Confident	88.2	Confident	164 Å²	164	60.4 Å²	60.4	86%	0.859	31%	0.313	S	S	*	.			trans	-85.6	118.8	172.7	-65	175.8	0	0	0	108.7
221	I	89.3	Confident	88.5	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.087	32%	0.316	C	S	.	.			trans	-112.4	125.3	178.5	-54.5	-175.5	0	0	0	107.7	D223 V226 R272 F305 L306	I221-D223 PolarHBondContact O-N 3.34Å; I221-V226 HydrophobicContact CG2-CG2 3.78Å; I221-R272 HydrophobicContact CG2-CG 4.2Å; I221-F305 HydrophobicContact CD1-CB 4.4Å; I221-F305 HydrophobicContact CD1-CD1 3.36Å; I221-F305 HydrophobicContact CD1-CE1 3.98Å; I221-F305 HydrophobicContact CD1-CG 4.2Å; I221-L306 HydrophobicContact CD1-CD1 4.37Å; I221-L306 HydrophobicContact CD1-CD2 3.56Å; I221-L306 HydrophobicContact CD1-CG 3.67Å; I221-L306 HydrophobicContact CG1-CD1 4.36Å; I221-L306 HydrophobicContact CG1-CD2 4.16Å; I221-L306 HydrophobicContact CG1-CG 4.19Å
222	D	91.4	Very high	88.9	Confident	99 Å²	99	54.9 Å²	54.9	53%	0.529	29%	0.292	S	S	.	.			trans	-69.7	126.9	173.9	-176.6	-6.8	0	0	0	110.2	S224 T225	D222-S224 PolarHBondContact O-N 3.22Å; D222-S224 VanDerWaalsContact O-N 3.14Å; D222-S224 WeakPolarHBondContact OD1-CB 3.36Å; D222-S224 PolarHBondContact OD1-N 3.42Å; D222-S224 PolarHBondContact OD1-OG 2.58Å; D222-S224 PolarHBondContact OD2-OG 2.68Å; D222-T225 HydrophobicContact CB-CG2 3.94Å; D222-T225 PolarHBondContact O-N 3.2Å; D222-T225 PolarHBondContact O-OG1 2.86Å
223	D	91.7	Very high	89.2	Confident	79 Å²	79	54.1 Å²	54.1	42%	0.422	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-58.3	-22.7	176.7	-69.3	-20.2	0	0	0	112.8	I221 T225 A300 T301 G302	I221-D223 PolarHBondContact O-N 3.34Å; D223-T225 PolarHBondContact O-N 3.02Å; D223-A300 VanDerWaalsContact O-O 3.05Å; D223-T301 HydrophobicContact CB-CG2 4.43Å; D223-T301 WeakPolarHBondContact OD1-CB 3.4Å; D223-G302 PolarHBondContact OD1-N 2.82Å
224	S	93.9	Very high	89.5	Confident	15 Å²	15	61.7 Å²	61.7	11%	0.105	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-73.1	-11.7	176.6	78.2	0	0	0	0	113.8	D222 R279	D222-S224 PolarHBondContact O-N 3.22Å; D222-S224 VanDerWaalsContact O-N 3.14Å; D222-S224 WeakPolarHBondContact OD1-CB 3.36Å; D222-S224 PolarHBondContact OD1-N 3.42Å; D222-S224 PolarHBondContact OD1-OG 2.58Å; D222-S224 PolarHBondContact OD2-OG 2.68Å; S224-R279 WeakPolarHBondContact O-CB 3.23Å; S224-R279 WeakPolarHBondContact O-CG 3.35Å; S224-R279 PolarHBondContact O-NE 3.27Å; S224-R279 PolarHBondContact O-NH1 2.99Å; S224-R279 VanDerWaalsContact O-NH1 3.16Å
225	T	96.8	Very high	89.6	Confident	11 Å²	11	63.6 Å²	63.6	7%	0.067	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-105.2	-0.7	-169.6	66.2	0	0	0	0	114.9	D222 D223 F273	D222-T225 HydrophobicContact CB-CG2 3.94Å; D222-T225 PolarHBondContact O-N 3.2Å; D222-T225 PolarHBondContact O-OG1 2.86Å; D223-T225 PolarHBondContact O-N 3.02Å; T225-F273 PolarHBondContact O-N 2.94Å
226	V	97.8	Very high	90	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.6	-172.2	-172.7	0	0	0	0	112	I221 L270 V271 R272 A300 F305	I221-V226 HydrophobicContact CG2-CG2 3.78Å; V226-L270 HydrophobicContact CG1-CD2 4.22Å; V226-V271 CarbonylContact C-O 3.6Å; V226-V271 WeakPolarHBondContact CA-O 3.34Å; V226-R272 HydrophobicContact CG2-CB 4.24Å; V226-R272 HydrophobicContact CG2-CG 4.35Å; V226-A300 HydrophobicContact CB-CB 4.47Å; V226-A300 HydrophobicContact CG1-CB 3.95Å; V226-A300 PolarHBondContact O-N 3.44Å; V226-A300 VanDerWaalsContact O-N 3.11Å; V226-F305 HydrophobicContact CG1-CB 4.05Å; V226-F305 HydrophobicContact CG1-CD2 4.3Å; V226-F305 HydrophobicContact CG2-CB 4.24Å
227	V	98.4	Very high	90.4	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	154.8	166.2	-55.7	0	0	0	0	111.6	F245 L270 V271 F273 R279 A282 L283 V297 Y298	V227-F245 HydrophobicContact CG2-CZ 4.16Å; V227-L270 WeakPolarHBondContact O-CA 3.44Å; V227-V271 HydrophobicContact CG2-CB 3.86Å; V227-V271 HydrophobicContact CG2-CG2 4.47Å; V227-V271 PolarHBondContact N-O 2.75Å; V227-V271 PolarHBondContact O-N 3.06Å; V227-F273 HydrophobicContact CB-CE2 4.42Å; V227-F273 HydrophobicContact CG1-CE2 3.97Å; V227-F273 HydrophobicContact CG2-CE2 3.64Å; V227-F273 HydrophobicContact CG2-CZ 4.33Å; V227-R279 HydrophobicContact CG1-CG 3.65Å; V227-A282 HydrophobicContact CG1-CB 4.19Å; V227-L283 HydrophobicContact CG1-CD2 4.18Å; V227-L283 HydrophobicContact CG1-CG 4.45Å; V227-V297 HydrophobicContact CB-CG1 3.77Å; V227-V297 HydrophobicContact CG1-CG1 4.01Å; V227-V297 HydrophobicContact CG2-CG1 3.92Å; V227-Y298 CarbonylContact C-O 3.56Å; V227-Y298 WeakPolarHBondContact CA-O 3.17Å; V227-Y298 WeakPolarHBondContact CB-O 3.37Å
228	R	97.8	Very high	90.8	Very high	69 Å²	69	55.4 Å²	55.4	26%	0.26	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.8	164.7	-169.9	176.2	-163.6	151.3	3.5	109.3	R230 E268 A269 L270 V297 Y298 A300	R228-R230 HydrophobicContact CG-CG 4.38Å; R228-E268 IonicContact CZ-OE2 3.1Å; R228-E268 IonicContact NE-OE1 3.21Å; R228-E268 IonicContact NE-OE2 2.73Å; R228-E268 PolarHBondContact NE-OE2 3.35Å; R228-E268 IonicContact NH2-OE1 2.66Å; R228-E268 IonicContact NH2-OE2 3.32Å; R228-E268 PolarHBondContact NH2-OE2 3.04Å; R228-A269 CarbonylContact C-O 3.46Å; R228-A269 WeakPolarHBondContact CA-O 3.17Å; R228-L270 HydrophobicContact CB-CD2 3.83Å; R228-L270 HydrophobicContact CG-CD2 4.06Å; R228-V297 WeakPolarHBondContact O-CA 3.4Å; R228-Y298 PolarHBondContact N-O 3.3Å; R228-Y298 PolarHBondContact O-N 3.41Å; R228-A300 HydrophobicContact CB-CB 4.04Å
229	A	97.9	Very high	91.2	Very high	3 Å²	3	49.9 Å²	49.9	3%	0.025	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.5	171.6	0	0	0	0	0	109.4	L232 F245 E268 A269 I295 E296	A229-L232 HydrophobicContact CB-CD1 3.85Å; A229-L232 VanDerWaalsContact O-CD1 3.3Å; A229-L232 WeakPolarHBondContact O-CD1 3.24Å; A229-F245 HydrophobicContact CB-CE2 4.43Å; A229-F245 HydrophobicContact CB-CZ 4.46Å; A229-E268 CarbonylContact O-C 3.58Å; A229-E268 WeakPolarHBondContact O-CA 3.22Å; A229-A269 PolarHBondContact N-O 3Å; A229-A269 PolarHBondContact O-N 3.39Å; A229-I295 HydrophobicContact CB-CG2 3.94Å; A229-E296 CarbonylContact C-O 3.47Å; A229-E296 WeakPolarHBondContact CA-O 3.46Å
230	R	96.7	Very high	91.7	Very high	86 Å²	86	49.3 Å²	49.3	33%	0.325	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	154.8	177.2	-61.1	-172.9	164	147.2	1.5	111.2	R228 E268 I295 E296	R228-R230 HydrophobicContact CG-CG 4.38Å; R230-E268 HydrophobicContact CB-CG 4.45Å; R230-E268 WeakPolarHBondContact CD-OE1 3.26Å; R230-E268 HydrophobicContact CG-CB 4.46Å; R230-E268 HydrophobicContact CG-CG 3.96Å; R230-E268 IonicContact CZ-OE1 3.54Å; R230-E268 IonicContact NE-OE1 3.53Å; R230-E268 PolarHBondContact NE-OE1 3.2Å; R230-E268 IonicContact NH2-OE1 2.72Å; R230-I295 WeakPolarHBondContact O-CA 3.22Å; R230-E296 HydrophobicContact CB-CB 4.27Å; R230-E296 PolarHBondContact N-O 2.84Å; R230-E296 PolarHBondContact O-N 3.36Å
231	G	94.3	Very high	92.1	Very high	18 Å²	18	41.5 Å²	41.5	19%	0.186	20%	0.201	C	C	.	.			trans	90	10.3	178.4	0	0	0	0	0	114	G267 R293	G231-G267 PolarHBondContact N-O 3.37Å; G231-R293 PolarHBondContact O-NE 2.85Å
232	L	94	Very high	92.4	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	20%	0.201	C	C	.	.			trans	-58.2	138.4	179	-71.4	77.3	0	0	0	110.2	A229 W234 I241 L257 G267 A269 I295	A229-L232 HydrophobicContact CB-CD1 3.85Å; A229-L232 VanDerWaalsContact O-CD1 3.3Å; A229-L232 WeakPolarHBondContact O-CD1 3.24Å; L232-W234 PolarHBondContact O-N 3.36Å; L232-I241 HydrophobicContact CD2-CD1 3.63Å; L232-I241 HydrophobicContact CD2-CG1 3.54Å; L232-L257 HydrophobicContact CD2-CD2 4.31Å; L232-G267 WeakPolarHBondContact CD1-O 3.22Å; L232-G267 PolarHBondContact N-O 2.99Å; L232-A269 HydrophobicContact CD1-CB 4.44Å; L232-A269 HydrophobicContact CD2-CB 3.85Å; L232-I295 HydrophobicContact CG-CD1 4.31Å
233	P	90.1	Very high	92.5	Very high	38 Å²	38	42.8 Å²	42.8	25%	0.247	20%	0.199	C	C	.	.			trans	-50.2	139.1	165.4	-23.8	29.9	0	0	0	111	Q235 S236 M290 R293	P233-Q235 PolarHBondContact O-N 2.9Å; P233-S236 WeakPolarHBondContact CB-OG 3.18Å; P233-S236 VanDerWaalsContact CD-OG 3.22Å; P233-S236 WeakPolarHBondContact CD-OG 3.39Å; P233-S236 VanDerWaalsContact O-CB 3.26Å; P233-S236 WeakPolarHBondContact O-CB 3.43Å; P233-S236 PolarHBondContact O-N 3.16Å; P233-S236 PolarHBondContact O-OG 3.38Å; P233-M290 HydrophobicContact CG-CG 4.44Å; P233-M290 HydrophobicContact CG-SD 4.32Å; P233-R293 HydrophobicContact CG-CB 4.31Å; P233-R293 HydrophobicContact CG-CG 4.06Å
234	W	82.9	Confident	92.7	Very high	180 Å²	180	40.1 Å²	40.1	68%	0.682	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.9	-174.8	-63.3	-36.2	0	0	0	114.3	L232 R265	L232-W234 PolarHBondContact O-N 3.36Å; W234-R265 WeakPolarHBondContact O-CD 3.43Å; W234-R265 PolarHBondContact O-NH1 3.38Å
235	Q	82	Confident	92.9	Very high	110 Å²	110	39.5 Å²	39.5	51%	0.514	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.5	176.3	-63	-67.3	27.7	0	0	114.1	P233 R265	P233-Q235 PolarHBondContact O-N 2.9Å; Q235-R265 PolarHBondContact O-NH1 3.01Å
236	S	88	Confident	92.9	Very high	6 Å²	6	41 Å²	41	4%	0.042	19%	0.185	C	C	.	.			trans	-57.9	141.8	-177.8	-50.4	0	0	0	0	112.2	P233 R265	P233-S236 WeakPolarHBondContact CB-OG 3.18Å; P233-S236 VanDerWaalsContact CD-OG 3.22Å; P233-S236 WeakPolarHBondContact CD-OG 3.39Å; P233-S236 VanDerWaalsContact O-CB 3.26Å; P233-S236 WeakPolarHBondContact O-CB 3.43Å; P233-S236 PolarHBondContact O-N 3.16Å; P233-S236 PolarHBondContact O-OG 3.38Å; S236-R265 VanDerWaalsContact O-CZ 3.32Å; S236-R265 PolarHBondContact O-NH1 2.95Å; S236-R265 PolarHBondContact O-NH2 3.08Å
237	S	87.4	Confident	92.8	Very high	5 Å²	5	41 Å²	41	4%	0.035	19%	0.186	C	C	.	.			trans	-104.9	172.4	173.5	63.3	0	0	0	0	111.4	Q239 D240 I241	S237-Q239 PolarHBondContact O-N 3.23Å; S237-Q239 PolarHBondContact OG-N 3.2Å; S237-D240 WeakPolarHBondContact CB-OD2 3.46Å; S237-D240 PolarHBondContact N-OD2 3.37Å; S237-D240 PolarHBondContact O-N 3.49Å; S237-D240 VanDerWaalsContact OG-CG 3.29Å; S237-D240 PolarHBondContact OG-N 3.22Å; S237-D240 PolarHBondContact OG-OD2 3.42Å; S237-I241 WeakPolarHBondContact O-CG1 3.28Å; S237-I241 PolarHBondContact O-N 3.19Å; S237-I241 VanDerWaalsContact O-N 3.12Å
238	D	88.6	Confident	92.7	Very high	13 Å²	13	41.5 Å²	41.5	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-57.8	-35.1	166.4	53.4	-15.7	0	0	0	112.5	F210 S212 I241 A242 A255 T405	F210-D238 HydrophobicContact CE1-CB 3.8Å; S212-D238 PolarHBondContact OG-OD2 3.45Å; D238-I241 WeakPolarHBondContact O-CB 3.45Å; D238-I241 PolarHBondContact O-N 3.11Å; D238-A242 WeakPolarHBondContact O-CB 3.48Å; D238-A242 PolarHBondContact O-N 2.95Å; D238-A255 HydrophobicContact CB-CB 4Å; D238-T405 HydrophobicContact CB-CG2 3.6Å
239	Q	89.1	Confident	92.7	Very high	62 Å²	62	39 Å²	39	29%	0.29	18%	0.179	S	C	.	.	H	α-helix	trans	-67.7	-35.1	175.1	-64	-62	-9	0	0	112.7	S237 I241 A242 R243	S237-Q239 PolarHBondContact O-N 3.23Å; S237-Q239 PolarHBondContact OG-N 3.2Å; Q239-I241 VanDerWaalsContact C-N 3.34Å; Q239-A242 PolarHBondContact O-N 2.87Å; Q239-R243 VanDerWaalsContact O-CB 3.28Å; Q239-R243 WeakPolarHBondContact O-CB 3.26Å; Q239-R243 PolarHBondContact O-N 3.44Å
240	D	91.8	Very high	92.6	Very high	57 Å²	57	39.3 Å²	39.3	31%	0.305	18%	0.181	S	C	.	.	H	α-helix	trans	-67.3	-38.6	174	-59.5	-52.1	0	0	0	111.2	S237 R243 F244 M290	S237-D240 WeakPolarHBondContact CB-OD2 3.46Å; S237-D240 PolarHBondContact N-OD2 3.37Å; S237-D240 PolarHBondContact O-N 3.49Å; S237-D240 VanDerWaalsContact OG-CG 3.29Å; S237-D240 PolarHBondContact OG-N 3.22Å; S237-D240 PolarHBondContact OG-OD2 3.42Å; D240-R243 PolarHBondContact O-N 2.62Å; D240-F244 PolarHBondContact O-N 3.15Å; D240-M290 HydrophobicContact CB-SD 4.47Å
241	I	94.6	Very high	92.5	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-47.6	172.6	-66.4	164.9	0	0	0	110.7	L232 S237 D238 Q239 R243 F244 F245 A255 L257 A269 V271	L232-I241 HydrophobicContact CD2-CD1 3.63Å; L232-I241 HydrophobicContact CD2-CG1 3.54Å; S237-I241 WeakPolarHBondContact O-CG1 3.28Å; S237-I241 PolarHBondContact O-N 3.19Å; S237-I241 VanDerWaalsContact O-N 3.12Å; D238-I241 WeakPolarHBondContact O-CB 3.45Å; D238-I241 PolarHBondContact O-N 3.11Å; Q239-I241 VanDerWaalsContact C-N 3.34Å; I241-R243 VanDerWaalsContact C-N 3.26Å; I241-R243 PolarHBondContact O-N 2.91Å; I241-F244 WeakPolarHBondContact O-CB 3.28Å; I241-F244 PolarHBondContact O-N 3.29Å; I241-F244 VanDerWaalsContact O-N 3.17Å; I241-F245 HydrophobicContact CG2-CD2 3.93Å; I241-F245 HydrophobicContact CG2-CE2 4.14Å; I241-F245 WeakPolarHBondContact O-CD2 3.39Å; I241-F245 PolarHBondContact O-N 2.92Å; I241-A255 HydrophobicContact CG2-CB 4.49Å; I241-L257 HydrophobicContact CD1-CD2 3.59Å; I241-L257 HydrophobicContact CD1-CG 4.4Å; I241-A269 HydrophobicContact CD1-CB 3.51Å; I241-A269 HydrophobicContact CG1-CB 4.46Å; I241-V271 HydrophobicContact CG2-CG2 3.49Å; I241-V271 VanDerWaalsContact CG2-CG2 3.49Å
242	A	94.8	Very high	92.2	Very high	12 Å²	12	40.3 Å²	40.3	10%	0.099	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-35.5	177.2	0	0	0	0	0	112.2	F210 D238 Q239 F245 K246 I250	F210-A242 HydrophobicContact CB-CB 3.45Å; F210-A242 VanDerWaalsContact CB-CB 3.45Å; F210-A242 HydrophobicContact CD1-CB 4.02Å; F210-A242 HydrophobicContact CD2-CB 4.43Å; F210-A242 HydrophobicContact CG-CB 3.71Å; D238-A242 WeakPolarHBondContact O-CB 3.48Å; D238-A242 PolarHBondContact O-N 2.95Å; Q239-A242 PolarHBondContact O-N 2.87Å; A242-F245 CarbonylContact O-C 3.59Å; A242-F245 PolarHBondContact O-N 2.72Å; A242-K246 PolarHBondContact O-N 2.92Å; A242-I250 HydrophobicContact CB-CD1 4.15Å
243	R	94.3	Very high	91.9	Very high	131 Å²	131	40.5 Å²	40.5	49%	0.494	19%	0.188	S	C	.	.	H	α-helix	trans	-67.6	-40.4	174.6	-166.4	-177.7	-101.8	117.1	-5	111.5	S123 Q239 D240 I241 F245 K246	S123-R243 WeakPolarHBondContact OG-CG 3.21Å; Q239-R243 VanDerWaalsContact O-CB 3.28Å; Q239-R243 WeakPolarHBondContact O-CB 3.26Å; Q239-R243 PolarHBondContact O-N 3.44Å; D240-R243 PolarHBondContact O-N 2.62Å; I241-R243 VanDerWaalsContact C-N 3.26Å; I241-R243 PolarHBondContact O-N 2.91Å; R243-F245 VanDerWaalsContact C-N 3.34Å; R243-K246 VanDerWaalsContact O-CB 3.26Å; R243-K246 WeakPolarHBondContact O-CB 3.48Å; R243-K246 PolarHBondContact O-N 2.89Å
244	F	96.2	Very high	92	Very high	23 Å²	23	38.7 Å²	38.7	10%	0.101	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-37.1	174.6	176.4	-92.9	0	0	0	112.7	D240 I241 R285 H288 M290 I295 V297	D240-F244 PolarHBondContact O-N 3.15Å; I241-F244 WeakPolarHBondContact O-CB 3.28Å; I241-F244 PolarHBondContact O-N 3.29Å; I241-F244 VanDerWaalsContact O-N 3.17Å; F244-R285 HydrophobicContact CE1-CB 4.16Å; F244-R285 HydrophobicContact CZ-CB 4.1Å; F244-R285 PolarHBondContact O-NH1 3.13Å; F244-H288 HydrophobicContact CE2-CB 3.62Å; F244-H288 HydrophobicContact CZ-CB 3.75Å; F244-M290 HydrophobicContact CB-CE 3.38Å; F244-M290 HydrophobicContact CD2-CB 4.1Å; F244-M290 HydrophobicContact CD2-CE 4.13Å; F244-M290 HydrophobicContact CG-CE 3.78Å; F244-I295 HydrophobicContact CD2-CG1 4.21Å; F244-I295 HydrophobicContact CE1-CB 4.26Å; F244-I295 HydrophobicContact CE1-CG2 4.09Å; F244-I295 HydrophobicContact CE2-CB 3.88Å; F244-I295 HydrophobicContact CE2-CG1 3.79Å; F244-I295 HydrophobicContact CZ-CB 3.64Å; F244-I295 HydrophobicContact CZ-CG1 4.05Å; F244-I295 HydrophobicContact CZ-CG2 3.98Å; F244-V297 HydrophobicContact CE1-CG2 4.12Å; F244-V297 HydrophobicContact CZ-CG2 4.45Å
245	F	97.3	Very high	92.5	Very high	1 Å²	1	30.4 Å²	30.4	0%	0.004	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	20.2	175.2	-66.4	-65.7	0	0	0	113.9	V227 A229 I241 A242 R243 G247 L248 I250 V271 F273 A282 V297	V227-F245 HydrophobicContact CG2-CZ 4.16Å; A229-F245 HydrophobicContact CB-CE2 4.43Å; A229-F245 HydrophobicContact CB-CZ 4.46Å; I241-F245 HydrophobicContact CG2-CD2 3.93Å; I241-F245 HydrophobicContact CG2-CE2 4.14Å; I241-F245 WeakPolarHBondContact O-CD2 3.39Å; I241-F245 PolarHBondContact O-N 2.92Å; A242-F245 CarbonylContact O-C 3.59Å; A242-F245 PolarHBondContact O-N 2.72Å; R243-F245 VanDerWaalsContact C-N 3.34Å; F245-G247 PolarHBondContact O-N 2.67Å; F245-L248 HydrophobicContact CD1-CD1 4.26Å; F245-L248 WeakPolarHBondContact O-CB 3.3Å; F245-L248 PolarHBondContact O-N 2.81Å; F245-I250 HydrophobicContact CB-CD1 4.17Å; F245-V271 HydrophobicContact CD2-CG1 4.33Å; F245-V271 HydrophobicContact CD2-CG2 4.36Å; F245-V271 HydrophobicContact CE2-CB 4.45Å; F245-V271 HydrophobicContact CE2-CG2 3.96Å; F245-F273 HydrophobicContact CB-CE1 4.1Å; F245-F273 HydrophobicContact CB-CZ 4.23Å; F245-F273 HydrophobicContact CD1-CE1 4.45Å; F245-F273 AromaticContact CD1-CZ 3.85Å; F245-F273 HydrophobicContact CD1-CZ 3.85Å; F245-F273 HydrophobicContact CD2-CZ 4.22Å; F245-F273 HydrophobicContact CE1-CZ 4.25Å; F245-F273 HydrophobicContact CG-CE1 4.23Å; F245-F273 AromaticContact CG-CZ 3.84Å; F245-F273 HydrophobicContact CG-CZ 3.84Å; F245-A282 HydrophobicContact CD1-CB 3.8Å; F245-A282 HydrophobicContact CE1-CB 3.64Å; F245-V297 HydrophobicContact CE1-CG1 4.35Å; F245-V297 HydrophobicContact CE1-CG2 4.22Å; F245-V297 HydrophobicContact CZ-CG1 4.18Å; F245-V297 HydrophobicContact CZ-CG2 4.05Å
246	K	95.9	Very high	92.9	Very high	43 Å²	43	25.1 Å²	25.1	19%	0.187	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	138.4	-179.2	-170.5	71	175.9	174.1	0	111.1	H119 P120 Y208 A242 R243 L248 R285	H119-K246 HydrophobicContact CB-CG 4.2Å; P120-K246 WeakPolarHBondContact CG-O 3.43Å; Y208-K246 PolarHBondContact O-NZ 3.43Å; A242-K246 PolarHBondContact O-N 2.92Å; R243-K246 VanDerWaalsContact O-CB 3.26Å; R243-K246 WeakPolarHBondContact O-CB 3.48Å; R243-K246 PolarHBondContact O-N 2.89Å; K246-L248 VanDerWaalsContact C-N 3.34Å; K246-R285 PolarHBondContact O-NH1 3.34Å; K246-R285 PolarHBondContact O-NH2 2.72Å
247	G	95.8	Very high	93.1	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.01	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.3	-20.6	-172.3	0	0	0	0	0	113.6	R115 H119 F245	R115-G247 WeakPolarHBondContact CG-O 3.42Å; R115-G247 PolarHBondContact NH1-O 2.78Å; H119-G247 VanDerWaalsContact CB-CA 3.45Å; F245-G247 PolarHBondContact O-N 2.67Å
248	L	97.7	Very high	93.3	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.052	12%	0.122	C	C	.	.	S	Bend	trans	-103.8	135.8	175.3	-49.5	179.4	0	0	0	109.5	R115 F245 K246 I250 F273 H278 L281 A282	R115-L248 HydrophobicContact CB-CD2 4.13Å; F245-L248 HydrophobicContact CD1-CD1 4.26Å; F245-L248 WeakPolarHBondContact O-CB 3.3Å; F245-L248 PolarHBondContact O-N 2.81Å; K246-L248 VanDerWaalsContact C-N 3.34Å; L248-I250 PolarHBondContact O-N 2.76Å; L248-F273 HydrophobicContact CB-CD1 4.02Å; L248-F273 HydrophobicContact CB-CE1 3.76Å; L248-F273 HydrophobicContact CD1-CE1 4.17Å; L248-F273 HydrophobicContact CD1-CZ 4.5Å; L248-H278 HydrophobicContact CB-CB 4.45Å; L248-L281 HydrophobicContact CD1-CB 4.1Å; L248-L281 HydrophobicContact CD2-CB 3.6Å; L248-L281 HydrophobicContact CD2-CD1 3.58Å; L248-L281 HydrophobicContact CD2-CG 4.28Å; L248-A282 HydrophobicContact CD1-CB 3.73Å
249	N	96.9	Very high	93.3	Very high	15 Å²	15	25.6 Å²	25.6	8%	0.08	12%	0.123	C	C	.	.			trans	-83.6	107	-178.8	-61.2	-20.5	0	0	0	109.8	R205 V206 N207 F273 V274 H278	R205-N249 PolarHBondContact O-ND2 3.03Å; V206-N249 WeakPolarHBondContact CA-OD1 3.41Å; N207-N249 PolarHBondContact N-OD1 3.41Å; N249-F273 WeakPolarHBondContact O-CA 3.35Å; N249-V274 HydrophobicContact CB-CG1 4.06Å; N249-V274 HydrophobicContact CB-CG2 3.64Å; N249-V274 PolarHBondContact O-N 3.17Å; N249-H278 PolarHBondContact N-ND1 3.02Å
250	I	96.2	Very high	93.1	Very high	11 Å²	11	25 Å²	25	6%	0.056	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	137.3	167.4	-56.8	174.3	0	0	0	108.1	F210 A242 F245 L248 V271 R272 F273	F210-I250 HydrophobicContact CD2-CB 3.95Å; F210-I250 HydrophobicContact CD2-CG2 3.9Å; F210-I250 HydrophobicContact CE2-CB 4.15Å; F210-I250 HydrophobicContact CE2-CG2 3.55Å; A242-I250 HydrophobicContact CB-CD1 4.15Å; F245-I250 HydrophobicContact CB-CD1 4.17Å; L248-I250 PolarHBondContact O-N 2.76Å; I250-V271 HydrophobicContact CD1-CG1 3.78Å; I250-V271 HydrophobicContact CG1-CG1 3.89Å; I250-V271 HydrophobicContact CG2-CG1 3.94Å; I250-R272 VanDerWaalsContact CG2-O 3.31Å; I250-R272 WeakPolarHBondContact CG2-O 3.21Å; I250-F273 HydrophobicContact CG1-CD1 3.99Å; I250-F273 HydrophobicContact CG1-CE1 3.73Å
251	A	93.8	Very high	92.4	Very high	14 Å²	14	26.1 Å²	26.1	12%	0.116	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	157.6	176.1	0	0	0	0	0	111.5	G253 G254 R272 V274	A251-G253 PolarHBondContact O-N 3.37Å; A251-G254 VanDerWaalsContact O-CA 3.31Å; A251-G254 WeakPolarHBondContact O-CA 3.27Å; A251-G254 PolarHBondContact O-N 3.43Å; A251-R272 HydrophobicContact CB-CG 4.2Å; A251-R272 PolarHBondContact N-O 3.47Å; A251-V274 HydrophobicContact CB-CG1 4.34Å
252	K	89.3	Confident	91.4	Very high	110 Å²	110	32 Å²	32	48%	0.478	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	127	174.5	-179.4	174.4	-177.7	171.6	0	109.8	E211 G254 E323	E211-K252 HydrophobicContact CB-CB 4.28Å; E211-K252 HydrophobicContact CB-CG 3.98Å; E211-K252 WeakPolarHBondContact O-CA 3.34Å; K252-G254 PolarHBondContact O-N 2.84Å; K252-E323 IonicContact NZ-OE1 3.99Å; K252-E323 PolarHBondContact NZ-OE1 2.94Å
253	G	86.9	Confident	90.5	Very high	7 Å²	7	31.4 Å²	31.4	7%	0.072	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	66.2	10.6	-173.8	0	0	0	0	0	114.7	E211 G213 A251 A255	E211-G253 PolarHBondContact O-N 3.34Å; G213-G253 WeakPolarHBondContact O-CA 3.46Å; A251-G253 PolarHBondContact O-N 3.37Å; G253-A255 PolarHBondContact O-N 2.83Å
254	G	91.9	Very high	89.9	Confident	1 Å²	1	33 Å²	33	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	13.4	-174.8	0	0	0	0	0	115	A251 K252 V271 R272	A251-G254 VanDerWaalsContact O-CA 3.31Å; A251-G254 WeakPolarHBondContact O-CA 3.27Å; A251-G254 PolarHBondContact O-N 3.43Å; K252-G254 PolarHBondContact O-N 2.84Å; G254-V271 CarbonylContact O-C 3.53Å; G254-V271 VanDerWaalsContact O-CA 3.22Å; G254-V271 WeakPolarHBondContact O-CA 3.27Å; G254-R272 PolarHBondContact O-N 3.39Å
255	A	93.4	Very high	89.3	Confident	5 Å²	5	33.3 Å²	33.3	4%	0.041	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	116	176.5	0	0	0	0	0	110.1	F210 D238 I241 G253	F210-A255 HydrophobicContact CE1-CB 4.22Å; F210-A255 HydrophobicContact CE2-CB 4.24Å; F210-A255 HydrophobicContact CZ-CB 3.67Å; D238-A255 HydrophobicContact CB-CB 4Å; I241-A255 HydrophobicContact CG2-CB 4.49Å; G253-A255 PolarHBondContact O-N 2.83Å
256	A	92.1	Very high	88.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	113.4	-174.7	0	0	0	0	0	111	A269 L270 F305 I308 A309 A407	A256-A269 CarbonylContact O-C 3.39Å; A256-A269 WeakPolarHBondContact O-CA 3.25Å; A256-A269 WeakPolarHBondContact O-CB 3.19Å; A256-L270 PolarHBondContact N-O 3.37Å; A256-L270 PolarHBondContact O-N 2.77Å; A256-F305 HydrophobicContact CB-CD2 4.47Å; A256-F305 HydrophobicContact CB-CE2 3.9Å; A256-F305 HydrophobicContact CB-CZ 4.29Å; A256-I308 HydrophobicContact CB-CG2 4.02Å; A256-A309 HydrophobicContact CB-CB 3.82Å; A256-A407 HydrophobicContact CB-CB 3.74Å
257	L	92.1	Very high	88.5	Confident	8 Å²	8	34.4 Å²	34.4	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.8	174.3	-68.6	173	0	0	0	110.2	L232 I241 A269 T405 Q411	L232-L257 HydrophobicContact CD2-CD2 4.31Å; I241-L257 HydrophobicContact CD1-CD2 3.59Å; I241-L257 HydrophobicContact CD1-CG 4.4Å; L257-A269 HydrophobicContact CD2-CB 4.27Å; L257-T405 HydrophobicContact CD1-CG2 3.86Å; L257-T405 HydrophobicContact CG-CG2 4.05Å; L257-Q411 PolarHBondContact O-NE2 2.94Å
258	C	91.2	Very high	88.4	Confident	6 Å²	6	35.9 Å²	35.9	4%	0.041	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.3	178.5	-63.6	0	0	0	0	111.2	N266 E268	C258-N266 WeakPolarHBondContact CB-OD1 3.41Å; C258-N266 PolarHBondContact O-N 2.88Å; C258-N266 PolarHBondContact O-OD1 2.86Å; C258-E268 HydrophobicContact CB-CB 4.09Å; C258-E268 WeakPolarHBondContact CB-O 3.41Å; C258-E268 PolarHBondContact N-O 2.99Å
259	L	88.3	Confident	88.3	Confident	20 Å²	20	35.4 Å²	35.4	11%	0.105	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	141.9	173.4	-60.8	-174.7	0	0	0	111.7	R264 R265 E408 Q411 V412	L259-R264 CarbonylContact C-O 3.59Å; L259-R264 WeakPolarHBondContact CA-O 3.47Å; L259-R265 HydrophobicContact CD2-CG 3.99Å; L259-E408 HydrophobicContact CD1-CG 3.76Å; L259-E408 HydrophobicContact CD2-CG 4.03Å; L259-E408 HydrophobicContact CG-CG 4.13Å; L259-Q411 HydrophobicContact CD1-CB 4.11Å; L259-V412 HydrophobicContact CD1-CG2 3.54Å
260	N	85.4	Confident	88.3	Confident	48 Å²	48	34.9 Å²	34.9	26%	0.257	18%	0.18	S	C	.	.			trans	-73.5	173.6	169.3	74.6	3.9	0	0	0	111.6	Q262 G263 R264 N266 R415	N260-Q262 VanDerWaalsContact CG-OE1 3.26Å; N260-Q262 PolarHBondContact ND2-OE1 2.93Å; N260-Q262 VanDerWaalsContact ND2-OE1 3.14Å; N260-Q262 PolarHBondContact O-N 3.32Å; N260-Q262 VanDerWaalsContact O-N 3.09Å; N260-Q262 VanDerWaalsContact OD1-C 3.32Å; N260-Q262 WeakPolarHBondContact OD1-CA 3.37Å; N260-Q262 PolarHBondContact OD1-N 3.17Å; N260-Q262 PolarHBondContact OD1-OE1 3.27Å; N260-G263 WeakPolarHBondContact O-CA 3.5Å; N260-G263 PolarHBondContact O-N 3.01Å; N260-G263 PolarHBondContact OD1-N 3.45Å; N260-R264 VanDerWaalsContact CG-O 3.31Å; N260-R264 PolarHBondContact N-O 3.11Å; N260-R264 PolarHBondContact OD1-N 2.8Å; N260-R264 PolarHBondContact OD1-O 3.35Å; N260-N266 HydrophobicContact CB-CB 4.36Å; N260-R415 PolarHBondContact O-NH2 3.15Å
261	A	75.9	Confident	88.4	Confident	81 Å²	81	34.4 Å²	34.4	67%	0.669	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.1	179.4	0	0	0	0	0	114	G263 R415	A261-G263 VanDerWaalsContact C-N 3.34Å; A261-R415 VanDerWaalsContact O-CZ 3.31Å; A261-R415 PolarHBondContact O-NH1 3.45Å
262	Q	74.3	Confident	88.5	Confident	125 Å²	125	35.4 Å²	35.4	58%	0.584	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.1	176.6	-58	77.6	18.9	0	0	113.5	N260 R264 R331 R415	N260-Q262 VanDerWaalsContact CG-OE1 3.26Å; N260-Q262 PolarHBondContact ND2-OE1 2.93Å; N260-Q262 VanDerWaalsContact ND2-OE1 3.14Å; N260-Q262 PolarHBondContact O-N 3.32Å; N260-Q262 VanDerWaalsContact O-N 3.09Å; N260-Q262 VanDerWaalsContact OD1-C 3.32Å; N260-Q262 WeakPolarHBondContact OD1-CA 3.37Å; N260-Q262 PolarHBondContact OD1-N 3.17Å; N260-Q262 PolarHBondContact OD1-OE1 3.27Å; Q262-R264 VanDerWaalsContact C-N 3.31Å; Q262-R331 PolarHBondContact O-NH2 3.38Å; Q262-R415 VanDerWaalsContact C-NH1 3.26Å
263	G	76.6	Confident	88.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	81.6	18.6	172.4	0	0	0	0	0	112.6	N260 A261 R329 R331	N260-G263 WeakPolarHBondContact O-CA 3.5Å; N260-G263 PolarHBondContact O-N 3.01Å; N260-G263 PolarHBondContact OD1-N 3.45Å; A261-G263 VanDerWaalsContact C-N 3.34Å; G263-R329 PolarHBondContact O-NH1 2.87Å; G263-R329 PolarHBondContact O-NH2 3.16Å; G263-R329 VanDerWaalsContact O-NH2 3.14Å; G263-R331 PolarHBondContact O-NH1 3.07Å
264	R	80.5	Confident	89.3	Confident	163 Å²	163	33.7 Å²	33.7	62%	0.615	18%	0.175	S	C	*	.	S	Bend	trans	-92.5	149.6	169.6	-63.8	178.6	179.7	175.7	-0.2	108.2	L259 N260 Q262 N266 R331	L259-R264 CarbonylContact C-O 3.59Å; L259-R264 WeakPolarHBondContact CA-O 3.47Å; N260-R264 VanDerWaalsContact CG-O 3.31Å; N260-R264 PolarHBondContact N-O 3.11Å; N260-R264 PolarHBondContact OD1-N 2.8Å; N260-R264 PolarHBondContact OD1-O 3.35Å; Q262-R264 VanDerWaalsContact C-N 3.31Å; R264-N266 PolarHBondContact O-N 2.64Å; R264-R331 VanDerWaalsContact CG-NH1 3.31Å
265	R	84	Confident	89.5	Confident	31 Å²	31	35.1 Å²	35.1	12%	0.117	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	131.7	173.7	-64.4	165.1	171.3	-156.9	-18.4	109.2	W234 Q235 S236 L259 R403 E408	W234-R265 WeakPolarHBondContact O-CD 3.43Å; W234-R265 PolarHBondContact O-NH1 3.38Å; Q235-R265 PolarHBondContact O-NH1 3.01Å; S236-R265 VanDerWaalsContact O-CZ 3.32Å; S236-R265 PolarHBondContact O-NH1 2.95Å; S236-R265 PolarHBondContact O-NH2 3.08Å; L259-R265 HydrophobicContact CD2-CG 3.99Å; R265-R403 PolarHBondContact NH2-O 3.24Å; R265-E408 IonicContact NE-OE2 2.66Å
266	N	86.5	Confident	89.6	Confident	58 Å²	58	39.4 Å²	39.4	31%	0.31	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-3.4	-179.9	69.1	-8.8	0	0	0	113	C258 N260 R264 E268	C258-N266 WeakPolarHBondContact CB-OD1 3.41Å; C258-N266 PolarHBondContact O-N 2.88Å; C258-N266 PolarHBondContact O-OD1 2.86Å; N260-N266 HydrophobicContact CB-CB 4.36Å; R264-N266 PolarHBondContact O-N 2.64Å; N266-E268 PolarHBondContact ND2-OE2 3.21Å; N266-E268 WeakPolarHBondContact OD1-CA 3.41Å; N266-E268 VanDerWaalsContact OD1-CB 3.27Å; N266-E268 WeakPolarHBondContact OD1-CB 3.31Å; N266-E268 PolarHBondContact OD1-N 2.74Å; N266-E268 PolarHBondContact OD1-O 3.21Å
267	G	89.9	Confident	89.8	Confident	9 Å²	9	42.7 Å²	42.7	9%	0.093	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80	21.3	-173.9	0	0	0	0	0	113.3	G231 L232	G231-G267 PolarHBondContact N-O 3.37Å; L232-G267 WeakPolarHBondContact CD1-O 3.22Å; L232-G267 PolarHBondContact N-O 2.99Å
268	E	94.3	Very high	90	Very high	32 Å²	32	42.6 Å²	42.6	15%	0.15	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	153.3	174.3	-47	-176.5	137.7	0	0	111.1	R228 A229 R230 C258 N266	R228-E268 IonicContact CZ-OE2 3.1Å; R228-E268 IonicContact NE-OE1 3.21Å; R228-E268 IonicContact NE-OE2 2.73Å; R228-E268 PolarHBondContact NE-OE2 3.35Å; R228-E268 IonicContact NH2-OE1 2.66Å; R228-E268 IonicContact NH2-OE2 3.32Å; R228-E268 PolarHBondContact NH2-OE2 3.04Å; A229-E268 CarbonylContact O-C 3.58Å; A229-E268 WeakPolarHBondContact O-CA 3.22Å; R230-E268 HydrophobicContact CB-CG 4.45Å; R230-E268 WeakPolarHBondContact CD-OE1 3.26Å; R230-E268 HydrophobicContact CG-CB 4.46Å; R230-E268 HydrophobicContact CG-CG 3.96Å; R230-E268 IonicContact CZ-OE1 3.54Å; R230-E268 IonicContact NE-OE1 3.53Å; R230-E268 PolarHBondContact NE-OE1 3.2Å; R230-E268 IonicContact NH2-OE1 2.72Å; C258-E268 HydrophobicContact CB-CB 4.09Å; C258-E268 WeakPolarHBondContact CB-O 3.41Å; C258-E268 PolarHBondContact N-O 2.99Å; N266-E268 PolarHBondContact ND2-OE2 3.21Å; N266-E268 WeakPolarHBondContact OD1-CA 3.41Å; N266-E268 VanDerWaalsContact OD1-CB 3.27Å; N266-E268 WeakPolarHBondContact OD1-CB 3.31Å; N266-E268 PolarHBondContact OD1-N 2.74Å; N266-E268 PolarHBondContact OD1-O 3.21Å
269	A	95.9	Very high	90.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.6	172.4	0	0	0	0	0	110.8	R228 A229 L232 I241 A256 L257	R228-A269 CarbonylContact C-O 3.46Å; R228-A269 WeakPolarHBondContact CA-O 3.17Å; A229-A269 PolarHBondContact N-O 3Å; A229-A269 PolarHBondContact O-N 3.39Å; L232-A269 HydrophobicContact CD1-CB 4.44Å; L232-A269 HydrophobicContact CD2-CB 3.85Å; I241-A269 HydrophobicContact CD1-CB 3.51Å; I241-A269 HydrophobicContact CG1-CB 4.46Å; A256-A269 CarbonylContact O-C 3.39Å; A256-A269 WeakPolarHBondContact O-CA 3.25Å; A256-A269 WeakPolarHBondContact O-CB 3.19Å; L257-A269 HydrophobicContact CD2-CB 4.27Å
270	L	96.2	Very high	90.7	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.9	166	-70.5	164	0	0	0	108.7	V226 V227 R228 A256 A300 D304 F305 I308	V226-L270 HydrophobicContact CG1-CD2 4.22Å; V227-L270 WeakPolarHBondContact O-CA 3.44Å; R228-L270 HydrophobicContact CB-CD2 3.83Å; R228-L270 HydrophobicContact CG-CD2 4.06Å; A256-L270 PolarHBondContact N-O 3.37Å; A256-L270 PolarHBondContact O-N 2.77Å; L270-A300 HydrophobicContact CD2-CB 3.62Å; L270-D304 VanDerWaalsContact CD1-C 3.5Å; L270-D304 HydrophobicContact CD1-CB 4.23Å; L270-D304 WeakPolarHBondContact CD1-O 3.49Å; L270-F305 HydrophobicContact CB-CD2 3.8Å; L270-F305 HydrophobicContact CB-CE2 4.49Å; L270-I308 HydrophobicContact CD1-CB 4.23Å; L270-I308 HydrophobicContact CD1-CG1 3.77Å
271	V	97.1	Very high	91.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.1	-176.9	-171.8	0	0	0	0	109.2	V226 V227 I241 F245 I250 G254 F273	V226-V271 CarbonylContact C-O 3.6Å; V226-V271 WeakPolarHBondContact CA-O 3.34Å; V227-V271 HydrophobicContact CG2-CB 3.86Å; V227-V271 HydrophobicContact CG2-CG2 4.47Å; V227-V271 PolarHBondContact N-O 2.75Å; V227-V271 PolarHBondContact O-N 3.06Å; I241-V271 HydrophobicContact CG2-CG2 3.49Å; I241-V271 VanDerWaalsContact CG2-CG2 3.49Å; F245-V271 HydrophobicContact CD2-CG1 4.33Å; F245-V271 HydrophobicContact CD2-CG2 4.36Å; F245-V271 HydrophobicContact CE2-CB 4.45Å; F245-V271 HydrophobicContact CE2-CG2 3.96Å; I250-V271 HydrophobicContact CD1-CG1 3.78Å; I250-V271 HydrophobicContact CG1-CG1 3.89Å; I250-V271 HydrophobicContact CG2-CG1 3.94Å; G254-V271 CarbonylContact O-C 3.53Å; G254-V271 VanDerWaalsContact O-CA 3.22Å; G254-V271 WeakPolarHBondContact O-CA 3.27Å; V271-F273 HydrophobicContact CB-CE2 4.38Å; V271-F273 HydrophobicContact CB-CZ 4.49Å; V271-F273 HydrophobicContact CG1-CE1 4.28Å; V271-F273 HydrophobicContact CG1-CE2 4.07Å; V271-F273 HydrophobicContact CG1-CZ 3.85Å
272	R	96.3	Very high	92.3	Very high	35 Å²	35	38.8 Å²	38.8	13%	0.132	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.6	176.4	177.2	-174.7	175.4	-167.7	-1.7	110	E219 I221 V226 I250 A251 G254 F305	E219-R272 IonicContact OE1-CZ 3.98Å; E219-R272 IonicContact OE1-NH1 3.52Å; E219-R272 PolarHBondContact OE1-NH1 3.21Å; E219-R272 IonicContact OE1-NH2 3.82Å; E219-R272 PolarHBondContact OE1-NH2 3.23Å; E219-R272 IonicContact OE2-NH1 2.92Å; E219-R272 PolarHBondContact OE2-NH1 3.21Å; I221-R272 HydrophobicContact CG2-CG 4.2Å; V226-R272 HydrophobicContact CG2-CB 4.24Å; V226-R272 HydrophobicContact CG2-CG 4.35Å; I250-R272 VanDerWaalsContact CG2-O 3.31Å; I250-R272 WeakPolarHBondContact CG2-O 3.21Å; A251-R272 HydrophobicContact CB-CG 4.2Å; A251-R272 PolarHBondContact N-O 3.47Å; G254-R272 PolarHBondContact O-N 3.39Å; R272-F305 HydrophobicContact CB-CD2 4.12Å; R272-F305 HydrophobicContact CB-CE2 3.96Å; R272-F305 HydrophobicContact CB-CZ 4.21Å
273	F	97.4	Very high	93.4	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	165.3	172.9	-62	-82.2	0	0	0	111.4	T225 V227 F245 L248 N249 I250 V271 S275 H278 R279 A282	T225-F273 PolarHBondContact O-N 2.94Å; V227-F273 HydrophobicContact CB-CE2 4.42Å; V227-F273 HydrophobicContact CG1-CE2 3.97Å; V227-F273 HydrophobicContact CG2-CE2 3.64Å; V227-F273 HydrophobicContact CG2-CZ 4.33Å; F245-F273 HydrophobicContact CB-CE1 4.1Å; F245-F273 HydrophobicContact CB-CZ 4.23Å; F245-F273 HydrophobicContact CD1-CE1 4.45Å; F245-F273 AromaticContact CD1-CZ 3.85Å; F245-F273 HydrophobicContact CD1-CZ 3.85Å; F245-F273 HydrophobicContact CD2-CZ 4.22Å; F245-F273 HydrophobicContact CE1-CZ 4.25Å; F245-F273 HydrophobicContact CG-CE1 4.23Å; F245-F273 AromaticContact CG-CZ 3.84Å; F245-F273 HydrophobicContact CG-CZ 3.84Å; L248-F273 HydrophobicContact CB-CD1 4.02Å; L248-F273 HydrophobicContact CB-CE1 3.76Å; L248-F273 HydrophobicContact CD1-CE1 4.17Å; L248-F273 HydrophobicContact CD1-CZ 4.5Å; N249-F273 WeakPolarHBondContact O-CA 3.35Å; I250-F273 HydrophobicContact CG1-CD1 3.99Å; I250-F273 HydrophobicContact CG1-CE1 3.73Å; V271-F273 HydrophobicContact CB-CE2 4.38Å; V271-F273 HydrophobicContact CB-CZ 4.49Å; V271-F273 HydrophobicContact CG1-CE1 4.28Å; V271-F273 HydrophobicContact CG1-CE2 4.07Å; V271-F273 HydrophobicContact CG1-CZ 3.85Å; F273-S275 VanDerWaalsContact C-N 3.26Å; F273-S275 PolarHBondContact O-N 3.41Å; F273-H278 HydrophobicContact CB-CB 3.78Å; F273-H278 HydrophobicContact CD1-CB 4.03Å; F273-H278 HydrophobicContact CG-CB 4.05Å; F273-R279 HydrophobicContact CD2-CB 4.04Å; F273-A282 HydrophobicContact CD2-CB 4.36Å; F273-A282 HydrophobicContact CE1-CB 4.2Å; F273-A282 HydrophobicContact CE2-CB 3.43Å; F273-A282 VanDerWaalsContact CE2-CB 3.43Å; F273-A282 HydrophobicContact CZ-CB 3.35Å
274	V	95.9	Very high	94.3	Very high	80 Å²	80	38 Å²	38	49%	0.485	18%	0.183	S	C	.	.	S	Bend	trans	-73.9	-16.7	176.3	-58.1	0	0	0	0	113.4	N249 A251 H278	N249-V274 HydrophobicContact CB-CG1 4.06Å; N249-V274 HydrophobicContact CB-CG2 3.64Å; N249-V274 PolarHBondContact O-N 3.17Å; A251-V274 HydrophobicContact CB-CG1 4.34Å; V274-H278 WeakPolarHBondContact CG2-ND1 3.42Å
275	S	95.8	Very high	95.1	Very high	32 Å²	32	30.4 Å²	30.4	22%	0.224	16%	0.155	C	C	.	.	S	Bend	trans	-150.9	157.2	-177.6	64.8	0	0	0	0	112	F273 E277 H278 R279	F273-S275 VanDerWaalsContact C-N 3.26Å; F273-S275 PolarHBondContact O-N 3.41Å; S275-E277 VanDerWaalsContact C-N 3.26Å; S275-E277 PolarHBondContact O-N 2.9Å; S275-H278 PolarHBondContact O-N 2.87Å; S275-H278 PolarHBondContact OG-CD2 3.36Å; S275-H278 PolarHBondContact OG-N 3.22Å; S275-R279 PolarHBondContact O-N 2.84Å
276	E	96.2	Very high	95.7	Very high	95 Å²	95	32.2 Å²	32.2	44%	0.444	17%	0.165	S	C	.	.	H	α-helix	trans	-58.7	-40	171.9	176.8	163.8	-146.1	0	0	111.7	H278 R279 D280	E276-H278 VanDerWaalsContact C-N 3.31Å; E276-H278 PolarHBondContact O-N 3.46Å; E276-R279 CarbonylContact O-C 3.52Å; E276-R279 WeakPolarHBondContact O-CA 3.46Å; E276-R279 VanDerWaalsContact O-CB 3.26Å; E276-R279 WeakPolarHBondContact O-CB 3.39Å; E276-R279 PolarHBondContact O-N 3.16Å; E276-R279 IonicContact OE1-CZ 3.06Å; E276-R279 IonicContact OE1-NH2 3.43Å; E276-R279 PolarHBondContact OE1-NH2 2.87Å; E276-D280 PolarHBondContact O-N 3.47Å
277	E	95	Very high	96.1	Very high	68 Å²	68	33.3 Å²	33.3	32%	0.318	17%	0.167	S	C	.	.	H	α-helix	trans	-56.8	-44.4	179	179.9	173.9	-149.4	0	0	112	Q111 K141 S275 D280 L281	Q111-E277 VanDerWaalsContact CD-OE1 3.3Å; Q111-E277 VanDerWaalsContact NE2-CD 3.28Å; Q111-E277 VanDerWaalsContact NE2-CG 3.32Å; Q111-E277 PolarHBondContact NE2-OE1 3.28Å; Q111-E277 PolarHBondContact OE1-OE1 3.23Å; K141-E277 WeakPolarHBondContact CE-OE1 3.35Å; K141-E277 IonicContact NZ-OE1 2.81Å; K141-E277 PolarHBondContact NZ-OE1 3.22Å; K141-E277 IonicContact NZ-OE2 3.79Å; K141-E277 PolarHBondContact NZ-OE2 2.85Å; S275-E277 VanDerWaalsContact C-N 3.26Å; S275-E277 PolarHBondContact O-N 2.9Å; E277-D280 PolarHBondContact O-N 2.66Å; E277-L281 WeakPolarHBondContact O-CG 3.31Å; E277-L281 PolarHBondContact O-N 3.17Å
278	H	97.4	Very high	96.4	Very high	7 Å²	7	33.8 Å²	33.8	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-68.6	-34.6	175.6	-68.6	178.3	0	0	0	112.4	R115 L248 N249 F273 V274 S275 E276 D280 L281 A282	R115-H278 PolarHBondContact NH1-NE2 3.14Å; R115-H278 PolarHBondContact NH2-NE2 2.89Å; L248-H278 HydrophobicContact CB-CB 4.45Å; N249-H278 PolarHBondContact N-ND1 3.02Å; F273-H278 HydrophobicContact CB-CB 3.78Å; F273-H278 HydrophobicContact CD1-CB 4.03Å; F273-H278 HydrophobicContact CG-CB 4.05Å; V274-H278 WeakPolarHBondContact CG2-ND1 3.42Å; S275-H278 PolarHBondContact O-N 2.87Å; S275-H278 PolarHBondContact OG-CD2 3.36Å; S275-H278 PolarHBondContact OG-N 3.22Å; E276-H278 VanDerWaalsContact C-N 3.31Å; E276-H278 PolarHBondContact O-N 3.46Å; H278-D280 VanDerWaalsContact C-N 3.33Å; H278-L281 PolarHBondContact O-N 2.74Å; H278-A282 WeakPolarHBondContact O-CB 3.4Å; H278-A282 PolarHBondContact O-N 3.47Å
279	R	97.4	Very high	96.3	Very high	9 Å²	9	37.2 Å²	37.2	3%	0.034	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-43.9	172.8	-176.2	-71.2	-54.6	-95.9	0.9	110.3	S224 V227 F273 S275 E276 A282 L283	S224-R279 WeakPolarHBondContact O-CB 3.23Å; S224-R279 WeakPolarHBondContact O-CG 3.35Å; S224-R279 PolarHBondContact O-NE 3.27Å; S224-R279 PolarHBondContact O-NH1 2.99Å; S224-R279 VanDerWaalsContact O-NH1 3.16Å; V227-R279 HydrophobicContact CG1-CG 3.65Å; F273-R279 HydrophobicContact CD2-CB 4.04Å; S275-R279 PolarHBondContact O-N 2.84Å; E276-R279 CarbonylContact O-C 3.52Å; E276-R279 WeakPolarHBondContact O-CA 3.46Å; E276-R279 VanDerWaalsContact O-CB 3.26Å; E276-R279 WeakPolarHBondContact O-CB 3.39Å; E276-R279 PolarHBondContact O-N 3.16Å; E276-R279 IonicContact OE1-CZ 3.06Å; E276-R279 IonicContact OE1-NH2 3.43Å; E276-R279 PolarHBondContact OE1-NH2 2.87Å; R279-A282 VanDerWaalsContact O-CB 3.31Å; R279-A282 WeakPolarHBondContact O-CB 3.27Å; R279-A282 PolarHBondContact O-N 3.47Å; R279-L283 WeakPolarHBondContact O-CG 3.4Å; R279-L283 PolarHBondContact O-N 3.37Å; R279-L283 VanDerWaalsContact O-N 3.09Å
280	D	96.6	Very high	96.2	Very high	59 Å²	59	38.3 Å²	38.3	32%	0.316	19%	0.188	S	C	.	.	H	α-helix	trans	-67.6	-40.1	179.3	-71.5	-19.4	0	0	0	112.4	E276 E277 H278 A282 L283 Q284	E276-D280 PolarHBondContact O-N 3.47Å; E277-D280 PolarHBondContact O-N 2.66Å; H278-D280 VanDerWaalsContact C-N 3.33Å; D280-A282 VanDerWaalsContact C-N 3.28Å; D280-A282 PolarHBondContact O-N 2.97Å; D280-L283 WeakPolarHBondContact O-CB 3.3Å; D280-L283 PolarHBondContact O-N 3.23Å; D280-Q284 PolarHBondContact O-N 3.5Å
281	L	97.1	Very high	95.8	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-35.4	170	-69	-179.7	0	0	0	112.5	Q111 L112 R115 Q116 L248 E277 H278 L283 Q284	Q111-L281 HydrophobicContact CG-CD1 4.01Å; L112-L281 HydrophobicContact CD2-CD2 3.4Å; L112-L281 VanDerWaalsContact CD2-CD2 3.4Å; R115-L281 HydrophobicContact CB-CD1 4.26Å; Q116-L281 HydrophobicContact CG-CD2 4.29Å; Q116-L281 PolarHBondContact NE2-O 3.42Å; L248-L281 HydrophobicContact CD1-CB 4.1Å; L248-L281 HydrophobicContact CD2-CB 3.6Å; L248-L281 HydrophobicContact CD2-CD1 3.58Å; L248-L281 HydrophobicContact CD2-CG 4.28Å; E277-L281 WeakPolarHBondContact O-CG 3.31Å; E277-L281 PolarHBondContact O-N 3.17Å; H278-L281 PolarHBondContact O-N 2.74Å; L281-L283 VanDerWaalsContact C-N 3.3Å; L281-L283 PolarHBondContact O-N 3.48Å; L281-Q284 WeakPolarHBondContact O-CB 3.34Å; L281-Q284 PolarHBondContact O-N 3.5Å
282	A	97.8	Very high	95.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-34.5	175.8	0	0	0	0	0	112	V227 F245 L248 F273 H278 R279 D280 Q284 R285	V227-A282 HydrophobicContact CG1-CB 4.19Å; F245-A282 HydrophobicContact CD1-CB 3.8Å; F245-A282 HydrophobicContact CE1-CB 3.64Å; L248-A282 HydrophobicContact CD1-CB 3.73Å; F273-A282 HydrophobicContact CD2-CB 4.36Å; F273-A282 HydrophobicContact CE1-CB 4.2Å; F273-A282 HydrophobicContact CE2-CB 3.43Å; F273-A282 VanDerWaalsContact CE2-CB 3.43Å; F273-A282 HydrophobicContact CZ-CB 3.35Å; H278-A282 WeakPolarHBondContact O-CB 3.4Å; H278-A282 PolarHBondContact O-N 3.47Å; R279-A282 VanDerWaalsContact O-CB 3.31Å; R279-A282 WeakPolarHBondContact O-CB 3.27Å; R279-A282 PolarHBondContact O-N 3.47Å; D280-A282 VanDerWaalsContact C-N 3.28Å; D280-A282 PolarHBondContact O-N 2.97Å; A282-Q284 PolarHBondContact O-N 3.27Å; A282-R285 WeakPolarHBondContact O-CB 3.5Å; A282-R285 PolarHBondContact O-N 2.87Å; A282-R285 VanDerWaalsContact O-N 3.07Å
283	L	97.4	Very high	95.2	Very high	40 Å²	40	51.6 Å²	51.6	21%	0.209	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-29.1	175.2	-65.3	170	0	0	0	112.4	V227 R279 D280 L281 R285 H286 V297 K299	V227-L283 HydrophobicContact CG1-CD2 4.18Å; V227-L283 HydrophobicContact CG1-CG 4.45Å; R279-L283 WeakPolarHBondContact O-CG 3.4Å; R279-L283 PolarHBondContact O-N 3.37Å; R279-L283 VanDerWaalsContact O-N 3.09Å; D280-L283 WeakPolarHBondContact O-CB 3.3Å; D280-L283 PolarHBondContact O-N 3.23Å; L281-L283 VanDerWaalsContact C-N 3.3Å; L281-L283 PolarHBondContact O-N 3.48Å; L283-R285 PolarHBondContact O-N 2.61Å; L283-H286 VanDerWaalsContact O-CB 3.31Å; L283-H286 WeakPolarHBondContact O-CB 3.41Å; L283-H286 PolarHBondContact O-N 3.39Å; L283-H286 VanDerWaalsContact O-N 3.16Å; L283-V297 HydrophobicContact CD2-CG1 4.19Å; L283-K299 HydrophobicContact CD1-CD 4.17Å; L283-K299 HydrophobicContact CD1-CG 3.64Å; L283-K299 HydrophobicContact CD2-CG 4.01Å; L283-K299 HydrophobicContact CG-CG 4.47Å
284	Q	96.3	Very high	95.1	Very high	67 Å²	67	57.3 Å²	57.3	31%	0.313	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-12.3	174.7	-59.8	175.8	3.5	0	0	112.8	Q116 D280 L281 A282 H286	Q116-Q284 VanDerWaalsContact NE2-OE1 3.11Å; D280-Q284 PolarHBondContact O-N 3.5Å; L281-Q284 WeakPolarHBondContact O-CB 3.34Å; L281-Q284 PolarHBondContact O-N 3.5Å; A282-Q284 PolarHBondContact O-N 3.27Å; Q284-H286 PolarHBondContact O-N 3.34Å
285	R	96.1	Very high	95.2	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.015	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	15	172.6	-54.7	-167.4	-174.5	-176.6	3.6	113.4	R115 P120 F244 K246 A282 L283 K287 H288	R115-R285 PolarHBondContact O-NH2 3.21Å; P120-R285 VanDerWaalsContact CG-NH2 3.35Å; F244-R285 HydrophobicContact CE1-CB 4.16Å; F244-R285 HydrophobicContact CZ-CB 4.1Å; F244-R285 PolarHBondContact O-NH1 3.13Å; K246-R285 PolarHBondContact O-NH1 3.34Å; K246-R285 PolarHBondContact O-NH2 2.72Å; A282-R285 WeakPolarHBondContact O-CB 3.5Å; A282-R285 PolarHBondContact O-N 2.87Å; A282-R285 VanDerWaalsContact O-N 3.07Å; L283-R285 PolarHBondContact O-N 2.61Å; R285-K287 PolarHBondContact O-N 3.18Å; R285-H288 HydrophobicContact CB-CB 4.26Å; R285-H288 VanDerWaalsContact O-CB 3.3Å; R285-H288 WeakPolarHBondContact O-CB 3.32Å; R285-H288 PolarHBondContact O-N 3.47Å
286	H	96.4	Very high	95.3	Very high	69 Å²	69	54.1 Å²	54.1	32%	0.319	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	130.2	175.7	-174.1	81.2	0	0	0	110.4	L283 Q284 H288 V297 Y298	L283-H286 VanDerWaalsContact O-CB 3.31Å; L283-H286 WeakPolarHBondContact O-CB 3.41Å; L283-H286 PolarHBondContact O-N 3.39Å; L283-H286 VanDerWaalsContact O-N 3.16Å; Q284-H286 PolarHBondContact O-N 3.34Å; H286-H288 PolarHBondContact O-N 3.32Å; H286-V297 PolarHBondContact ND1-N 2.82Å; H286-V297 VanDerWaalsContact ND1-N 3.18Å; H286-V297 PolarHBondContact ND1-O 3.34Å; H286-Y298 AromaticContact CE1-CE1 3.97Å; H286-Y298 AromaticContact CE1-CZ 3.96Å
287	K	95.4	Very high	95.4	Very high	81 Å²	81	49.9 Å²	49.9	35%	0.352	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	10.7	-172.3	-56	-59	-173.2	174	0	115.7	R285 Y294 I295 E296	R285-K287 PolarHBondContact O-N 3.18Å; K287-Y294 HydrophobicContact CD-CD2 3.63Å; K287-Y294 HydrophobicContact CD-CE2 4.05Å; K287-Y294 HydrophobicContact CD-CG 4.27Å; K287-I295 VanDerWaalsContact CA-O 3.31Å; K287-I295 WeakPolarHBondContact CA-O 3.45Å; K287-I295 PolarHBondContact N-O 2.9Å; K287-E296 HydrophobicContact CD-CG 4.32Å; K287-E296 IonicContact NZ-OE1 2.78Å; K287-E296 PolarHBondContact NZ-OE1 2.7Å
288	H	95.6	Very high	95.5	Very high	19 Å²	19	50.8 Å²	50.8	9%	0.088	26%	0.256	C	S	.	.			trans	-67.6	156.7	170.3	-71.5	-162.7	0	0	0	111.6	S25 E27 F244 R285 H286 Y294 I295	S25-H288 PolarHBondContact O-NE2 2.92Å; E27-H288 VanDerWaalsContact CD-CA 3.43Å; E27-H288 HydrophobicContact CG-CB 3.91Å; E27-H288 WeakPolarHBondContact CG-CD2 3.5Å; E27-H288 VanDerWaalsContact OE2-CA 3.24Å; E27-H288 WeakPolarHBondContact OE2-CA 3.43Å; F244-H288 HydrophobicContact CE2-CB 3.62Å; F244-H288 HydrophobicContact CZ-CB 3.75Å; R285-H288 HydrophobicContact CB-CB 4.26Å; R285-H288 VanDerWaalsContact O-CB 3.3Å; R285-H288 WeakPolarHBondContact O-CB 3.32Å; R285-H288 PolarHBondContact O-N 3.47Å; H286-H288 PolarHBondContact O-N 3.32Å; H288-Y294 CarbonylContact O-C 3.45Å; H288-Y294 WeakPolarHBondContact O-CA 3.46Å; H288-I295 PolarHBondContact O-N 2.83Å
289	H	93.6	Very high	95.5	Very high	105 Å²	105	56.7 Å²	56.7	49%	0.486	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.1	-173.3	-68	76.1	0	0	0	113.2	E27 R293	E27-H289 PolarHBondContact OE1-N 2.81Å; E27-H289 IonicContact OE1-ND1 2.7Å; E27-H289 IonicContact OE2-CE1 3.5Å; E27-H289 IonicContact OE2-CG 2.92Å; E27-H289 PolarHBondContact OE2-N 3.33Å; E27-H289 IonicContact OE2-ND1 2.81Å; E27-H289 PolarHBondContact OE2-ND1 3.49Å; H289-R293 WeakPolarHBondContact CA-O 3.42Å
290	M	92.3	Very high	95.5	Very high	23 Å²	23	56.8 Å²	56.8	11%	0.113	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	94.8	165.2	-173.9	-172.3	-74.1	0	0	108.3	P233 D240 F244 T292 R293 I295	P233-M290 HydrophobicContact CG-CG 4.44Å; P233-M290 HydrophobicContact CG-SD 4.32Å; D240-M290 HydrophobicContact CB-SD 4.47Å; F244-M290 HydrophobicContact CB-CE 3.38Å; F244-M290 HydrophobicContact CD2-CB 4.1Å; F244-M290 HydrophobicContact CD2-CE 4.13Å; F244-M290 HydrophobicContact CG-CE 3.78Å; M290-T292 PolarHBondContact O-N 2.91Å; M290-R293 PolarHBondContact N-O 2.99Å; M290-R293 PolarHBondContact O-N 2.92Å; M290-I295 HydrophobicContact CB-CD1 3.87Å; M290-I295 HydrophobicContact CB-CG1 3.64Å; M290-I295 HydrophobicContact CE-CG1 4.43Å; M290-I295 HydrophobicContact SD-CD1 4.41Å
291	G	87.9	Confident	95.4	Very high	71 Å²	71	56.1 Å²	56.1	73%	0.732	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-123	-170.3	0	0	0	0	0	110.7	R293	G291-R293 VanDerWaalsContact C-N 3.32Å
292	T	88.4	Confident	95.1	Very high	140 Å²	140	55.9 Å²	55.9	86%	0.859	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	8.5	-178.8	58.2	0	0	0	0	114	M290	M290-T292 PolarHBondContact O-N 2.91Å
293	R	93.4	Very high	94.8	Very high	107 Å²	107	61.7 Å²	61.7	40%	0.404	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.9	-173.1	-61.8	-69.3	-67.2	-112.3	-6.1	109.3	G231 P233 H289 M290 G291	G231-R293 PolarHBondContact O-NE 2.85Å; P233-R293 HydrophobicContact CG-CB 4.31Å; P233-R293 HydrophobicContact CG-CG 4.06Å; H289-R293 WeakPolarHBondContact CA-O 3.42Å; M290-R293 PolarHBondContact N-O 2.99Å; M290-R293 PolarHBondContact O-N 2.92Å; G291-R293 VanDerWaalsContact C-N 3.32Å
294	Y	95	Very high	94.6	Very high	121 Å²	121	62.2 Å²	62.2	48%	0.475	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	146.8	163.5	64.5	-100.9	0	0	0	109.5	K287 H288 E296	K287-Y294 HydrophobicContact CD-CD2 3.63Å; K287-Y294 HydrophobicContact CD-CE2 4.05Å; K287-Y294 HydrophobicContact CD-CG 4.27Å; H288-Y294 CarbonylContact O-C 3.45Å; H288-Y294 WeakPolarHBondContact O-CA 3.46Å; Y294-E296 HydrophobicContact CD2-CG 4.13Å; Y294-E296 HydrophobicContact CE2-CG 3.96Å
295	I	97.8	Very high	94.4	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.			trans	-109.8	129.2	179.5	-55.9	-55.8	0	0	0	109.2	A229 R230 L232 F244 K287 H288 M290 V297	A229-I295 HydrophobicContact CB-CG2 3.94Å; R230-I295 WeakPolarHBondContact O-CA 3.22Å; L232-I295 HydrophobicContact CG-CD1 4.31Å; F244-I295 HydrophobicContact CD2-CG1 4.21Å; F244-I295 HydrophobicContact CE1-CB 4.26Å; F244-I295 HydrophobicContact CE1-CG2 4.09Å; F244-I295 HydrophobicContact CE2-CB 3.88Å; F244-I295 HydrophobicContact CE2-CG1 3.79Å; F244-I295 HydrophobicContact CZ-CB 3.64Å; F244-I295 HydrophobicContact CZ-CG1 4.05Å; F244-I295 HydrophobicContact CZ-CG2 3.98Å; K287-I295 VanDerWaalsContact CA-O 3.31Å; K287-I295 WeakPolarHBondContact CA-O 3.45Å; K287-I295 PolarHBondContact N-O 2.9Å; H288-I295 PolarHBondContact O-N 2.83Å; M290-I295 HydrophobicContact CB-CD1 3.87Å; M290-I295 HydrophobicContact CB-CG1 3.64Å; M290-I295 HydrophobicContact CE-CG1 4.43Å; M290-I295 HydrophobicContact SD-CD1 4.41Å; I295-V297 HydrophobicContact CG2-CG2 4.27Å
296	E	97.7	Very high	94.1	Very high	45 Å²	45	60.3 Å²	60.3	21%	0.21	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.7	173.3	-55.1	-179.2	138.7	0	0	108.9	A229 R230 K287 Y294 Y298	A229-E296 CarbonylContact C-O 3.47Å; A229-E296 WeakPolarHBondContact CA-O 3.46Å; R230-E296 HydrophobicContact CB-CB 4.27Å; R230-E296 PolarHBondContact N-O 2.84Å; R230-E296 PolarHBondContact O-N 3.36Å; K287-E296 HydrophobicContact CD-CG 4.32Å; K287-E296 IonicContact NZ-OE1 2.78Å; K287-E296 PolarHBondContact NZ-OE1 2.7Å; Y294-E296 HydrophobicContact CD2-CG 4.13Å; Y294-E296 HydrophobicContact CE2-CG 3.96Å; E296-Y298 HydrophobicContact CB-CD2 4.32Å; E296-Y298 HydrophobicContact CB-CE2 3.49Å; E296-Y298 VanDerWaalsContact CB-CE2 3.49Å; E296-Y298 PolarHBondContact OE2-OH 2.78Å
297	V	98.1	Very high	93.7	Very high	5 Å²	5	63.5 Å²	63.5	3%	0.03	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.9	177.3	-166.1	0	0	0	0	109.1	V227 R228 F244 F245 L283 H286 I295	V227-V297 HydrophobicContact CB-CG1 3.77Å; V227-V297 HydrophobicContact CG1-CG1 4.01Å; V227-V297 HydrophobicContact CG2-CG1 3.92Å; R228-V297 WeakPolarHBondContact O-CA 3.4Å; F244-V297 HydrophobicContact CE1-CG2 4.12Å; F244-V297 HydrophobicContact CZ-CG2 4.45Å; F245-V297 HydrophobicContact CE1-CG1 4.35Å; F245-V297 HydrophobicContact CE1-CG2 4.22Å; F245-V297 HydrophobicContact CZ-CG1 4.18Å; F245-V297 HydrophobicContact CZ-CG2 4.05Å; L283-V297 HydrophobicContact CD2-CG1 4.19Å; H286-V297 PolarHBondContact ND1-N 2.82Å; H286-V297 VanDerWaalsContact ND1-N 3.18Å; H286-V297 PolarHBondContact ND1-O 3.34Å; I295-V297 HydrophobicContact CG2-CG2 4.27Å
298	Y	97.9	Very high	93.3	Very high	87 Å²	87	61.7 Å²	61.7	34%	0.341	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	156.3	179	-60.1	-72.1	0	0	0	110.9	V227 R228 H286 E296	V227-Y298 CarbonylContact C-O 3.56Å; V227-Y298 WeakPolarHBondContact CA-O 3.17Å; V227-Y298 WeakPolarHBondContact CB-O 3.37Å; R228-Y298 PolarHBondContact N-O 3.3Å; R228-Y298 PolarHBondContact O-N 3.41Å; H286-Y298 AromaticContact CE1-CE1 3.97Å; H286-Y298 AromaticContact CE1-CZ 3.96Å; E296-Y298 HydrophobicContact CB-CD2 4.32Å; E296-Y298 HydrophobicContact CB-CE2 3.49Å; E296-Y298 VanDerWaalsContact CB-CE2 3.49Å; E296-Y298 PolarHBondContact OE2-OH 2.78Å
299	K	97.3	Very high	92.9	Very high	132 Å²	132	60.9 Å²	60.9	57%	0.574	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	143.5	168.6	-67.9	-173.4	175.8	-166.8	0	110.2	L283	L283-K299 HydrophobicContact CD1-CD 4.17Å; L283-K299 HydrophobicContact CD1-CG 3.64Å; L283-K299 HydrophobicContact CD2-CG 4.01Å; L283-K299 HydrophobicContact CG-CG 4.47Å
300	A	96.6	Very high	92.3	Very high	11 Å²	11	56.3 Å²	56.3	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	169.4	172.9	0	0	0	0	0	109.9	D223 V226 R228 L270	D223-A300 VanDerWaalsContact O-O 3.05Å; V226-A300 HydrophobicContact CB-CB 4.47Å; V226-A300 HydrophobicContact CG1-CB 3.95Å; V226-A300 PolarHBondContact O-N 3.44Å; V226-A300 VanDerWaalsContact O-N 3.11Å; R228-A300 HydrophobicContact CB-CB 4.04Å; L270-A300 HydrophobicContact CD2-CB 3.62Å
301	T	94.8	Very high	91.3	Very high	45 Å²	45	55.8 Å²	55.8	28%	0.276	29%	0.288	S	S	.	.			trans	-100.7	160	-178	61.5	0	0	0	0	111.9	D223 E303 D304 F305	D223-T301 HydrophobicContact CB-CG2 4.43Å; D223-T301 WeakPolarHBondContact OD1-CB 3.4Å; T301-E303 VanDerWaalsContact C-N 3.25Å; T301-E303 PolarHBondContact O-N 3.2Å; T301-D304 PolarHBondContact O-N 3.12Å; T301-D304 VanDerWaalsContact OG1-CG 3.27Å; T301-D304 PolarHBondContact OG1-N 3.23Å; T301-F305 PolarHBondContact O-N 3.32Å
302	G	92.1	Very high	90.1	Very high	1 Å²	1	57 Å²	57	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-36.1	171	0	0	0	0	0	111.6	D223 D304 F305 L306	D223-G302 PolarHBondContact OD1-N 2.82Å; G302-D304 PolarHBondContact O-N 2.82Å; G302-F305 WeakPolarHBondContact O-CB 3.39Å; G302-F305 PolarHBondContact O-N 3.09Å; G302-L306 WeakPolarHBondContact O-CG 3.48Å; G302-L306 PolarHBondContact O-N 3.31Å
303	E	91.6	Very high	89.2	Confident	123 Å²	123	52.5 Å²	52.5	58%	0.575	26%	0.255	S	S	*	.	H	α-helix	trans	-59.7	-43.6	173	-66.1	-169.8	172	0	0	112.7	T301 F305 L306 K307	T301-E303 VanDerWaalsContact C-N 3.25Å; T301-E303 PolarHBondContact O-N 3.2Å; E303-F305 VanDerWaalsContact C-N 3.29Å; E303-F305 PolarHBondContact O-N 3.31Å; E303-L306 PolarHBondContact O-N 2.98Å; E303-K307 VanDerWaalsContact O-CG 3.25Å; E303-K307 WeakPolarHBondContact O-CG 3.47Å; E303-K307 PolarHBondContact O-N 3.11Å; E303-K307 IonicContact OE2-NZ 3.28Å
304	D	92	Very high	88.2	Confident	50 Å²	50	53.6 Å²	53.6	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-39.4	177.7	-75.5	-11.5	0	0	0	110.9	L270 T301 G302 K307	L270-D304 VanDerWaalsContact CD1-C 3.5Å; L270-D304 HydrophobicContact CD1-CB 4.23Å; L270-D304 WeakPolarHBondContact CD1-O 3.49Å; T301-D304 PolarHBondContact O-N 3.12Å; T301-D304 VanDerWaalsContact OG1-CG 3.27Å; T301-D304 PolarHBondContact OG1-N 3.23Å; G302-D304 PolarHBondContact O-N 2.82Å; D304-K307 PolarHBondContact O-N 2.9Å; D304-K307 IonicContact OD1-NZ 3.42Å; D304-K307 PolarHBondContact OD1-NZ 3.03Å
305	F	92.9	Very high	87.3	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-49	173.2	-172.1	-87.7	0	0	0	111.5	C215 I221 V226 A256 L270 R272 T301 G302 E303 K307 I308 A309	C215-F305 HydrophobicContact CB-CE1 4.02Å; I221-F305 HydrophobicContact CD1-CB 4.4Å; I221-F305 HydrophobicContact CD1-CD1 3.36Å; I221-F305 HydrophobicContact CD1-CE1 3.98Å; I221-F305 HydrophobicContact CD1-CG 4.2Å; V226-F305 HydrophobicContact CG1-CB 4.05Å; V226-F305 HydrophobicContact CG1-CD2 4.3Å; V226-F305 HydrophobicContact CG2-CB 4.24Å; A256-F305 HydrophobicContact CB-CD2 4.47Å; A256-F305 HydrophobicContact CB-CE2 3.9Å; A256-F305 HydrophobicContact CB-CZ 4.29Å; L270-F305 HydrophobicContact CB-CD2 3.8Å; L270-F305 HydrophobicContact CB-CE2 4.49Å; R272-F305 HydrophobicContact CB-CD2 4.12Å; R272-F305 HydrophobicContact CB-CE2 3.96Å; R272-F305 HydrophobicContact CB-CZ 4.21Å; T301-F305 PolarHBondContact O-N 3.32Å; G302-F305 WeakPolarHBondContact O-CB 3.39Å; G302-F305 PolarHBondContact O-N 3.09Å; E303-F305 VanDerWaalsContact C-N 3.29Å; E303-F305 PolarHBondContact O-N 3.31Å; F305-K307 VanDerWaalsContact C-N 3.33Å; F305-K307 PolarHBondContact O-N 3.19Å; F305-I308 PolarHBondContact O-N 3.17Å; F305-I308 VanDerWaalsContact O-N 3.08Å; F305-A309 HydrophobicContact CD1-CB 3.9Å; F305-A309 HydrophobicContact CE1-CB 3.47Å; F305-A309 VanDerWaalsContact CE1-CB 3.47Å; F305-A309 HydrophobicContact CE2-CB 4.4Å; F305-A309 HydrophobicContact CZ-CB 3.74Å; F305-A309 WeakPolarHBondContact O-CB 3.2Å; F305-A309 PolarHBondContact O-N 3.06Å
306	L	90.5	Very high	86.3	Confident	32 Å²	32	53.1 Å²	53.1	17%	0.168	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-31.5	-179.6	-71.5	171.9	0	0	0	113.2	E219 I221 G302 E303 I308 G310	E219-L306 WeakPolarHBondContact O-CD1 3.12Å; I221-L306 HydrophobicContact CD1-CD1 4.37Å; I221-L306 HydrophobicContact CD1-CD2 3.56Å; I221-L306 HydrophobicContact CD1-CG 3.67Å; I221-L306 HydrophobicContact CG1-CD1 4.36Å; I221-L306 HydrophobicContact CG1-CD2 4.16Å; I221-L306 HydrophobicContact CG1-CG 4.19Å; G302-L306 WeakPolarHBondContact O-CG 3.48Å; G302-L306 PolarHBondContact O-N 3.31Å; E303-L306 PolarHBondContact O-N 2.98Å; L306-I308 PolarHBondContact O-N 3.45Å; L306-G310 WeakPolarHBondContact O-CA 3.49Å; L306-G310 PolarHBondContact O-N 3.32Å
307	K	87.4	Confident	85.4	Confident	136 Å²	136	53.6 Å²	53.6	59%	0.591	28%	0.283	S	S	*	.	H	α-helix	trans	-60.5	-30.2	173.5	-74.3	165.8	-158.7	157	0	112.1	E303 D304 F305	E303-K307 VanDerWaalsContact O-CG 3.25Å; E303-K307 WeakPolarHBondContact O-CG 3.47Å; E303-K307 PolarHBondContact O-N 3.11Å; E303-K307 IonicContact OE2-NZ 3.28Å; D304-K307 PolarHBondContact O-N 2.9Å; D304-K307 IonicContact OD1-NZ 3.42Å; D304-K307 PolarHBondContact OD1-NZ 3.03Å; F305-K307 VanDerWaalsContact C-N 3.33Å; F305-K307 PolarHBondContact O-N 3.19Å
308	I	87.6	Confident	84.5	Confident	43 Å²	43	60.4 Å²	60.4	22%	0.221	32%	0.315	C	S	.	.	H	α-helix	trans	-99.2	-41.7	-176.1	-59.3	-56.1	0	0	0	111.8	A256 L270 F305 L306 Q411	A256-I308 HydrophobicContact CB-CG2 4.02Å; L270-I308 HydrophobicContact CD1-CB 4.23Å; L270-I308 HydrophobicContact CD1-CG1 3.77Å; F305-I308 PolarHBondContact O-N 3.17Å; F305-I308 VanDerWaalsContact O-N 3.08Å; L306-I308 PolarHBondContact O-N 3.45Å; I308-Q411 HydrophobicContact CG2-CG 4.34Å; I308-Q411 VanDerWaalsContact O-CG 3.23Å; I308-Q411 WeakPolarHBondContact O-CG 3.44Å
309	A	86.2	Confident	83.8	Confident	2 Å²	2	57.1 Å²	57.1	2%	0.017	30%	0.302	C	S	.	.	H	α-helix	trans	-109.8	-5.2	-172	0	0	0	0	0	114.5	C215 A256 F305 G311 A407 Q410	C215-A309 HydrophobicContact CB-CB 4.32Å; C215-A309 WeakPolarHBondContact CB-O 3.48Å; A256-A309 HydrophobicContact CB-CB 3.82Å; F305-A309 HydrophobicContact CD1-CB 3.9Å; F305-A309 HydrophobicContact CE1-CB 3.47Å; F305-A309 VanDerWaalsContact CE1-CB 3.47Å; F305-A309 HydrophobicContact CE2-CB 4.4Å; F305-A309 HydrophobicContact CZ-CB 3.74Å; F305-A309 WeakPolarHBondContact O-CB 3.2Å; F305-A309 PolarHBondContact O-N 3.06Å; A309-G311 PolarHBondContact O-N 3.46Å; A309-A407 HydrophobicContact CB-CB 3.9Å; A309-Q410 PolarHBondContact O-OE1 2.7Å
310	G	81.3	Confident	83	Confident	8 Å²	8	52.2 Å²	52.2	8%	0.082	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	106.5	180	0	0	0	0	0	111.3	L306	L306-G310 WeakPolarHBondContact O-CA 3.49Å; L306-G310 PolarHBondContact O-N 3.32Å
311	G	69.9	Low	82	Confident	12 Å²	12	55.5 Å²	55.5	12%	0.124	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	150.3	176.6	0	0	0	0	0	113.1	C215 K217 A309 Q410	C215-G311 PolarHBondContact O-N 3.15Å; K217-G311 PolarHBondContact N-O 3.17Å; A309-G311 PolarHBondContact O-N 3.46Å; G311-Q410 VanDerWaalsContact CA-CD 3.41Å; G311-Q410 VanDerWaalsContact CA-OE1 3.32Å
312	T	63.7	Low	80.9	Confident	98 Å²	98	58.2 Å²	58.2	60%	0.601	31%	0.313	S	S	*	.			trans	-129.9	0.6	170.3	57.9	0	0	0	0	113.5	K217	K217-T312 HydrophobicContact CB-CG2 3.59Å; K217-T312 HydrophobicContact CD-CG2 3.63Å; K217-T312 HydrophobicContact CG-CG2 4.22Å
313	S	69.5	Low	79.7	Confident	44 Å²	44	64.7 Å²	64.7	31%	0.308	34%	0.342	S	S	.	.			trans	-84	121.6	-174.9	-178.2	0	0	0	0	111.6	E315 V316 A317	S313-E315 VanDerWaalsContact C-N 3.26Å; S313-E315 PolarHBondContact O-N 2.98Å; S313-V316 PolarHBondContact O-N 3.14Å; S313-A317 PolarHBondContact O-N 3.07Å
314	N	73.1	Confident	78.6	Confident	130 Å²	130	66 Å²	66	70%	0.695	35%	0.353	S	S	*	.	H	α-helix	trans	-61.3	-33.8	176.1	-73.7	-20.6	0	0	0	112.6	V316 A317 Q318	N314-V316 VanDerWaalsContact C-N 3.34Å; N314-A317 PolarHBondContact O-N 3.43Å; N314-Q318 WeakPolarHBondContact O-CG 3.5Å; N314-Q318 PolarHBondContact O-N 3.37Å
315	E	75.6	Confident	78.1	Confident	108 Å²	108	65 Å²	65	51%	0.505	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-42	176.5	-176.6	-179.2	-166	0	0	111	S313 Q318 F319 L360	S313-E315 VanDerWaalsContact C-N 3.26Å; S313-E315 PolarHBondContact O-N 2.98Å; E315-Q318 PolarHBondContact O-N 2.81Å; E315-F319 WeakPolarHBondContact O-CB 3.46Å; E315-F319 PolarHBondContact O-N 3.3Å; E315-L360 HydrophobicContact CG-CD1 4.22Å; E315-L360 WeakPolarHBondContact OE1-CD1 3.38Å
316	V	76.4	Confident	77.8	Confident	4 Å²	4	66 Å²	66	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-68.3	-39.7	175.9	-178.5	0	0	0	0	111	S313 N314 Q318 F319 L320 V409 Q410 L413	S313-V316 PolarHBondContact O-N 3.14Å; N314-V316 VanDerWaalsContact C-N 3.34Å; V316-Q318 VanDerWaalsContact C-N 3.31Å; V316-Q318 PolarHBondContact O-N 2.76Å; V316-F319 PolarHBondContact O-N 3.27Å; V316-L320 HydrophobicContact CG1-CD1 3.49Å; V316-L320 VanDerWaalsContact CG1-CD1 3.49Å; V316-L320 HydrophobicContact CG1-CG 4.08Å; V316-L320 VanDerWaalsContact O-CB 3.27Å; V316-L320 WeakPolarHBondContact O-CB 3.36Å; V316-L320 VanDerWaalsContact O-CG 3.27Å; V316-L320 WeakPolarHBondContact O-CG 3.5Å; V316-L320 PolarHBondContact O-N 3.44Å; V316-V409 HydrophobicContact CG1-CG1 4.01Å; V316-V409 HydrophobicContact CG2-CG1 4.44Å; V316-Q410 HydrophobicContact CG1-CG 3.72Å; V316-L413 HydrophobicContact CG2-CD1 3.22Å
317	A	77.9	Confident	77.8	Confident	54 Å²	54	65.2 Å²	65.2	45%	0.446	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-39.1	174.8	0	0	0	0	0	111.7	S313 N314 L320 S321	S313-A317 PolarHBondContact O-N 3.07Å; N314-A317 PolarHBondContact O-N 3.43Å; A317-L320 CarbonylContact O-C 3.5Å; A317-S321 VanDerWaalsContact O-CA 3.32Å; A317-S321 WeakPolarHBondContact O-CA 3.44Å; A317-S321 VanDerWaalsContact O-CB 3.26Å; A317-S321 WeakPolarHBondContact O-CB 3.38Å; A317-S321 PolarHBondContact O-N 3Å
318	Q	80.4	Confident	78.1	Confident	148 Å²	148	58.8 Å²	58.8	69%	0.692	32%	0.321	S	S	*	.	H	α-helix	trans	-68.5	-45.3	174.5	-76	-179	-4	0	0	112.1	N314 E315 V316 L320 S321	N314-Q318 WeakPolarHBondContact O-CG 3.5Å; N314-Q318 PolarHBondContact O-N 3.37Å; E315-Q318 PolarHBondContact O-N 2.81Å; V316-Q318 VanDerWaalsContact C-N 3.31Å; V316-Q318 PolarHBondContact O-N 2.76Å; Q318-L320 VanDerWaalsContact C-N 3.29Å; Q318-L320 PolarHBondContact O-N 3.33Å; Q318-S321 VanDerWaalsContact O-CB 3.32Å; Q318-S321 WeakPolarHBondContact O-CB 3.3Å; Q318-S321 PolarHBondContact O-N 2.85Å; Q318-S321 PolarHBondContact O-OG 3.43Å
319	F	82.4	Confident	78.4	Confident	18 Å²	18	56.9 Å²	56.9	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-60.2	-40.3	177	-179.1	-106.9	0	0	0	111.9	E315 V316 L360 F374 L376 V409	E315-F319 WeakPolarHBondContact O-CB 3.46Å; E315-F319 PolarHBondContact O-N 3.3Å; V316-F319 PolarHBondContact O-N 3.27Å; F319-L360 HydrophobicContact CB-CD2 4.2Å; F319-L360 HydrophobicContact CD1-CB 4.38Å; F319-L360 HydrophobicContact CD1-CD2 3.83Å; F319-L360 HydrophobicContact CD2-CB 3.64Å; F319-L360 HydrophobicContact CD2-CD2 4.22Å; F319-L360 HydrophobicContact CD2-CG 4.45Å; F319-L360 HydrophobicContact CE1-CB 4.21Å; F319-L360 HydrophobicContact CE1-CD2 4.2Å; F319-L360 HydrophobicContact CE2-CB 3.42Å; F319-L360 VanDerWaalsContact CE2-CB 3.42Å; F319-L360 HydrophobicContact CG-CB 4.11Å; F319-L360 HydrophobicContact CG-CD2 3.83Å; F319-L360 HydrophobicContact CZ-CB 3.73Å; F319-F374 HydrophobicContact CE1-CB 3.94Å; F319-F374 HydrophobicContact CZ-CB 3.81Å; F319-L376 HydrophobicContact CD1-CD1 4.33Å; F319-L376 HydrophobicContact CD1-CD2 4.31Å; F319-L376 HydrophobicContact CD2-CD1 3.69Å; F319-L376 HydrophobicContact CD2-CG 4.31Å; F319-L376 HydrophobicContact CE1-CD1 4.14Å; F319-L376 HydrophobicContact CE1-CD2 3.62Å; F319-L376 HydrophobicContact CE1-CG 3.91Å; F319-L376 HydrophobicContact CE2-CD1 3.46Å; F319-L376 VanDerWaalsContact CE2-CD1 3.46Å; F319-L376 HydrophobicContact CE2-CD2 4.28Å; F319-L376 HydrophobicContact CE2-CG 3.61Å; F319-L376 HydrophobicContact CG-CD1 4.13Å; F319-L376 HydrophobicContact CZ-CD1 3.72Å; F319-L376 HydrophobicContact CZ-CD2 3.62Å; F319-L376 HydrophobicContact CZ-CG 3.38Å; F319-L376 WeakPolarHBondContact O-CD1 3.37Å; F319-V409 HydrophobicContact CD1-CG1 4.38Å; F319-V409 HydrophobicContact CE1-CG2 4.49Å
320	L	80.9	Confident	78.8	Confident	30 Å²	30	56.8 Å²	56.8	16%	0.157	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	7.5	-179.7	-57.7	178.3	0	0	0	113.6	T214 V316 A317 Q318 K322 I327 A406	T214-L320 HydrophobicContact CG2-CB 3.76Å; T214-L320 HydrophobicContact CG2-CD1 3.32Å; T214-L320 HydrophobicContact CG2-CG 4.18Å; V316-L320 HydrophobicContact CG1-CD1 3.49Å; V316-L320 VanDerWaalsContact CG1-CD1 3.49Å; V316-L320 HydrophobicContact CG1-CG 4.08Å; V316-L320 VanDerWaalsContact O-CB 3.27Å; V316-L320 WeakPolarHBondContact O-CB 3.36Å; V316-L320 VanDerWaalsContact O-CG 3.27Å; V316-L320 WeakPolarHBondContact O-CG 3.5Å; V316-L320 PolarHBondContact O-N 3.44Å; A317-L320 CarbonylContact O-C 3.5Å; Q318-L320 VanDerWaalsContact C-N 3.29Å; Q318-L320 PolarHBondContact O-N 3.33Å; L320-K322 PolarHBondContact O-N 3.4Å; L320-I327 HydrophobicContact CD2-CD1 3.54Å; L320-I327 HydrophobicContact CD2-CG1 4.31Å; L320-A406 HydrophobicContact CD1-CB 3.7Å
321	S	76.3	Confident	79.3	Confident	80 Å²	80	58.3 Å²	58.3	56%	0.559	31%	0.314	S	S	*	.			trans	-67.4	-23.4	-176.3	62.3	0	0	0	0	113.1	A317 Q318	A317-S321 VanDerWaalsContact O-CA 3.32Å; A317-S321 WeakPolarHBondContact O-CA 3.44Å; A317-S321 VanDerWaalsContact O-CB 3.26Å; A317-S321 WeakPolarHBondContact O-CB 3.38Å; A317-S321 PolarHBondContact O-N 3Å; Q318-S321 VanDerWaalsContact O-CB 3.32Å; Q318-S321 WeakPolarHBondContact O-CB 3.3Å; Q318-S321 PolarHBondContact O-N 2.85Å; Q318-S321 PolarHBondContact O-OG 3.43Å
322	K	71.3	Confident	80.3	Confident	102 Å²	102	58.7 Å²	58.7	44%	0.443	32%	0.317	S	S	.	.	S	Bend	trans	-85.4	120	-179.2	-67.3	177.5	-177.4	171.5	0	109.3	L320 Q325	L320-K322 PolarHBondContact O-N 3.4Å; K322-Q325 VanDerWaalsContact CB-CD 3.41Å; K322-Q325 HydrophobicContact CB-CG 4.17Å; K322-Q325 VanDerWaalsContact CD-NE2 3.27Å
323	E	65.8	Low	81.8	Confident	136 Å²	136	54.3 Å²	54.3	64%	0.636	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	159.7	179.2	-57.6	-161.4	133.6	0	0	112.4	K252 Q325	K252-E323 IonicContact NZ-OE1 3.99Å; K252-E323 PolarHBondContact NZ-OE1 2.94Å; E323-Q325 VanDerWaalsContact C-N 3.34Å; E323-Q325 PolarHBondContact O-N 3.46Å
324	N	68.4	Low	83	Confident	150 Å²	150	53.5 Å²	53.5	80%	0.802	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	31.9	175.3	-61.3	-31.4	0	0	0	116
325	Q	82.8	Confident	83.9	Confident	30 Å²	30	54.5 Å²	54.5	14%	0.14	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-100.8	146.8	177.3	-62.5	-171.1	-20.6	0	0	112.8	K322 E323 L376 F377	K322-Q325 VanDerWaalsContact CB-CD 3.41Å; K322-Q325 HydrophobicContact CB-CG 4.17Å; K322-Q325 VanDerWaalsContact CD-NE2 3.27Å; E323-Q325 VanDerWaalsContact C-N 3.34Å; E323-Q325 PolarHBondContact O-N 3.46Å; Q325-L376 HydrophobicContact CB-CD2 4.35Å; Q325-F377 WeakPolarHBondContact CA-O 3.43Å
326	V	87	Confident	84.7	Confident	22 Å²	22	55 Å²	55	13%	0.133	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.3	174.6	-174.2	0	0	0	0	109.1	F377 A383	V326-F377 HydrophobicContact CB-CB 4.49Å; V326-F377 PolarHBondContact N-O 3.43Å; V326-F377 PolarHBondContact O-N 2.81Å; V326-A383 HydrophobicContact CB-CB 3.72Å; V326-A383 HydrophobicContact CG1-CB 3.33Å; V326-A383 HydrophobicContact CG2-CB 4.45Å
327	I	90.7	Very high	85.5	Confident	15 Å²	15	55.6 Å²	55.6	8%	0.077	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.9	-176.1	-48.1	166.7	0	0	0	108.9	L320 F374 V375 L376 S404 V409	L320-I327 HydrophobicContact CD2-CD1 3.54Å; L320-I327 HydrophobicContact CD2-CG1 4.31Å; I327-F374 HydrophobicContact CG2-CB 4.23Å; I327-F374 HydrophobicContact CG2-CD1 3.9Å; I327-F374 HydrophobicContact CG2-CG 4.49Å; I327-V375 WeakPolarHBondContact CA-O 3.3Å; I327-L376 HydrophobicContact CG1-CD2 3.85Å; I327-S404 PolarHBondContact O-N 3.43Å; I327-V409 HydrophobicContact CD1-CG2 4.16Å; I327-V409 HydrophobicContact CG2-CG2 3.92Å
328	V	92.8	Very high	86.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129	170.2	177.4	0	0	0	0	108.9	F374 V375 F377 A383 L387 L401 F402	V328-F374 CarbonylContact O-C 3.57Å; V328-F374 WeakPolarHBondContact O-CA 3.23Å; V328-V375 PolarHBondContact N-O 2.81Å; V328-V375 PolarHBondContact O-N 3.44Å; V328-F377 HydrophobicContact CB-CD2 4.31Å; V328-F377 HydrophobicContact CB-CE2 3.85Å; V328-F377 HydrophobicContact CG2-CD2 3.79Å; V328-F377 HydrophobicContact CG2-CE2 3.67Å; V328-A383 HydrophobicContact CG2-CB 4.2Å; V328-L387 HydrophobicContact CG1-CD2 4.16Å; V328-L387 HydrophobicContact CG2-CD2 4.48Å; V328-L401 HydrophobicContact CG1-CB 4.18Å; V328-L401 HydrophobicContact CG1-CD2 4.28Å; V328-F402 CarbonylContact C-O 3.58Å; V328-F402 WeakPolarHBondContact CA-O 3.2Å; V328-F402 WeakPolarHBondContact CG1-O 3.24Å
329	R	92.9	Very high	86.8	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.015	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.1	171.3	-179.7	176.9	177.8	-173.3	0	110.3	G263 R331 D372 A373 F374 L401 F402 S404 E408	G263-R329 PolarHBondContact O-NH1 2.87Å; G263-R329 PolarHBondContact O-NH2 3.16Å; G263-R329 VanDerWaalsContact O-NH2 3.14Å; R329-R331 HydrophobicContact CG-CG 4.18Å; R329-D372 IonicContact CZ-OD2 2.75Å; R329-D372 IonicContact NE-OD2 3.05Å; R329-D372 PolarHBondContact NE-OD2 2.87Å; R329-D372 IonicContact NH2-OD2 3.76Å; R329-D372 PolarHBondContact NH2-OD2 2.66Å; R329-A373 CarbonylContact C-O 3.57Å; R329-A373 WeakPolarHBondContact CA-O 3.41Å; R329-F374 HydrophobicContact CB-CD1 3.77Å; R329-F374 HydrophobicContact CB-CE1 3.64Å; R329-F374 HydrophobicContact CG-CD1 4.15Å; R329-F374 HydrophobicContact CG-CE1 3.77Å; R329-F374 HydrophobicContact CG-CZ 4.18Å; R329-L401 WeakPolarHBondContact O-CA 3.29Å; R329-F402 PolarHBondContact N-O 3.15Å; R329-F402 PolarHBondContact O-N 2.86Å; R329-S404 WeakPolarHBondContact CB-OG 3.43Å; R329-E408 VanDerWaalsContact CD-OE1 3.29Å; R329-E408 WeakPolarHBondContact CD-OE1 3.3Å; R329-E408 IonicContact CZ-OE1 3.38Å; R329-E408 IonicContact NE-OE1 2.73Å; R329-E408 IonicContact NH1-OE1 3.61Å; R329-E408 PolarHBondContact NH1-OE1 3.41Å
330	M	94.5	Very high	87.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.1	169.8	-52.5	-177.2	78.5	0	0	109.1	L333 V342 F345 F346 D372 A373 V375 I399 E400 L401	M330-L333 HydrophobicContact CB-CD1 4.09Å; M330-L333 HydrophobicContact CB-CG 4.32Å; M330-L333 HydrophobicContact CE-CD2 3.94Å; M330-L333 HydrophobicContact SD-CD2 4.45Å; M330-V342 HydrophobicContact CE-CG1 4.11Å; M330-V342 HydrophobicContact SD-CG1 3.61Å; M330-V342 HydrophobicContact SD-CG2 4.47Å; M330-F345 HydrophobicContact CE-CD1 3.86Å; M330-F345 HydrophobicContact CE-CE1 4.02Å; M330-F346 HydrophobicContact CE-CE2 3.59Å; M330-F346 HydrophobicContact CE-CZ 3.7Å; M330-F346 HydrophobicContact CG-CE2 4.44Å; M330-F346 HydrophobicContact CG-CZ 4.22Å; M330-F346 HydrophobicContact SD-CE2 3.54Å; M330-F346 VanDerWaalsContact SD-CE2 3.54Å; M330-F346 HydrophobicContact SD-CZ 3.85Å; M330-D372 VanDerWaalsContact O-CA 3.3Å; M330-D372 WeakPolarHBondContact O-CA 3.31Å; M330-A373 HydrophobicContact CB-CB 4.47Å; M330-A373 PolarHBondContact N-O 3.45Å; M330-A373 PolarHBondContact O-N 3.33Å; M330-V375 HydrophobicContact CG-CG2 4Å; M330-V375 HydrophobicContact SD-CG2 3.53Å; M330-V375 VanDerWaalsContact SD-CG2 3.53Å; M330-I399 HydrophobicContact CB-CG2 4.17Å; M330-I399 HydrophobicContact CE-CG2 3.8Å; M330-E400 CarbonylContact C-O 3.58Å; M330-E400 WeakPolarHBondContact CA-O 3.48Å; M330-L401 HydrophobicContact CB-CD2 4.15Å; M330-L401 HydrophobicContact CE-CD2 4.09Å; M330-L401 HydrophobicContact CG-CD2 3.62Å
331	R	92.4	Very high	88	Confident	39 Å²	39	56 Å²	56	15%	0.147	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	148.4	171.4	-54.1	-170.2	76.4	173.7	4.8	111.1	Q262 G263 R264 R329 D372 E400 F402	Q262-R331 PolarHBondContact O-NH2 3.38Å; G263-R331 PolarHBondContact O-NH1 3.07Å; R264-R331 VanDerWaalsContact CG-NH1 3.31Å; R329-R331 HydrophobicContact CG-CG 4.18Å; R331-D372 WeakPolarHBondContact CB-OD1 3.41Å; R331-D372 WeakPolarHBondContact CG-OD1 3.36Å; R331-D372 IonicContact CZ-OD2 3.74Å; R331-D372 IonicContact NE-OD1 2.71Å; R331-D372 PolarHBondContact NE-OD1 3.5Å; R331-D372 IonicContact NE-OD2 2.69Å; R331-D372 PolarHBondContact NE-OD2 3Å; R331-D372 IonicContact NH2-OD2 3.75Å; R331-E400 HydrophobicContact CB-CB 4.33Å; R331-E400 PolarHBondContact N-O 3.37Å; R331-E400 PolarHBondContact O-N 3.23Å; R331-F402 HydrophobicContact CB-CE2 4.49Å; R331-F402 HydrophobicContact CG-CD2 4.26Å; R331-F402 HydrophobicContact CG-CE2 4.08Å
332	G	92.1	Very high	88.9	Confident	20 Å²	20	52.1 Å²	52.1	21%	0.206	27%	0.271	C	S	.	.	S	Bend	trans	86.2	16.7	177.1	0	0	0	0	0	114.3	G371 R397 I399	G332-G371 PolarHBondContact N-O 3.41Å; G332-R397 WeakPolarHBondContact O-CB 3.27Å; G332-I399 WeakPolarHBondContact O-CD1 3.37Å
333	L	94.7	Very high	90	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.031	27%	0.265	C	S	.	.			trans	-56.8	137.1	174.7	-70.6	166.4	0	0	0	110.5	M330 A337 V342 F361 G371 A373 L394 I399	M330-L333 HydrophobicContact CB-CD1 4.09Å; M330-L333 HydrophobicContact CB-CG 4.32Å; M330-L333 HydrophobicContact CE-CD2 3.94Å; M330-L333 HydrophobicContact SD-CD2 4.45Å; L333-A337 HydrophobicContact CB-CB 4.35Å; L333-A337 HydrophobicContact CD2-CB 4.48Å; L333-V342 HydrophobicContact CD2-CG2 4.14Å; L333-F361 HydrophobicContact CD1-CD1 4.43Å; L333-F361 HydrophobicContact CD1-CE1 4.11Å; L333-G371 WeakPolarHBondContact CB-O 3.23Å; L333-G371 PolarHBondContact N-O 3.19Å; L333-A373 HydrophobicContact CD1-CB 3.42Å; L333-A373 VanDerWaalsContact CD1-CB 3.42Å; L333-L394 HydrophobicContact CD2-CD1 3.92Å; L333-I399 HydrophobicContact CD2-CD1 3.94Å; L333-I399 HydrophobicContact CD2-CG1 4.48Å; L333-I399 HydrophobicContact CG-CD1 4.38Å
334	P	93.4	Very high	91.3	Very high	27 Å²	27	46.8 Å²	46.8	18%	0.175	26%	0.263	C	S	.	.			trans	-51.6	142.4	166.2	-22.6	30.9	0	0	0	111	T336 A337 L394 R397	P334-T336 PolarHBondContact O-N 3.09Å; P334-T336 VanDerWaalsContact O-N 3.14Å; P334-A337 HydrophobicContact CB-CB 4.3Å; P334-A337 WeakPolarHBondContact O-CB 3.2Å; P334-A337 PolarHBondContact O-N 2.79Å; P334-L394 HydrophobicContact CG-CD2 3.84Å; P334-L394 WeakPolarHBondContact CG-O 3.27Å; P334-R397 HydrophobicContact CB-CG 4.48Å; P334-R397 HydrophobicContact CG-CB 4.09Å; P334-R397 HydrophobicContact CG-CG 3.88Å
335	F	92.4	Very high	92.5	Very high	152 Å²	152	40.5 Å²	40.5	67%	0.667	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.6	178.2	-59.9	-34.5	0	0	0	113.7	P369	F335-P369 HydrophobicContact CB-CG 3.8Å; F335-P369 HydrophobicContact CD1-CG 4.23Å; F335-P369 HydrophobicContact CG-CG 4.31Å; F335-P369 VanDerWaalsContact O-CG 3.31Å; F335-P369 WeakPolarHBondContact O-CG 3.38Å
336	T	92	Very high	93	Very high	117 Å²	117	39.1 Å²	39.1	72%	0.718	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	4.6	173.5	57.1	0	0	0	0	112.8	P334 T338	P334-T336 PolarHBondContact O-N 3.09Å; P334-T336 VanDerWaalsContact O-N 3.14Å; T336-T338 PolarHBondContact O-N 3.27Å
337	A	93.3	Very high	93	Very high	17 Å²	17	39.6 Å²	39.6	14%	0.14	23%	0.231	C	C	.	.			trans	-64.2	132.2	-175.1	0	0	0	0	0	111	L333 P334 E341 L394	L333-A337 HydrophobicContact CB-CB 4.35Å; L333-A337 HydrophobicContact CD2-CB 4.48Å; P334-A337 HydrophobicContact CB-CB 4.3Å; P334-A337 WeakPolarHBondContact O-CB 3.2Å; P334-A337 PolarHBondContact O-N 2.79Å; A337-E341 VanDerWaalsContact CA-OE2 3.27Å; A337-E341 WeakPolarHBondContact CA-OE2 3.21Å; A337-L394 HydrophobicContact CB-CD2 4.31Å
338	T	93.9	Very high	92.6	Very high	58 Å²	58	47.9 Å²	47.9	36%	0.356	27%	0.27	S	S	.	.			trans	-102	160.6	179.2	60.3	0	0	0	0	111.5	T336 E340 E341 V342	T336-T338 PolarHBondContact O-N 3.27Å; T338-E340 WeakPolarHBondContact CB-OE2 3.31Å; T338-E340 PolarHBondContact O-N 3.17Å; T338-E341 PolarHBondContact N-OE2 3.08Å; T338-E341 PolarHBondContact O-N 3.47Å; T338-E341 VanDerWaalsContact OG1-CG 3.27Å; T338-E341 WeakPolarHBondContact OG1-CG 3.19Å; T338-E341 PolarHBondContact OG1-N 3.49Å; T338-E341 PolarHBondContact OG1-OE2 2.88Å; T338-V342 PolarHBondContact O-N 3.3Å; T338-V342 VanDerWaalsContact O-N 3.14Å
339	A	93.6	Very high	91.9	Very high	19 Å²	19	55.5 Å²	55.5	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-35.4	175.5	0	0	0	0	0	111.3	V342 V343 K356 I359 F361	A339-V342 PolarHBondContact O-N 3.38Å; A339-V343 VanDerWaalsContact O-CG2 3.3Å; A339-V343 WeakPolarHBondContact O-CG2 3.25Å; A339-V343 PolarHBondContact O-N 2.8Å; A339-K356 HydrophobicContact CB-CB 4.03Å; A339-K356 HydrophobicContact CB-CD 4.28Å; A339-K356 HydrophobicContact CB-CG 3.95Å; A339-I359 HydrophobicContact CB-CD1 4.19Å; A339-F361 HydrophobicContact CB-CE2 4.12Å
340	E	94.2	Very high	91.6	Very high	95 Å²	95	55.6 Å²	55.6	44%	0.444	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-44.1	176.4	-65.5	73.9	-167	0	0	112	T338 V342 V343 A344 K356	T338-E340 WeakPolarHBondContact CB-OE2 3.31Å; T338-E340 PolarHBondContact O-N 3.17Å; E340-V342 VanDerWaalsContact C-N 3.33Å; E340-V343 PolarHBondContact O-N 3.22Å; E340-A344 WeakPolarHBondContact O-CB 3.49Å; E340-A344 PolarHBondContact O-N 3.25Å; E340-K356 WeakPolarHBondContact OE1-CD 3.27Å; E340-K356 WeakPolarHBondContact OE1-CE 3Å; E340-K356 IonicContact OE1-NZ 2.72Å; E340-K356 PolarHBondContact OE1-NZ 2.95Å
341	E	93.9	Very high	91.3	Very high	86 Å²	86	58.2 Å²	58.2	40%	0.402	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-36.2	176.8	-73.6	168.9	145.7	0	0	111.9	A337 T338 A344 F345 L394	A337-E341 VanDerWaalsContact CA-OE2 3.27Å; A337-E341 WeakPolarHBondContact CA-OE2 3.21Å; T338-E341 PolarHBondContact N-OE2 3.08Å; T338-E341 PolarHBondContact O-N 3.47Å; T338-E341 VanDerWaalsContact OG1-CG 3.27Å; T338-E341 WeakPolarHBondContact OG1-CG 3.19Å; T338-E341 PolarHBondContact OG1-N 3.49Å; T338-E341 PolarHBondContact OG1-OE2 2.88Å; E341-A344 PolarHBondContact O-N 3.47Å; E341-F345 VanDerWaalsContact O-CB 3.29Å; E341-F345 WeakPolarHBondContact O-CB 3.35Å; E341-F345 PolarHBondContact O-N 3.49Å; E341-L394 HydrophobicContact CB-CD2 4.42Å
342	V	94.8	Very high	91.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-42.8	174.8	173.2	0	0	0	0	111.2	M330 L333 T338 A339 E340 A344 F345 F346 I352 I359 F361 V375 L394	M330-V342 HydrophobicContact CE-CG1 4.11Å; M330-V342 HydrophobicContact SD-CG1 3.61Å; M330-V342 HydrophobicContact SD-CG2 4.47Å; L333-V342 HydrophobicContact CD2-CG2 4.14Å; T338-V342 PolarHBondContact O-N 3.3Å; T338-V342 VanDerWaalsContact O-N 3.14Å; A339-V342 PolarHBondContact O-N 3.38Å; E340-V342 VanDerWaalsContact C-N 3.33Å; V342-A344 VanDerWaalsContact C-N 3.33Å; V342-A344 PolarHBondContact O-N 2.83Å; V342-F345 WeakPolarHBondContact O-CB 3.14Å; V342-F345 PolarHBondContact O-N 2.71Å; V342-F346 HydrophobicContact CG1-CD2 4.16Å; V342-F346 HydrophobicContact CG1-CE2 3.99Å; V342-F346 WeakPolarHBondContact O-CD2 3.34Å; V342-F346 PolarHBondContact O-N 3.33Å; V342-I352 HydrophobicContact CG1-CD1 4.2Å; V342-I359 HydrophobicContact CB-CD1 3.83Å; V342-I359 HydrophobicContact CG1-CD1 3.62Å; V342-I359 HydrophobicContact CG1-CG1 4.17Å; V342-I359 HydrophobicContact CG1-CG2 4.41Å; V342-F361 HydrophobicContact CG2-CE1 4.34Å; V342-F361 HydrophobicContact CG2-CZ 4.02Å; V342-V375 HydrophobicContact CG1-CG2 4.21Å; V342-L394 HydrophobicContact CG2-CD1 4.35Å
343	V	94.8	Very high	91	Very high	53 Å²	53	57.4 Å²	57.4	32%	0.321	32%	0.318	S	S	.	.	H	α-helix	trans	-60	-44.6	173	172.4	0	0	0	0	110.6	A339 E340 F345 F346 G347 I352 K356 I359	A339-V343 VanDerWaalsContact O-CG2 3.3Å; A339-V343 WeakPolarHBondContact O-CG2 3.25Å; A339-V343 PolarHBondContact O-N 2.8Å; E340-V343 PolarHBondContact O-N 3.22Å; V343-F345 PolarHBondContact O-N 3.11Å; V343-F346 PolarHBondContact O-N 2.91Å; V343-G347 PolarHBondContact O-N 3.18Å; V343-I352 HydrophobicContact CB-CD1 4.41Å; V343-I352 HydrophobicContact CG2-CD1 3.91Å; V343-K356 HydrophobicContact CG2-CG 4.49Å; V343-I359 HydrophobicContact CG2-CD1 3.87Å
344	A	92.9	Very high	90.5	Very high	72 Å²	72	59.3 Å²	59.3	60%	0.595	34%	0.339	S	S	*	.	H	α-helix	trans	-65.6	-37.2	177.9	0	0	0	0	0	112.6	E340 E341 V342 F346 G347	E340-A344 WeakPolarHBondContact O-CB 3.49Å; E340-A344 PolarHBondContact O-N 3.25Å; E341-A344 PolarHBondContact O-N 3.47Å; V342-A344 VanDerWaalsContact C-N 3.33Å; V342-A344 PolarHBondContact O-N 2.83Å; A344-F346 PolarHBondContact O-N 3.3Å; A344-G347 PolarHBondContact O-N 3.24Å
345	F	93.4	Very high	90.3	Very high	18 Å²	18	59.4 Å²	59.4	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-59.4	-45.8	177.3	172.7	-94.8	0	0	0	111.8	M330 E341 V342 V343 K389 E392 L394 I399 L401	M330-F345 HydrophobicContact CE-CD1 3.86Å; M330-F345 HydrophobicContact CE-CE1 4.02Å; E341-F345 VanDerWaalsContact O-CB 3.29Å; E341-F345 WeakPolarHBondContact O-CB 3.35Å; E341-F345 PolarHBondContact O-N 3.49Å; V342-F345 WeakPolarHBondContact O-CB 3.14Å; V342-F345 PolarHBondContact O-N 2.71Å; V343-F345 PolarHBondContact O-N 3.11Å; F345-K389 HydrophobicContact CE1-CB 4.17Å; F345-K389 HydrophobicContact CZ-CB 4.02Å; F345-K389 WeakPolarHBondContact O-CE 3.29Å; F345-K389 PolarHBondContact O-NZ 3.05Å; F345-E392 HydrophobicContact CE2-CB 3.76Å; F345-E392 HydrophobicContact CZ-CB 3.97Å; F345-L394 HydrophobicContact CB-CD1 3.85Å; F345-L394 HydrophobicContact CD2-CB 4.09Å; F345-L394 HydrophobicContact CD2-CD1 4.19Å; F345-L394 HydrophobicContact CD2-CG 4.4Å; F345-L394 HydrophobicContact CE2-CB 4.5Å; F345-L394 HydrophobicContact CG-CD1 4.05Å; F345-I399 HydrophobicContact CE2-CG1 4.41Å; F345-I399 HydrophobicContact CZ-CB 4.21Å; F345-I399 HydrophobicContact CZ-CG1 4.5Å; F345-L401 HydrophobicContact CE1-CD1 4.14Å
346	F	92.9	Very high	90.1	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.009	34%	0.335	C	S	.	.	H	α-helix	trans	-75.6	-29.4	175.7	-71.1	-64.5	0	0	0	113	M330 V342 V343 A344 C350 I352 V375 F377 A386 K389 L401	M330-F346 HydrophobicContact CE-CE2 3.59Å; M330-F346 HydrophobicContact CE-CZ 3.7Å; M330-F346 HydrophobicContact CG-CE2 4.44Å; M330-F346 HydrophobicContact CG-CZ 4.22Å; M330-F346 HydrophobicContact SD-CE2 3.54Å; M330-F346 VanDerWaalsContact SD-CE2 3.54Å; M330-F346 HydrophobicContact SD-CZ 3.85Å; V342-F346 HydrophobicContact CG1-CD2 4.16Å; V342-F346 HydrophobicContact CG1-CE2 3.99Å; V342-F346 WeakPolarHBondContact O-CD2 3.34Å; V342-F346 PolarHBondContact O-N 3.33Å; V343-F346 PolarHBondContact O-N 2.91Å; A344-F346 PolarHBondContact O-N 3.3Å; F346-C350 HydrophobicContact CB-CB 4.12Å; F346-I352 HydrophobicContact CD2-CD1 3.82Å; F346-I352 HydrophobicContact CD2-CG1 4.2Å; F346-V375 HydrophobicContact CE2-CB 4.44Å; F346-V375 HydrophobicContact CE2-CG1 4.2Å; F346-V375 HydrophobicContact CE2-CG2 4.07Å; F346-F377 AromaticContact CD1-CZ 4Å; F346-F377 HydrophobicContact CD1-CZ 4Å; F346-F377 HydrophobicContact CD2-CZ 4.28Å; F346-F377 HydrophobicContact CE1-CZ 4.05Å; F346-F377 HydrophobicContact CE2-CZ 4.29Å; F346-F377 HydrophobicContact CG-CZ 4.12Å; F346-F377 HydrophobicContact CZ-CZ 4.18Å; F346-A386 HydrophobicContact CD1-CB 3.67Å; F346-A386 HydrophobicContact CE1-CB 3.56Å; F346-K389 HydrophobicContact CD1-CD 4.34Å; F346-L401 HydrophobicContact CE1-CD1 3.86Å; F346-L401 HydrophobicContact CE1-CD2 4.27Å; F346-L401 HydrophobicContact CZ-CD1 4.32Å; F346-L401 HydrophobicContact CZ-CD2 3.88Å
347	G	87.1	Confident	89.8	Confident	31 Å²	31	59.1 Å²	59.1	32%	0.32	34%	0.336	S	S	.	.			trans	66.4	-170.9	174.4	0	0	0	0	0	113.4	V343 A344 H349 C350	V343-G347 PolarHBondContact O-N 3.18Å; A344-G347 PolarHBondContact O-N 3.24Å; G347-H349 VanDerWaalsContact C-N 3.28Å; G347-H349 PolarHBondContact O-N 2.96Å; G347-C350 PolarHBondContact O-N 3.22Å
348	Q	81.6	Confident	89.5	Confident	189 Å²	189	58.4 Å²	58.4	88%	0.883	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.8	-175.9	-63.6	-169.2	12.6	0	0	113.8	C350	Q348-C350 VanDerWaalsContact C-N 3.26Å; Q348-C350 PolarHBondContact O-N 3.3Å
349	H	79.2	Confident	89.5	Confident	161 Å²	161	56.4 Å²	56.4	75%	0.745	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.6	179.6	-61.6	-59.6	0	0	0	113.5	G347 N385	G347-H349 VanDerWaalsContact C-N 3.28Å; G347-H349 PolarHBondContact O-N 2.96Å; H349-N385 PolarHBondContact O-ND2 3.27Å
350	C	86.6	Confident	89.4	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.034	31%	0.312	C	S	.	.	S	Bend	trans	-138.4	70.6	-179.6	-50.5	0	0	0	0	109.5	F346 G347 Q348 I352 F377 N385 A386	F346-C350 HydrophobicContact CB-CB 4.12Å; G347-C350 PolarHBondContact O-N 3.22Å; Q348-C350 VanDerWaalsContact C-N 3.26Å; Q348-C350 PolarHBondContact O-N 3.3Å; C350-I352 PolarHBondContact O-N 3.3Å; C350-F377 HydrophobicContact CB-CE1 4.03Å; C350-N385 WeakPolarHBondContact SG-CB 3.48Å; C350-A386 HydrophobicContact CB-CB 4.38Å; C350-A386 PolarHBondContact SG-N 3.22Å
351	P	87.8	Confident	89.3	Confident	55 Å²	55	54.5 Å²	54.5	36%	0.357	30%	0.304	S	S	.	.			trans	-64.4	126.6	-175.8	26.7	-34.1	0	0	0	111.2	Y382	P351-Y382 HydrophobicContact CG-CD1 4.48Å; P351-Y382 HydrophobicContact CG-CD2 3.69Å; P351-Y382 HydrophobicContact CG-CE1 4.27Å; P351-Y382 HydrophobicContact CG-CE2 3.44Å; P351-Y382 VanDerWaalsContact CG-CE2 3.44Å; P351-Y382 HydrophobicContact CG-CG 4.22Å
352	I	90.9	Very high	89.2	Confident	16 Å²	16	50.5 Å²	50.5	8%	0.082	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-73.6	135.1	174.6	-56.3	177.5	0	0	0	109.2	V342 V343 F346 C350 G354 G355 I359 V375 L376 F377	V342-I352 HydrophobicContact CG1-CD1 4.2Å; V343-I352 HydrophobicContact CB-CD1 4.41Å; V343-I352 HydrophobicContact CG2-CD1 3.91Å; F346-I352 HydrophobicContact CD2-CD1 3.82Å; F346-I352 HydrophobicContact CD2-CG1 4.2Å; C350-I352 PolarHBondContact O-N 3.3Å; I352-G354 PolarHBondContact O-N 2.85Å; I352-G354 VanDerWaalsContact O-N 3.15Å; I352-G355 VanDerWaalsContact CG2-O 3.22Å; I352-G355 WeakPolarHBondContact CG2-O 2.82Å; I352-G355 PolarHBondContact O-N 3.17Å; I352-I359 HydrophobicContact CD1-CD1 3.84Å; I352-I359 HydrophobicContact CD1-CG1 3.98Å; I352-I359 HydrophobicContact CG2-CG1 4.16Å; I352-V375 HydrophobicContact CB-CG1 4.21Å; I352-V375 HydrophobicContact CD1-CG1 3.74Å; I352-V375 HydrophobicContact CG1-CG1 3.7Å; I352-V375 HydrophobicContact CG2-CG1 3.58Å; I352-L376 WeakPolarHBondContact CG2-O 3.28Å; I352-F377 HydrophobicContact CG1-CE1 4.35Å
353	T	88.2	Confident	88.9	Confident	26 Å²	26	53.4 Å²	53.4	16%	0.16	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	115.5	-177.3	-50.1	0	0	0	0	111.6	G355 G358 L376 F377 A378	T353-G355 VanDerWaalsContact C-N 3.26Å; T353-G358 WeakPolarHBondContact O-CA 3.19Å; T353-G358 PolarHBondContact O-N 3.23Å; T353-L376 PolarHBondContact N-O 3.16Å; T353-L376 PolarHBondContact OG1-O 3.14Å; T353-F377 WeakPolarHBondContact OG1-CA 3.4Å; T353-A378 WeakPolarHBondContact OG1-CA 3.37Å; T353-A378 PolarHBondContact OG1-N 3.15Å
354	G	83.7	Confident	88.6	Confident	47 Å²	47	54.8 Å²	54.8	49%	0.485	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	14.1	-176	0	0	0	0	0	113.8	I352 K356 E357	I352-G354 PolarHBondContact O-N 2.85Å; I352-G354 VanDerWaalsContact O-N 3.15Å; G354-K356 PolarHBondContact O-N 2.76Å; G354-E357 PolarHBondContact O-N 3.43Å
355	G	88.1	Confident	88.2	Confident	28 Å²	28	56 Å²	56	29%	0.289	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	61.6	-117.9	178.2	0	0	0	0	0	111.7	I352 T353 E357 G358	I352-G355 VanDerWaalsContact CG2-O 3.22Å; I352-G355 WeakPolarHBondContact CG2-O 2.82Å; I352-G355 PolarHBondContact O-N 3.17Å; T353-G355 VanDerWaalsContact C-N 3.26Å; G355-E357 VanDerWaalsContact C-N 3.3Å; G355-E357 PolarHBondContact O-N 2.79Å; G355-G358 PolarHBondContact O-N 2.93Å
356	K	88.4	Confident	87.8	Confident	108 Å²	108	59 Å²	59	47%	0.47	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-64.9	-33.8	-179	-57	179.2	-164.8	177.1	0	112.7	A339 E340 V343 G354 G358 I359	A339-K356 HydrophobicContact CB-CB 4.03Å; A339-K356 HydrophobicContact CB-CD 4.28Å; A339-K356 HydrophobicContact CB-CG 3.95Å; E340-K356 WeakPolarHBondContact OE1-CD 3.27Å; E340-K356 WeakPolarHBondContact OE1-CE 3Å; E340-K356 IonicContact OE1-NZ 2.72Å; E340-K356 PolarHBondContact OE1-NZ 2.95Å; V343-K356 HydrophobicContact CG2-CG 4.49Å; G354-K356 PolarHBondContact O-N 2.76Å; K356-G358 PolarHBondContact O-N 2.97Å; K356-I359 PolarHBondContact O-N 2.69Å; K356-I359 VanDerWaalsContact O-N 3.11Å
357	E	86.1	Confident	87.4	Confident	156 Å²	156	61.3 Å²	61.3	73%	0.729	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-68.5	-16	178.4	-57.7	-58.1	129	0	0	112.8	G354 G355 I359	G354-E357 PolarHBondContact O-N 3.43Å; G355-E357 VanDerWaalsContact C-N 3.3Å; G355-E357 PolarHBondContact O-N 2.79Å; E357-I359 VanDerWaalsContact C-N 3.28Å
358	G	88.3	Confident	87.5	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.01	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-86.7	6	174.3	0	0	0	0	0	113.9	T353 G355 K356 V375 L376	T353-G358 WeakPolarHBondContact O-CA 3.19Å; T353-G358 PolarHBondContact O-N 3.23Å; G355-G358 PolarHBondContact O-N 2.93Å; K356-G358 PolarHBondContact O-N 2.97Å; G358-V375 WeakPolarHBondContact O-CA 3.44Å; G358-L376 PolarHBondContact O-N 2.88Å
359	I	92.8	Very high	88	Confident	17 Å²	17	60 Å²	60	9%	0.087	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.1	-178.7	-54.9	167.5	0	0	0	108.9	A339 V342 V343 I352 K356 E357 F361 F374 V375	A339-I359 HydrophobicContact CB-CD1 4.19Å; V342-I359 HydrophobicContact CB-CD1 3.83Å; V342-I359 HydrophobicContact CG1-CD1 3.62Å; V342-I359 HydrophobicContact CG1-CG1 4.17Å; V342-I359 HydrophobicContact CG1-CG2 4.41Å; V343-I359 HydrophobicContact CG2-CD1 3.87Å; I352-I359 HydrophobicContact CD1-CD1 3.84Å; I352-I359 HydrophobicContact CD1-CG1 3.98Å; I352-I359 HydrophobicContact CG2-CG1 4.16Å; K356-I359 PolarHBondContact O-N 2.69Å; K356-I359 VanDerWaalsContact O-N 3.11Å; E357-I359 VanDerWaalsContact C-N 3.28Å; I359-F361 HydrophobicContact CG2-CD2 4.01Å; I359-F361 HydrophobicContact CG2-CE2 3.68Å; I359-F361 HydrophobicContact CG2-CZ 4.03Å; I359-F374 CarbonylContact C-O 3.49Å; I359-F374 WeakPolarHBondContact CA-O 3.45Å; I359-V375 HydrophobicContact CG1-CG2 4.37Å; I359-V375 HydrophobicContact CG2-CG2 4.44Å
360	L	92	Very high	88.5	Confident	12 Å²	12	53.4 Å²	53.4	6%	0.063	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	105.5	173.8	-178.2	63	0	0	0	109.6	E315 F319 A373 F374 V409 L413	E315-L360 HydrophobicContact CG-CD1 4.22Å; E315-L360 WeakPolarHBondContact OE1-CD1 3.38Å; F319-L360 HydrophobicContact CB-CD2 4.2Å; F319-L360 HydrophobicContact CD1-CB 4.38Å; F319-L360 HydrophobicContact CD1-CD2 3.83Å; F319-L360 HydrophobicContact CD2-CB 3.64Å; F319-L360 HydrophobicContact CD2-CD2 4.22Å; F319-L360 HydrophobicContact CD2-CG 4.45Å; F319-L360 HydrophobicContact CE1-CB 4.21Å; F319-L360 HydrophobicContact CE1-CD2 4.2Å; F319-L360 HydrophobicContact CE2-CB 3.42Å; F319-L360 VanDerWaalsContact CE2-CB 3.42Å; F319-L360 HydrophobicContact CG-CB 4.11Å; F319-L360 HydrophobicContact CG-CD2 3.83Å; F319-L360 HydrophobicContact CZ-CB 3.73Å; L360-A373 CarbonylContact O-C 3.56Å; L360-A373 VanDerWaalsContact O-CA 3.22Å; L360-A373 WeakPolarHBondContact O-CA 3.35Å; L360-F374 HydrophobicContact CB-CB 4.39Å; L360-F374 PolarHBondContact N-O 3.41Å; L360-F374 PolarHBondContact O-N 3.48Å; L360-V409 HydrophobicContact CD2-CG1 3.98Å; L360-L413 HydrophobicContact CD2-CD1 3.7Å
361	F	92.6	Very high	88.8	Confident	62 Å²	62	53.5 Å²	53.5	27%	0.272	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	134.7	172.9	-73.3	-82.2	0	0	0	110.4	L333 A339 V342 I359 T363 A373	L333-F361 HydrophobicContact CD1-CD1 4.43Å; L333-F361 HydrophobicContact CD1-CE1 4.11Å; A339-F361 HydrophobicContact CB-CE2 4.12Å; V342-F361 HydrophobicContact CG2-CE1 4.34Å; V342-F361 HydrophobicContact CG2-CZ 4.02Å; I359-F361 HydrophobicContact CG2-CD2 4.01Å; I359-F361 HydrophobicContact CG2-CE2 3.68Å; I359-F361 HydrophobicContact CG2-CZ 4.03Å; F361-T363 PolarHBondContact O-N 3.27Å; F361-A373 HydrophobicContact CD1-CB 4Å; F361-A373 HydrophobicContact CE1-CB 4.36Å
362	V	90.8	Very high	89	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	113.6	174.6	-177.9	0	0	0	0	108	T370 D372 F374 V412 L413 F416	V362-T370 WeakPolarHBondContact CB-OG1 3.4Å; V362-T370 HydrophobicContact CG1-CG2 4.04Å; V362-T370 WeakPolarHBondContact O-CB 3.17Å; V362-T370 VanDerWaalsContact O-CG2 3.31Å; V362-T370 WeakPolarHBondContact O-CG2 3.29Å; V362-T370 PolarHBondContact O-N 2.83Å; V362-T370 PolarHBondContact O-OG1 2.57Å; V362-D372 HydrophobicContact CB-CB 4.14Å; V362-D372 WeakPolarHBondContact CB-O 3.36Å; V362-D372 HydrophobicContact CG2-CB 4.16Å; V362-D372 PolarHBondContact N-O 2.72Å; V362-F374 HydrophobicContact CG2-CD2 3.94Å; V362-F374 HydrophobicContact CG2-CE2 3.75Å; V362-V412 HydrophobicContact CB-CG1 4.44Å; V362-V412 HydrophobicContact CG1-CG1 3.84Å; V362-V412 HydrophobicContact CG2-CG1 3.84Å; V362-L413 HydrophobicContact CG1-CD2 4.28Å; V362-L413 HydrophobicContact CG2-CD2 4.21Å; V362-F416 HydrophobicContact CG1-CB 4.16Å; V362-F416 HydrophobicContact CG1-CD2 3.41Å; V362-F416 VanDerWaalsContact CG1-CD2 3.41Å; V362-F416 HydrophobicContact CG1-CE2 4.06Å; V362-F416 HydrophobicContact CG1-CG 3.99Å
363	T	89.4	Confident	89.2	Confident	62 Å²	62	50.8 Å²	50.8	38%	0.38	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	154.8	177.8	57.4	0	0	0	0	111.5	F361 R368	F361-T363 PolarHBondContact O-N 3.27Å; T363-R368 CarbonylContact C-O 3.56Å; T363-R368 VanDerWaalsContact CA-O 3.23Å; T363-R368 WeakPolarHBondContact CA-O 3.09Å; T363-R368 WeakPolarHBondContact CB-O 3.22Å
364	Y	87.6	Confident	89.5	Confident	82 Å²	82	49.5 Å²	49.5	32%	0.322	28%	0.278	S	S	.	.			trans	-67.9	166.3	164.5	-71	-79.3	0	0	0	110.6	D366 G367 R368 T370 F416	Y364-D366 WeakPolarHBondContact CB-OD1 3.45Å; Y364-D366 PolarHBondContact O-N 2.94Å; Y364-D366 VanDerWaalsContact O-N 3.15Å; Y364-G367 WeakPolarHBondContact O-CA 3.24Å; Y364-G367 PolarHBondContact O-N 2.94Å; Y364-R368 HydrophobicContact CD2-CB 3.97Å; Y364-R368 WeakPolarHBondContact CD2-O 3.44Å; Y364-R368 PolarHBondContact N-O 3.06Å; Y364-T370 HydrophobicContact CD2-CG2 3.76Å; Y364-T370 HydrophobicContact CE2-CG2 3.61Å; Y364-T370 HydrophobicContact CG-CG2 4.3Å; Y364-F416 HydrophobicContact CD1-CD1 4Å; Y364-F416 AromaticContact CE1-CD1 3.55Å; Y364-F416 HydrophobicContact CE1-CD1 3.55Å; Y364-F416 AromaticContact CE1-CE1 3.91Å; Y364-F416 HydrophobicContact CE1-CE1 3.91Å; Y364-F416 AromaticContact CZ-CD1 3.94Å; Y364-F416 AromaticContact CZ-CE1 3.9Å
365	P	83.8	Confident	90	Very high	96 Å²	96	47.3 Å²	47.3	62%	0.623	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-20.5	179.7	-20.9	35.2	0	0	0	113.1	G367 F416	P365-G367 VanDerWaalsContact C-N 3.26Å; P365-F416 WeakPolarHBondContact CD-O 3.26Å; P365-F416 WeakPolarHBondContact CG-O 3.4Å
366	D	85.7	Confident	90.2	Very high	82 Å²	82	46.1 Å²	46.1	44%	0.439	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.2	173.7	62.1	13.1	0	0	0	113.5	Y364 R368	Y364-D366 WeakPolarHBondContact CB-OD1 3.45Å; Y364-D366 PolarHBondContact O-N 2.94Å; Y364-D366 VanDerWaalsContact O-N 3.15Å; D366-R368 VanDerWaalsContact C-N 3.32Å; D366-R368 VanDerWaalsContact CG-NE 3.33Å; D366-R368 PolarHBondContact O-N 2.89Å; D366-R368 VanDerWaalsContact OD1-CB 3.3Å; D366-R368 WeakPolarHBondContact OD1-CB 3.5Å; D366-R368 WeakPolarHBondContact OD1-CG 3.23Å; D366-R368 PolarHBondContact OD1-N 2.66Å; D366-R368 IonicContact OD1-NE 3.7Å; D366-R368 PolarHBondContact OD1-NE 3.34Å; D366-R368 IonicContact OD2-CZ 2.79Å; D366-R368 IonicContact OD2-NE 2.72Å; D366-R368 PolarHBondContact OD2-NE 2.79Å; D366-R368 IonicContact OD2-NH2 3.77Å; D366-R368 PolarHBondContact OD2-NH2 3.21Å
367	G	85	Confident	90.4	Very high	50 Å²	50	41 Å²	41	52%	0.515	22%	0.22	S	C	.	.	S	Bend	trans	81.7	0.9	179.8	0	0	0	0	0	114.7	Y364 P365	Y364-G367 WeakPolarHBondContact O-CA 3.24Å; Y364-G367 PolarHBondContact O-N 2.94Å; P365-G367 VanDerWaalsContact C-N 3.26Å
368	R	89.8	Confident	90.5	Very high	139 Å²	139	36.3 Å²	36.3	53%	0.525	21%	0.208	S	C	.	.			trans	-68.8	138.3	178.4	-71.3	-174.8	-66.7	169.7	-5.7	111.5	T363 Y364 D366	T363-R368 CarbonylContact C-O 3.56Å; T363-R368 VanDerWaalsContact CA-O 3.23Å; T363-R368 WeakPolarHBondContact CA-O 3.09Å; T363-R368 WeakPolarHBondContact CB-O 3.22Å; Y364-R368 HydrophobicContact CD2-CB 3.97Å; Y364-R368 WeakPolarHBondContact CD2-O 3.44Å; Y364-R368 PolarHBondContact N-O 3.06Å; D366-R368 VanDerWaalsContact C-N 3.32Å; D366-R368 VanDerWaalsContact CG-NE 3.33Å; D366-R368 PolarHBondContact O-N 2.89Å; D366-R368 VanDerWaalsContact OD1-CB 3.3Å; D366-R368 WeakPolarHBondContact OD1-CB 3.5Å; D366-R368 WeakPolarHBondContact OD1-CG 3.23Å; D366-R368 PolarHBondContact OD1-N 2.66Å; D366-R368 IonicContact OD1-NE 3.7Å; D366-R368 PolarHBondContact OD1-NE 3.34Å; D366-R368 IonicContact OD2-CZ 2.79Å; D366-R368 IonicContact OD2-NE 2.72Å; D366-R368 PolarHBondContact OD2-NE 2.79Å; D366-R368 IonicContact OD2-NH2 3.77Å; D366-R368 PolarHBondContact OD2-NH2 3.21Å
369	P	90.9	Very high	90.4	Very high	54 Å²	54	38.4 Å²	38.4	35%	0.351	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	135.3	177.8	28.9	-33.8	0	0	0	111.1	F335	F335-P369 HydrophobicContact CB-CG 3.8Å; F335-P369 HydrophobicContact CD1-CG 4.23Å; F335-P369 HydrophobicContact CG-CG 4.31Å; F335-P369 VanDerWaalsContact O-CG 3.31Å; F335-P369 WeakPolarHBondContact O-CG 3.38Å
370	T	90.9	Very high	90.1	Very high	23 Å²	23	42 Å²	42	14%	0.141	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-16.9	176.4	63.6	0	0	0	0	112.9	V362 Y364 D372 F416	V362-T370 WeakPolarHBondContact CB-OG1 3.4Å; V362-T370 HydrophobicContact CG1-CG2 4.04Å; V362-T370 WeakPolarHBondContact O-CB 3.17Å; V362-T370 VanDerWaalsContact O-CG2 3.31Å; V362-T370 WeakPolarHBondContact O-CG2 3.29Å; V362-T370 PolarHBondContact O-N 2.83Å; V362-T370 PolarHBondContact O-OG1 2.57Å; Y364-T370 HydrophobicContact CD2-CG2 3.76Å; Y364-T370 HydrophobicContact CE2-CG2 3.61Å; Y364-T370 HydrophobicContact CG-CG2 4.3Å; T370-D372 VanDerWaalsContact C-N 3.33Å; T370-D372 PolarHBondContact OG1-N 2.89Å; T370-F416 HydrophobicContact CG2-CB 4.47Å; T370-F416 HydrophobicContact CG2-CD1 3.59Å; T370-F416 HydrophobicContact CG2-CD2 4.21Å; T370-F416 HydrophobicContact CG2-CE1 3.74Å; T370-F416 HydrophobicContact CG2-CE2 4.34Å; T370-F416 HydrophobicContact CG2-CG 3.84Å; T370-F416 HydrophobicContact CG2-CZ 4.11Å
371	G	91	Very high	90	Very high	7 Å²	7	47.5 Å²	47.5	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	84.1	5.6	-170.5	0	0	0	0	0	114.1	G332 L333	G332-G371 PolarHBondContact N-O 3.41Å; L333-G371 WeakPolarHBondContact CB-O 3.23Å; L333-G371 PolarHBondContact N-O 3.19Å
372	D	92.8	Very high	90	Very high	13 Å²	13	48.4 Å²	48.4	7%	0.07	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	143.8	170.6	-75.2	5.1	0	0	0	110.3	R329 M330 R331 V362 T370	R329-D372 IonicContact CZ-OD2 2.75Å; R329-D372 IonicContact NE-OD2 3.05Å; R329-D372 PolarHBondContact NE-OD2 2.87Å; R329-D372 IonicContact NH2-OD2 3.76Å; R329-D372 PolarHBondContact NH2-OD2 2.66Å; M330-D372 VanDerWaalsContact O-CA 3.3Å; M330-D372 WeakPolarHBondContact O-CA 3.31Å; R331-D372 WeakPolarHBondContact CB-OD1 3.41Å; R331-D372 WeakPolarHBondContact CG-OD1 3.36Å; R331-D372 IonicContact CZ-OD2 3.74Å; R331-D372 IonicContact NE-OD1 2.71Å; R331-D372 PolarHBondContact NE-OD1 3.5Å; R331-D372 IonicContact NE-OD2 2.69Å; R331-D372 PolarHBondContact NE-OD2 3Å; R331-D372 IonicContact NH2-OD2 3.75Å; V362-D372 HydrophobicContact CB-CB 4.14Å; V362-D372 WeakPolarHBondContact CB-O 3.36Å; V362-D372 HydrophobicContact CG2-CB 4.16Å; V362-D372 PolarHBondContact N-O 2.72Å; T370-D372 VanDerWaalsContact C-N 3.33Å; T370-D372 PolarHBondContact OG1-N 2.89Å
373	A	94.7	Very high	90	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159.1	172.1	0	0	0	0	0	111.2	R329 M330 L333 L360 F361	R329-A373 CarbonylContact C-O 3.57Å; R329-A373 WeakPolarHBondContact CA-O 3.41Å; M330-A373 HydrophobicContact CB-CB 4.47Å; M330-A373 PolarHBondContact N-O 3.45Å; M330-A373 PolarHBondContact O-N 3.33Å; L333-A373 HydrophobicContact CD1-CB 3.42Å; L333-A373 VanDerWaalsContact CD1-CB 3.42Å; L360-A373 CarbonylContact O-C 3.56Å; L360-A373 VanDerWaalsContact O-CA 3.22Å; L360-A373 WeakPolarHBondContact O-CA 3.35Å; F361-A373 HydrophobicContact CD1-CB 4Å; F361-A373 HydrophobicContact CE1-CB 4.36Å
374	F	94.2	Very high	90	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.4	171.8	-65.1	-84.8	0	0	0	110.3	F319 I327 V328 R329 I359 L360 V362 V409 V412	F319-F374 HydrophobicContact CE1-CB 3.94Å; F319-F374 HydrophobicContact CZ-CB 3.81Å; I327-F374 HydrophobicContact CG2-CB 4.23Å; I327-F374 HydrophobicContact CG2-CD1 3.9Å; I327-F374 HydrophobicContact CG2-CG 4.49Å; V328-F374 CarbonylContact O-C 3.57Å; V328-F374 WeakPolarHBondContact O-CA 3.23Å; R329-F374 HydrophobicContact CB-CD1 3.77Å; R329-F374 HydrophobicContact CB-CE1 3.64Å; R329-F374 HydrophobicContact CG-CD1 4.15Å; R329-F374 HydrophobicContact CG-CE1 3.77Å; R329-F374 HydrophobicContact CG-CZ 4.18Å; I359-F374 CarbonylContact C-O 3.49Å; I359-F374 WeakPolarHBondContact CA-O 3.45Å; L360-F374 HydrophobicContact CB-CB 4.39Å; L360-F374 PolarHBondContact N-O 3.41Å; L360-F374 PolarHBondContact O-N 3.48Å; V362-F374 HydrophobicContact CG2-CD2 3.94Å; V362-F374 HydrophobicContact CG2-CE2 3.75Å; F374-V409 HydrophobicContact CB-CG2 4.42Å; F374-V409 HydrophobicContact CD1-CG2 3.63Å; F374-V409 HydrophobicContact CD2-CG1 4.21Å; F374-V409 HydrophobicContact CD2-CG2 4.26Å; F374-V409 HydrophobicContact CE1-CB 4.46Å; F374-V409 HydrophobicContact CE1-CG2 3.79Å; F374-V409 HydrophobicContact CE2-CB 4.44Å; F374-V409 HydrophobicContact CE2-CG1 4.37Å; F374-V409 HydrophobicContact CE2-CG2 4.42Å; F374-V409 HydrophobicContact CG-CG2 3.86Å; F374-V409 HydrophobicContact CZ-CB 4.38Å; F374-V409 HydrophobicContact CZ-CG2 4.19Å; F374-V412 HydrophobicContact CE2-CB 3.93Å; F374-V412 HydrophobicContact CE2-CG1 3.94Å; F374-V412 HydrophobicContact CE2-CG2 4.42Å; F374-V412 HydrophobicContact CZ-CB 3.84Å; F374-V412 HydrophobicContact CZ-CG1 4.18Å; F374-V412 HydrophobicContact CZ-CG2 3.85Å
375	V	94.6	Very high	90.2	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.6	-176.2	-175.4	0	0	0	0	109.8	I327 V328 M330 V342 F346 I352 G358 I359 F377	I327-V375 WeakPolarHBondContact CA-O 3.3Å; V328-V375 PolarHBondContact N-O 2.81Å; V328-V375 PolarHBondContact O-N 3.44Å; M330-V375 HydrophobicContact CG-CG2 4Å; M330-V375 HydrophobicContact SD-CG2 3.53Å; M330-V375 VanDerWaalsContact SD-CG2 3.53Å; V342-V375 HydrophobicContact CG1-CG2 4.21Å; F346-V375 HydrophobicContact CE2-CB 4.44Å; F346-V375 HydrophobicContact CE2-CG1 4.2Å; F346-V375 HydrophobicContact CE2-CG2 4.07Å; I352-V375 HydrophobicContact CB-CG1 4.21Å; I352-V375 HydrophobicContact CD1-CG1 3.74Å; I352-V375 HydrophobicContact CG1-CG1 3.7Å; I352-V375 HydrophobicContact CG2-CG1 3.58Å; G358-V375 WeakPolarHBondContact O-CA 3.44Å; I359-V375 HydrophobicContact CG1-CG2 4.37Å; I359-V375 HydrophobicContact CG2-CG2 4.44Å; V375-F377 HydrophobicContact CB-CE2 4.11Å; V375-F377 HydrophobicContact CG1-CD2 4.47Å; V375-F377 HydrophobicContact CG1-CE2 3.76Å; V375-F377 HydrophobicContact CG1-CZ 3.81Å
376	L	92.6	Very high	90.7	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.6	179.8	-59	169.3	0	0	0	110.8	F319 Q325 I327 I352 T353 G358	F319-L376 HydrophobicContact CD1-CD1 4.33Å; F319-L376 HydrophobicContact CD1-CD2 4.31Å; F319-L376 HydrophobicContact CD2-CD1 3.69Å; F319-L376 HydrophobicContact CD2-CG 4.31Å; F319-L376 HydrophobicContact CE1-CD1 4.14Å; F319-L376 HydrophobicContact CE1-CD2 3.62Å; F319-L376 HydrophobicContact CE1-CG 3.91Å; F319-L376 HydrophobicContact CE2-CD1 3.46Å; F319-L376 VanDerWaalsContact CE2-CD1 3.46Å; F319-L376 HydrophobicContact CE2-CD2 4.28Å; F319-L376 HydrophobicContact CE2-CG 3.61Å; F319-L376 HydrophobicContact CG-CD1 4.13Å; F319-L376 HydrophobicContact CZ-CD1 3.72Å; F319-L376 HydrophobicContact CZ-CD2 3.62Å; F319-L376 HydrophobicContact CZ-CG 3.38Å; F319-L376 WeakPolarHBondContact O-CD1 3.37Å; Q325-L376 HydrophobicContact CB-CD2 4.35Å; I327-L376 HydrophobicContact CG1-CD2 3.85Å; I352-L376 WeakPolarHBondContact CG2-O 3.28Å; T353-L376 PolarHBondContact N-O 3.16Å; T353-L376 PolarHBondContact OG1-O 3.14Å; G358-L376 PolarHBondContact O-N 2.88Å
377	F	92.1	Very high	91	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.3	172.7	-66.3	-82.6	0	0	0	110.5	Q325 V326 V328 F346 C350 I352 T353 V375 C379 A383 A386	Q325-F377 WeakPolarHBondContact CA-O 3.43Å; V326-F377 HydrophobicContact CB-CB 4.49Å; V326-F377 PolarHBondContact N-O 3.43Å; V326-F377 PolarHBondContact O-N 2.81Å; V328-F377 HydrophobicContact CB-CD2 4.31Å; V328-F377 HydrophobicContact CB-CE2 3.85Å; V328-F377 HydrophobicContact CG2-CD2 3.79Å; V328-F377 HydrophobicContact CG2-CE2 3.67Å; F346-F377 AromaticContact CD1-CZ 4Å; F346-F377 HydrophobicContact CD1-CZ 4Å; F346-F377 HydrophobicContact CD2-CZ 4.28Å; F346-F377 HydrophobicContact CE1-CZ 4.05Å; F346-F377 HydrophobicContact CE2-CZ 4.29Å; F346-F377 HydrophobicContact CG-CZ 4.12Å; F346-F377 HydrophobicContact CZ-CZ 4.18Å; C350-F377 HydrophobicContact CB-CE1 4.03Å; I352-F377 HydrophobicContact CG1-CE1 4.35Å; T353-F377 WeakPolarHBondContact OG1-CA 3.4Å; V375-F377 HydrophobicContact CB-CE2 4.11Å; V375-F377 HydrophobicContact CG1-CD2 4.47Å; V375-F377 HydrophobicContact CG1-CE2 3.76Å; V375-F377 HydrophobicContact CG1-CZ 3.81Å; F377-C379 VanDerWaalsContact C-N 3.26Å; F377-C379 PolarHBondContact O-N 2.93Å; F377-A383 HydrophobicContact CB-CB 4.1Å; F377-A383 HydrophobicContact CD2-CB 4.13Å; F377-A383 HydrophobicContact CG-CB 4.22Å; F377-A386 HydrophobicContact CE1-CB 3.9Å; F377-A386 HydrophobicContact CE2-CB 3.88Å; F377-A386 HydrophobicContact CZ-CB 3.43Å; F377-A386 VanDerWaalsContact CZ-CB 3.43Å
378	A	88.8	Confident	91.3	Very high	58 Å²	58	46 Å²	46	48%	0.479	22%	0.223	S	C	.	.	S	Bend	trans	-74.9	-19.5	-173.7	0	0	0	0	0	112.7	T353	T353-A378 WeakPolarHBondContact OG1-CA 3.37Å; T353-A378 PolarHBondContact OG1-N 3.15Å
379	C	86.8	Confident	91.5	Very high	44 Å²	44	41.7 Å²	41.7	30%	0.297	21%	0.208	S	C	.	.	S	Bend	trans	-152.3	164.9	178.5	69.3	0	0	0	0	112	F377 E381 Y382 A383	F377-C379 VanDerWaalsContact C-N 3.26Å; F377-C379 PolarHBondContact O-N 2.93Å; C379-E381 VanDerWaalsContact C-N 3.27Å; C379-E381 PolarHBondContact O-N 3.19Å; C379-Y382 PolarHBondContact O-N 2.94Å; C379-Y382 WeakPolarHBondContact SG-CD2 3.39Å; C379-Y382 VanDerWaalsContact SG-CG 3.59Å; C379-A383 PolarHBondContact O-N 2.82Å
380	E	86	Confident	91.6	Very high	93 Å²	93	41.6 Å²	41.6	44%	0.435	20%	0.203	S	C	.	.	H	α-helix	trans	-55.8	-39.1	176.6	-173.4	66.7	-170.4	0	0	113.2	A383 Q384 R403	E380-A383 PolarHBondContact O-N 2.85Å; E380-Q384 WeakPolarHBondContact O-CB 3.31Å; E380-Q384 PolarHBondContact O-N 2.81Å; E380-R403 IonicContact OE1-CZ 3.41Å; E380-R403 IonicContact OE1-NH1 3.69Å; E380-R403 PolarHBondContact OE1-NH1 3.34Å; E380-R403 IonicContact OE1-NH2 3.37Å; E380-R403 PolarHBondContact OE1-NH2 3.11Å; E380-R403 IonicContact OE2-CZ 2.71Å; E380-R403 IonicContact OE2-NH1 2.71Å; E380-R403 PolarHBondContact OE2-NH1 3.46Å; E380-R403 IonicContact OE2-NH2 3.96Å; E380-R403 PolarHBondContact OE2-NH2 3.34Å
381	E	89.8	Confident	91.7	Very high	128 Å²	128	46.9 Å²	46.9	60%	0.598	22%	0.224	S	C	*	.	H	α-helix	trans	-64.2	-46.4	-177.7	-172	-174.1	161.7	0	0	111.8	C379 Q384 N385	C379-E381 VanDerWaalsContact C-N 3.27Å; C379-E381 PolarHBondContact O-N 3.19Å; E381-Q384 PolarHBondContact O-N 3.03Å; E381-N385 PolarHBondContact O-N 3.25Å; E381-N385 PolarHBondContact O-OD1 2.83Å
382	Y	92.4	Very high	91.8	Very high	81 Å²	81	50.5 Å²	50.5	32%	0.318	24%	0.239	S	C	.	.	H	α-helix	trans	-66.7	-39.2	178.8	-62.3	-26.8	0	0	0	112.3	P351 C379 Q384 N385 A386	P351-Y382 HydrophobicContact CG-CD1 4.48Å; P351-Y382 HydrophobicContact CG-CD2 3.69Å; P351-Y382 HydrophobicContact CG-CE1 4.27Å; P351-Y382 HydrophobicContact CG-CE2 3.44Å; P351-Y382 VanDerWaalsContact CG-CE2 3.44Å; P351-Y382 HydrophobicContact CG-CG 4.22Å; C379-Y382 PolarHBondContact O-N 2.94Å; C379-Y382 WeakPolarHBondContact SG-CD2 3.39Å; C379-Y382 VanDerWaalsContact SG-CG 3.59Å; Y382-Q384 VanDerWaalsContact C-N 3.32Å; Y382-Q384 PolarHBondContact O-N 3.48Å; Y382-N385 PolarHBondContact O-N 2.82Å; Y382-A386 VanDerWaalsContact O-CB 3.31Å; Y382-A386 WeakPolarHBondContact O-CB 3.45Å; Y382-A386 PolarHBondContact O-N 2.57Å
383	A	90.7	Very high	91.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-40.6	172.8	0	0	0	0	0	111.5	V326 V328 F377 C379 E380 A386 L387	V326-A383 HydrophobicContact CB-CB 3.72Å; V326-A383 HydrophobicContact CG1-CB 3.33Å; V326-A383 HydrophobicContact CG2-CB 4.45Å; V328-A383 HydrophobicContact CG2-CB 4.2Å; F377-A383 HydrophobicContact CB-CB 4.1Å; F377-A383 HydrophobicContact CD2-CB 4.13Å; F377-A383 HydrophobicContact CG-CB 4.22Å; C379-A383 PolarHBondContact O-N 2.82Å; E380-A383 PolarHBondContact O-N 2.85Å; A383-A386 WeakPolarHBondContact O-CB 3.33Å; A383-A386 PolarHBondContact O-N 2.92Å; A383-L387 VanDerWaalsContact O-CG 3.27Å; A383-L387 WeakPolarHBondContact O-CG 3.46Å; A383-L387 PolarHBondContact O-N 3.18Å
384	Q	90.3	Very high	91.8	Very high	92 Å²	92	56.1 Å²	56.1	43%	0.43	27%	0.269	S	S	.	.	H	α-helix	trans	-65.5	-42.2	177.2	-165.8	64.1	19.1	0	0	112	E380 E381 Y382 A386 L387 R388 R403	E380-Q384 WeakPolarHBondContact O-CB 3.31Å; E380-Q384 PolarHBondContact O-N 2.81Å; E381-Q384 PolarHBondContact O-N 3.03Å; Y382-Q384 VanDerWaalsContact C-N 3.32Å; Y382-Q384 PolarHBondContact O-N 3.48Å; Q384-A386 VanDerWaalsContact C-N 3.33Å; Q384-L387 PolarHBondContact O-N 2.79Å; Q384-R388 PolarHBondContact O-N 2.89Å; Q384-R403 VanDerWaalsContact OE1-NH2 3.13Å
385	N	92.3	Very high	91.5	Very high	23 Å²	23	59.4 Å²	59.4	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-60.4	-43.9	173	-65.6	-18.8	0	0	0	110.9	H349 C350 E381 Y382 L387 R388	H349-N385 PolarHBondContact O-ND2 3.27Å; C350-N385 WeakPolarHBondContact SG-CB 3.48Å; E381-N385 PolarHBondContact O-N 3.25Å; E381-N385 PolarHBondContact O-OD1 2.83Å; Y382-N385 PolarHBondContact O-N 2.82Å; N385-L387 PolarHBondContact O-N 3.04Å; N385-R388 WeakPolarHBondContact O-CB 3.48Å; N385-R388 PolarHBondContact O-N 3.46Å; N385-R388 PolarHBondContact OD1-NH1 2.78Å; N385-R388 PolarHBondContact OD1-NH2 3.17Å
386	A	92.8	Very high	91.2	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.1	-44.5	176.5	0	0	0	0	0	111.8	F346 C350 F377 Y382 A383 Q384 R388 K389 L401	F346-A386 HydrophobicContact CD1-CB 3.67Å; F346-A386 HydrophobicContact CE1-CB 3.56Å; C350-A386 HydrophobicContact CB-CB 4.38Å; C350-A386 PolarHBondContact SG-N 3.22Å; F377-A386 HydrophobicContact CE1-CB 3.9Å; F377-A386 HydrophobicContact CE2-CB 3.88Å; F377-A386 HydrophobicContact CZ-CB 3.43Å; F377-A386 VanDerWaalsContact CZ-CB 3.43Å; Y382-A386 VanDerWaalsContact O-CB 3.31Å; Y382-A386 WeakPolarHBondContact O-CB 3.45Å; Y382-A386 PolarHBondContact O-N 2.57Å; A383-A386 WeakPolarHBondContact O-CB 3.33Å; A383-A386 PolarHBondContact O-N 2.92Å; Q384-A386 VanDerWaalsContact C-N 3.33Å; A386-R388 PolarHBondContact O-N 3.02Å; A386-K389 VanDerWaalsContact O-CB 3.28Å; A386-K389 WeakPolarHBondContact O-CB 3.21Å; A386-K389 PolarHBondContact O-N 3.33Å; A386-L401 WeakPolarHBondContact O-CD1 3.31Å
387	L	91.8	Very high	91.2	Very high	34 Å²	34	75 Å²	75	18%	0.178	37%	0.367	C	S	.	.	H	α-helix	trans	-63	-24.1	178.1	-68.2	166.7	0	0	0	113.5	V328 A383 Q384 N385 K389 H390 L401 R403	V328-L387 HydrophobicContact CG1-CD2 4.16Å; V328-L387 HydrophobicContact CG2-CD2 4.48Å; A383-L387 VanDerWaalsContact O-CG 3.27Å; A383-L387 WeakPolarHBondContact O-CG 3.46Å; A383-L387 PolarHBondContact O-N 3.18Å; Q384-L387 PolarHBondContact O-N 2.79Å; N385-L387 PolarHBondContact O-N 3.04Å; L387-K389 PolarHBondContact O-N 2.89Å; L387-H390 WeakPolarHBondContact O-CB 3.41Å; L387-H390 PolarHBondContact O-N 2.83Å; L387-H390 VanDerWaalsContact O-N 3.17Å; L387-L401 HydrophobicContact CD2-CB 4.22Å; L387-R403 HydrophobicContact CD1-CG 3.54Å; L387-R403 HydrophobicContact CD2-CG 4.32Å
388	R	92.6	Very high	91.3	Very high	174 Å²	174	81.1 Å²	81.1	66%	0.657	39%	0.39	S	S	*	.	H	α-helix	trans	-65.4	-22.5	172.8	-59.7	-170.4	-148.3	119.6	1.9	112.7	Q384 N385 A386 H390	Q384-R388 PolarHBondContact O-N 2.89Å; N385-R388 WeakPolarHBondContact O-CB 3.48Å; N385-R388 PolarHBondContact O-N 3.46Å; N385-R388 PolarHBondContact OD1-NH1 2.78Å; N385-R388 PolarHBondContact OD1-NH2 3.17Å; A386-R388 PolarHBondContact O-N 3.02Å; R388-H390 PolarHBondContact O-N 2.85Å
389	K	92.8	Very high	91.6	Very high	47 Å²	47	78.3 Å²	78.3	20%	0.204	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	8.6	175.9	-48.6	-162.9	65.4	140.3	0	113.3	F345 F346 A386 L387 K391 E392 L401	F345-K389 HydrophobicContact CE1-CB 4.17Å; F345-K389 HydrophobicContact CZ-CB 4.02Å; F345-K389 WeakPolarHBondContact O-CE 3.29Å; F345-K389 PolarHBondContact O-NZ 3.05Å; F346-K389 HydrophobicContact CD1-CD 4.34Å; A386-K389 VanDerWaalsContact O-CB 3.28Å; A386-K389 WeakPolarHBondContact O-CB 3.21Å; A386-K389 PolarHBondContact O-N 3.33Å; L387-K389 PolarHBondContact O-N 2.89Å; K389-K391 PolarHBondContact O-N 2.97Å; K389-E392 WeakPolarHBondContact CA-OE1 3.27Å; K389-E392 HydrophobicContact CB-CB 4.49Å; K389-E392 HydrophobicContact CB-CG 4.21Å; K389-E392 VanDerWaalsContact CE-CD 3.43Å; K389-E392 WeakPolarHBondContact CE-OE2 3.44Å; K389-E392 IonicContact NZ-OE2 4Å; K389-E392 PolarHBondContact NZ-OE2 2.94Å; K389-E392 VanDerWaalsContact O-CB 3.27Å; K389-E392 WeakPolarHBondContact O-CB 3.32Å; K389-E392 WeakPolarHBondContact O-CG 3.38Å; K389-E392 PolarHBondContact O-N 2.96Å; K389-L401 HydrophobicContact CB-CD1 3.95Å
390	H	92.9	Very high	91.9	Very high	53 Å²	53	79.1 Å²	79.1	25%	0.245	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	128.7	178.6	179.6	90.2	0	0	0	110.7	L387 R388 E392 L401	L387-H390 WeakPolarHBondContact O-CB 3.41Å; L387-H390 PolarHBondContact O-N 2.83Å; L387-H390 VanDerWaalsContact O-N 3.17Å; R388-H390 PolarHBondContact O-N 2.85Å; H390-E392 VanDerWaalsContact C-N 3.29Å; H390-L401 HydrophobicContact CB-CB 4.33Å; H390-L401 PolarHBondContact ND1-N 3.14Å; H390-L401 PolarHBondContact ND1-O 2.93Å
391	K	93.3	Very high	92.3	Very high	134 Å²	134	74.9 Å²	74.9	58%	0.583	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	10.5	-173	-61.9	168.3	179.8	-177.6	0	115.8	K389 I399	K389-K391 PolarHBondContact O-N 2.97Å; K391-I399 VanDerWaalsContact CA-O 3.29Å; K391-I399 WeakPolarHBondContact CA-O 3.46Å; K391-I399 PolarHBondContact N-O 3.41Å
392	E	94.6	Very high	92.3	Very high	83 Å²	83	70.5 Å²	70.5	39%	0.388	33%	0.326	S	S	.	.			trans	-68.5	159	166.2	-72	-172.1	-154.4	0	0	111.7	F345 K389 H390 Y398 I399	F345-E392 HydrophobicContact CE2-CB 3.76Å; F345-E392 HydrophobicContact CZ-CB 3.97Å; K389-E392 WeakPolarHBondContact CA-OE1 3.27Å; K389-E392 HydrophobicContact CB-CB 4.49Å; K389-E392 HydrophobicContact CB-CG 4.21Å; K389-E392 VanDerWaalsContact CE-CD 3.43Å; K389-E392 WeakPolarHBondContact CE-OE2 3.44Å; K389-E392 IonicContact NZ-OE2 4Å; K389-E392 PolarHBondContact NZ-OE2 2.94Å; K389-E392 VanDerWaalsContact O-CB 3.27Å; K389-E392 WeakPolarHBondContact O-CB 3.32Å; K389-E392 WeakPolarHBondContact O-CG 3.38Å; K389-E392 PolarHBondContact O-N 2.96Å; H390-E392 VanDerWaalsContact C-N 3.29Å; E392-Y398 CarbonylContact O-C 3.59Å; E392-Y398 WeakPolarHBondContact O-CA 3.48Å; E392-I399 PolarHBondContact O-N 2.71Å
393	L	92.9	Very high	92.1	Very high	120 Å²	120	67.6 Å²	67.6	63%	0.628	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.4	-176	-65	172.5	0	0	0	111.6	R397	L393-R397 CarbonylContact C-O 3.56Å; L393-R397 WeakPolarHBondContact CA-O 3.45Å
394	L	92.7	Very high	92	Very high	11 Å²	11	67.9 Å²	67.9	6%	0.058	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.1	161.1	-164.4	158.2	0	0	0	107.5	L333 P334 A337 E341 V342 F345 K396 R397 I399	L333-L394 HydrophobicContact CD2-CD1 3.92Å; P334-L394 HydrophobicContact CG-CD2 3.84Å; P334-L394 WeakPolarHBondContact CG-O 3.27Å; A337-L394 HydrophobicContact CB-CD2 4.31Å; E341-L394 HydrophobicContact CB-CD2 4.42Å; V342-L394 HydrophobicContact CG2-CD1 4.35Å; F345-L394 HydrophobicContact CB-CD1 3.85Å; F345-L394 HydrophobicContact CD2-CB 4.09Å; F345-L394 HydrophobicContact CD2-CD1 4.19Å; F345-L394 HydrophobicContact CD2-CG 4.4Å; F345-L394 HydrophobicContact CE2-CB 4.5Å; F345-L394 HydrophobicContact CG-CD1 4.05Å; L394-K396 PolarHBondContact O-N 3.34Å; L394-K396 VanDerWaalsContact O-N 3.15Å; L394-R397 PolarHBondContact N-O 2.84Å; L394-R397 PolarHBondContact O-N 3.05Å; L394-I399 HydrophobicContact CB-CD1 3.91Å; L394-I399 HydrophobicContact CB-CG1 3.56Å
395	G	88.3	Confident	91.8	Very high	69 Å²	69	63.7 Å²	63.7	71%	0.711	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	-113.2	-167.9	0	0	0	0	0	111.3
396	K	89.5	Confident	91.5	Very high	203 Å²	203	63 Å²	63	88%	0.883	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	8.1	-179.4	-61.4	-177.1	-178.9	178.7	0	113.8	L394	L394-K396 PolarHBondContact O-N 3.34Å; L394-K396 VanDerWaalsContact O-N 3.15Å
397	R	92.2	Very high	91.1	Very high	128 Å²	128	63.4 Å²	63.4	48%	0.483	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.4	-173.2	-62.4	-68.6	-65.1	-172.6	-1.6	109.5	G332 P334 L393 L394 I399	G332-R397 WeakPolarHBondContact O-CB 3.27Å; P334-R397 HydrophobicContact CB-CG 4.48Å; P334-R397 HydrophobicContact CG-CB 4.09Å; P334-R397 HydrophobicContact CG-CG 3.88Å; L393-R397 CarbonylContact C-O 3.56Å; L393-R397 WeakPolarHBondContact CA-O 3.45Å; L394-R397 PolarHBondContact N-O 2.84Å; L394-R397 PolarHBondContact O-N 3.05Å; R397-I399 HydrophobicContact CB-CD1 4.45Å
398	Y	94.4	Very high	90.9	Very high	128 Å²	128	61.9 Å²	61.9	50%	0.502	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	139.9	166.9	62.5	-95.7	0	0	0	109.1	E392 E400	E392-Y398 CarbonylContact O-C 3.59Å; E392-Y398 WeakPolarHBondContact O-CA 3.48Å; Y398-E400 HydrophobicContact CD2-CG 4.24Å; Y398-E400 HydrophobicContact CE2-CG 4.12Å
399	I	95.6	Very high	90.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.259	C	S	.	.			trans	-105.4	125.5	-177.6	-56.4	-50.9	0	0	0	109.5	M330 G332 L333 F345 K391 E392 L394 R397 L401	M330-I399 HydrophobicContact CB-CG2 4.17Å; M330-I399 HydrophobicContact CE-CG2 3.8Å; G332-I399 WeakPolarHBondContact O-CD1 3.37Å; L333-I399 HydrophobicContact CD2-CD1 3.94Å; L333-I399 HydrophobicContact CD2-CG1 4.48Å; L333-I399 HydrophobicContact CG-CD1 4.38Å; F345-I399 HydrophobicContact CE2-CG1 4.41Å; F345-I399 HydrophobicContact CZ-CB 4.21Å; F345-I399 HydrophobicContact CZ-CG1 4.5Å; K391-I399 VanDerWaalsContact CA-O 3.29Å; K391-I399 WeakPolarHBondContact CA-O 3.46Å; K391-I399 PolarHBondContact N-O 3.41Å; E392-I399 PolarHBondContact O-N 2.71Å; L394-I399 HydrophobicContact CB-CD1 3.91Å; L394-I399 HydrophobicContact CB-CG1 3.56Å; R397-I399 HydrophobicContact CB-CD1 4.45Å; I399-L401 HydrophobicContact CG2-CD2 3.78Å; I399-L401 HydrophobicContact CG2-CG 4.35Å
400	E	92.8	Very high	90.4	Very high	61 Å²	61	51.8 Å²	51.8	29%	0.285	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124.2	173	-58.3	-178.5	108.2	0	0	109.4	M330 R331 Y398 F402	M330-E400 CarbonylContact C-O 3.58Å; M330-E400 WeakPolarHBondContact CA-O 3.48Å; R331-E400 HydrophobicContact CB-CB 4.33Å; R331-E400 PolarHBondContact N-O 3.37Å; R331-E400 PolarHBondContact O-N 3.23Å; Y398-E400 HydrophobicContact CD2-CG 4.24Å; Y398-E400 HydrophobicContact CE2-CG 4.12Å; E400-F402 HydrophobicContact CB-CD2 4.43Å; E400-F402 HydrophobicContact CB-CE2 3.44Å; E400-F402 VanDerWaalsContact CB-CE2 3.44Å; E400-F402 HydrophobicContact CB-CZ 3.73Å
401	L	92.9	Very high	90.2	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.7	178.3	-57.8	176.9	0	0	0	110.5	V328 R329 M330 F345 F346 A386 L387 K389 H390 I399	V328-L401 HydrophobicContact CG1-CB 4.18Å; V328-L401 HydrophobicContact CG1-CD2 4.28Å; R329-L401 WeakPolarHBondContact O-CA 3.29Å; M330-L401 HydrophobicContact CB-CD2 4.15Å; M330-L401 HydrophobicContact CE-CD2 4.09Å; M330-L401 HydrophobicContact CG-CD2 3.62Å; F345-L401 HydrophobicContact CE1-CD1 4.14Å; F346-L401 HydrophobicContact CE1-CD1 3.86Å; F346-L401 HydrophobicContact CE1-CD2 4.27Å; F346-L401 HydrophobicContact CZ-CD1 4.32Å; F346-L401 HydrophobicContact CZ-CD2 3.88Å; A386-L401 WeakPolarHBondContact O-CD1 3.31Å; L387-L401 HydrophobicContact CD2-CB 4.22Å; K389-L401 HydrophobicContact CB-CD1 3.95Å; H390-L401 HydrophobicContact CB-CB 4.33Å; H390-L401 PolarHBondContact ND1-N 3.14Å; H390-L401 PolarHBondContact ND1-O 2.93Å; I399-L401 HydrophobicContact CG2-CD2 3.78Å; I399-L401 HydrophobicContact CG2-CG 4.35Å
402	F	90.1	Very high	89.9	Confident	37 Å²	37	44 Å²	44	16%	0.162	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145	177.6	-54.1	-83.4	0	0	0	108.9	V328 R329 R331 E400	V328-F402 CarbonylContact C-O 3.58Å; V328-F402 WeakPolarHBondContact CA-O 3.2Å; V328-F402 WeakPolarHBondContact CG1-O 3.24Å; R329-F402 PolarHBondContact N-O 3.15Å; R329-F402 PolarHBondContact O-N 2.86Å; R331-F402 HydrophobicContact CB-CE2 4.49Å; R331-F402 HydrophobicContact CG-CD2 4.26Å; R331-F402 HydrophobicContact CG-CE2 4.08Å; E400-F402 HydrophobicContact CB-CD2 4.43Å; E400-F402 HydrophobicContact CB-CE2 3.44Å; E400-F402 VanDerWaalsContact CB-CE2 3.44Å; E400-F402 HydrophobicContact CB-CZ 3.73Å
403	R	88.8	Confident	89.5	Confident	20 Å²	20	40.7 Å²	40.7	8%	0.075	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	156.2	162.3	-74.7	-153.6	176.5	-135.9	1.4	109.9	R265 E380 Q384 L387	R265-R403 PolarHBondContact NH2-O 3.24Å; E380-R403 IonicContact OE1-CZ 3.41Å; E380-R403 IonicContact OE1-NH1 3.69Å; E380-R403 PolarHBondContact OE1-NH1 3.34Å; E380-R403 IonicContact OE1-NH2 3.37Å; E380-R403 PolarHBondContact OE1-NH2 3.11Å; E380-R403 IonicContact OE2-CZ 2.71Å; E380-R403 IonicContact OE2-NH1 2.71Å; E380-R403 PolarHBondContact OE2-NH1 3.46Å; E380-R403 IonicContact OE2-NH2 3.96Å; E380-R403 PolarHBondContact OE2-NH2 3.34Å; Q384-R403 VanDerWaalsContact OE1-NH2 3.13Å; L387-R403 HydrophobicContact CD1-CG 3.54Å; L387-R403 HydrophobicContact CD2-CG 4.32Å
404	S	88.7	Confident	89	Confident	6 Å²	6	38 Å²	38	4%	0.042	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	163.8	173.3	-85.1	0	0	0	0	111.5	I327 R329 E408	I327-S404 PolarHBondContact O-N 3.43Å; R329-S404 WeakPolarHBondContact CB-OG 3.43Å; S404-E408 WeakPolarHBondContact CA-OE2 3.1Å; S404-E408 WeakPolarHBondContact CB-OE2 3.45Å; S404-E408 PolarHBondContact OG-OE1 3.49Å; S404-E408 PolarHBondContact OG-OE2 3.47Å
405	T	86.6	Confident	88.6	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.018	20%	0.198	C	C	.	.			trans	-113.1	161.9	176.7	61.2	0	0	0	0	109.4	D238 L257 A407 E408 V409	D238-T405 HydrophobicContact CB-CG2 3.6Å; L257-T405 HydrophobicContact CD1-CG2 3.86Å; L257-T405 HydrophobicContact CG-CG2 4.05Å; T405-A407 PolarHBondContact O-N 2.87Å; T405-E408 WeakPolarHBondContact O-CB 3.49Å; T405-E408 PolarHBondContact O-N 3.01Å; T405-E408 PolarHBondContact OG1-N 2.86Å; T405-E408 VanDerWaalsContact OG1-N 3.14Å; T405-V409 PolarHBondContact O-N 2.85Å; T405-V409 VanDerWaalsContact O-N 3.15Å
406	A	84.8	Confident	88.1	Confident	10 Å²	10	39.1 Å²	39.1	8%	0.083	17%	0.171	C	C	.	.	H	α-helix	trans	-54	-41.1	172.1	0	0	0	0	0	112	G213 T214 L320 E408 V409 Q410	G213-A406 VanDerWaalsContact O-CB 3.25Å; G213-A406 WeakPolarHBondContact O-CB 3.3Å; T214-A406 HydrophobicContact CG2-CB 4.07Å; L320-A406 HydrophobicContact CD1-CB 3.7Å; A406-E408 VanDerWaalsContact C-N 3.31Å; A406-E408 PolarHBondContact O-N 2.89Å; A406-V409 WeakPolarHBondContact O-CB 3.44Å; A406-V409 PolarHBondContact O-N 3.22Å; A406-Q410 WeakPolarHBondContact O-CG 3.44Å; A406-Q410 PolarHBondContact O-N 3.14Å
407	A	85.3	Confident	87.3	Confident	7 Å²	7	33.3 Å²	33.3	6%	0.058	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-35.9	175.2	0	0	0	0	0	112.4	A256 A309 T405 Q410 Q411	A256-A407 HydrophobicContact CB-CB 3.74Å; A309-A407 HydrophobicContact CB-CB 3.9Å; T405-A407 PolarHBondContact O-N 2.87Å; A407-Q410 PolarHBondContact O-N 2.91Å; A407-Q411 WeakPolarHBondContact O-CB 3.3Å; A407-Q411 VanDerWaalsContact O-CG 3.3Å; A407-Q411 WeakPolarHBondContact O-CG 3.2Å; A407-Q411 PolarHBondContact O-N 3.38Å; A407-Q411 PolarHBondContact O-NE2 2.83Å; A407-Q411 VanDerWaalsContact O-NE2 3.15Å
408	E	88.2	Confident	85.7	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.009	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-42.2	177	-162.9	179.3	164.9	0	0	111.7	L259 R265 R329 S404 T405 A406 Q410 Q411 V412	L259-E408 HydrophobicContact CD1-CG 3.76Å; L259-E408 HydrophobicContact CD2-CG 4.03Å; L259-E408 HydrophobicContact CG-CG 4.13Å; R265-E408 IonicContact NE-OE2 2.66Å; R329-E408 VanDerWaalsContact CD-OE1 3.29Å; R329-E408 WeakPolarHBondContact CD-OE1 3.3Å; R329-E408 IonicContact CZ-OE1 3.38Å; R329-E408 IonicContact NE-OE1 2.73Å; R329-E408 IonicContact NH1-OE1 3.61Å; R329-E408 PolarHBondContact NH1-OE1 3.41Å; S404-E408 WeakPolarHBondContact CA-OE2 3.1Å; S404-E408 WeakPolarHBondContact CB-OE2 3.45Å; S404-E408 PolarHBondContact OG-OE1 3.49Å; S404-E408 PolarHBondContact OG-OE2 3.47Å; T405-E408 WeakPolarHBondContact O-CB 3.49Å; T405-E408 PolarHBondContact O-N 3.01Å; T405-E408 PolarHBondContact OG1-N 2.86Å; T405-E408 VanDerWaalsContact OG1-N 3.14Å; A406-E408 VanDerWaalsContact C-N 3.31Å; A406-E408 PolarHBondContact O-N 2.89Å; E408-Q410 VanDerWaalsContact C-N 3.32Å; E408-Q410 PolarHBondContact O-N 2.82Å; E408-Q411 PolarHBondContact O-N 3.15Å; E408-V412 HydrophobicContact CG-CG2 4.49Å; E408-V412 WeakPolarHBondContact O-CG2 3.41Å; E408-V412 PolarHBondContact O-N 2.81Å
409	V	88.6	Confident	83.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56	-49.7	175.1	179.2	0	0	0	0	110.1	V316 F319 I327 L360 F374 T405 A406 V412 L413	V316-V409 HydrophobicContact CG1-CG1 4.01Å; V316-V409 HydrophobicContact CG2-CG1 4.44Å; F319-V409 HydrophobicContact CD1-CG1 4.38Å; F319-V409 HydrophobicContact CE1-CG2 4.49Å; I327-V409 HydrophobicContact CD1-CG2 4.16Å; I327-V409 HydrophobicContact CG2-CG2 3.92Å; L360-V409 HydrophobicContact CD2-CG1 3.98Å; F374-V409 HydrophobicContact CB-CG2 4.42Å; F374-V409 HydrophobicContact CD1-CG2 3.63Å; F374-V409 HydrophobicContact CD2-CG1 4.21Å; F374-V409 HydrophobicContact CD2-CG2 4.26Å; F374-V409 HydrophobicContact CE1-CB 4.46Å; F374-V409 HydrophobicContact CE1-CG2 3.79Å; F374-V409 HydrophobicContact CE2-CB 4.44Å; F374-V409 HydrophobicContact CE2-CG1 4.37Å; F374-V409 HydrophobicContact CE2-CG2 4.42Å; F374-V409 HydrophobicContact CG-CG2 3.86Å; F374-V409 HydrophobicContact CZ-CB 4.38Å; F374-V409 HydrophobicContact CZ-CG2 4.19Å; T405-V409 PolarHBondContact O-N 2.85Å; T405-V409 VanDerWaalsContact O-N 3.15Å; A406-V409 WeakPolarHBondContact O-CB 3.44Å; A406-V409 PolarHBondContact O-N 3.22Å; V409-V412 PolarHBondContact O-N 2.83Å; V409-L413 HydrophobicContact CG1-CD1 3.69Å; V409-L413 WeakPolarHBondContact O-CB 3.42Å; V409-L413 WeakPolarHBondContact O-CD1 3.32Å; V409-L413 WeakPolarHBondContact O-CG 3.38Å; V409-L413 PolarHBondContact O-N 2.97Å
410	Q	86.3	Confident	80.7	Confident	10 Å²	10	32.2 Å²	32.2	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-45.7	179.1	-67.9	175.9	0.3	0	0	112.6	A309 G311 V316 A406 A407 E408 V412 L413 N414	A309-Q410 PolarHBondContact O-OE1 2.7Å; G311-Q410 VanDerWaalsContact CA-CD 3.41Å; G311-Q410 VanDerWaalsContact CA-OE1 3.32Å; V316-Q410 HydrophobicContact CG1-CG 3.72Å; A406-Q410 WeakPolarHBondContact O-CG 3.44Å; A406-Q410 PolarHBondContact O-N 3.14Å; A407-Q410 PolarHBondContact O-N 2.91Å; E408-Q410 VanDerWaalsContact C-N 3.32Å; E408-Q410 PolarHBondContact O-N 2.82Å; Q410-V412 PolarHBondContact O-N 2.7Å; Q410-L413 PolarHBondContact O-N 2.99Å; Q410-N414 VanDerWaalsContact O-CB 3.24Å; Q410-N414 WeakPolarHBondContact O-CB 3.13Å; Q410-N414 PolarHBondContact O-N 3.09Å; Q410-N414 PolarHBondContact O-ND2 2.89Å
411	Q	87.6	Confident	78.2	Confident	23 Å²	23	36.8 Å²	36.8	11%	0.107	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-43.6	179.3	-77.9	171.4	73.1	0	0	112.7	L257 L259 I308 A407 E408 R415	L257-Q411 PolarHBondContact O-NE2 2.94Å; L259-Q411 HydrophobicContact CD1-CB 4.11Å; I308-Q411 HydrophobicContact CG2-CG 4.34Å; I308-Q411 VanDerWaalsContact O-CG 3.23Å; I308-Q411 WeakPolarHBondContact O-CG 3.44Å; A407-Q411 WeakPolarHBondContact O-CB 3.3Å; A407-Q411 VanDerWaalsContact O-CG 3.3Å; A407-Q411 WeakPolarHBondContact O-CG 3.2Å; A407-Q411 PolarHBondContact O-N 3.38Å; A407-Q411 PolarHBondContact O-NE2 2.83Å; A407-Q411 VanDerWaalsContact O-NE2 3.15Å; E408-Q411 PolarHBondContact O-N 3.15Å; Q411-R415 WeakPolarHBondContact O-CB 3.22Å; Q411-R415 PolarHBondContact O-N 2.69Å
412	V	88.1	Confident	75.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-47.4	-179.8	171.8	0	0	0	0	110	L259 V362 F374 E408 V409 Q410 R415 F416	L259-V412 HydrophobicContact CD1-CG2 3.54Å; V362-V412 HydrophobicContact CB-CG1 4.44Å; V362-V412 HydrophobicContact CG1-CG1 3.84Å; V362-V412 HydrophobicContact CG2-CG1 3.84Å; F374-V412 HydrophobicContact CE2-CB 3.93Å; F374-V412 HydrophobicContact CE2-CG1 3.94Å; F374-V412 HydrophobicContact CE2-CG2 4.42Å; F374-V412 HydrophobicContact CZ-CB 3.84Å; F374-V412 HydrophobicContact CZ-CG1 4.18Å; F374-V412 HydrophobicContact CZ-CG2 3.85Å; E408-V412 HydrophobicContact CG-CG2 4.49Å; E408-V412 WeakPolarHBondContact O-CG2 3.41Å; E408-V412 PolarHBondContact O-N 2.81Å; V409-V412 PolarHBondContact O-N 2.83Å; Q410-V412 PolarHBondContact O-N 2.7Å; V412-R415 WeakPolarHBondContact O-CB 3.44Å; V412-R415 PolarHBondContact O-N 3.45Å; V412-F416 HydrophobicContact CG1-CD2 4Å; V412-F416 HydrophobicContact CG1-CE2 4.01Å; V412-F416 WeakPolarHBondContact O-CD2 3.32Å; V412-F416 PolarHBondContact O-N 2.75Å
413	L	85.4	Confident	73.1	Confident	13 Å²	13	46.7 Å²	46.7	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-48.2	-180	-70	163.8	0	0	0	111.7	V316 L360 V362 V409 Q410 R415 F416 S417	V316-L413 HydrophobicContact CG2-CD1 3.22Å; L360-L413 HydrophobicContact CD2-CD1 3.7Å; V362-L413 HydrophobicContact CG1-CD2 4.28Å; V362-L413 HydrophobicContact CG2-CD2 4.21Å; V409-L413 HydrophobicContact CG1-CD1 3.69Å; V409-L413 WeakPolarHBondContact O-CB 3.42Å; V409-L413 WeakPolarHBondContact O-CD1 3.32Å; V409-L413 WeakPolarHBondContact O-CG 3.38Å; V409-L413 PolarHBondContact O-N 2.97Å; Q410-L413 PolarHBondContact O-N 2.99Å; L413-R415 PolarHBondContact O-N 3.06Å; L413-R415 VanDerWaalsContact O-N 3.11Å; L413-F416 PolarHBondContact O-N 3.46Å; L413-S417 WeakPolarHBondContact O-CB 3.32Å; L413-S417 PolarHBondContact O-N 3.14Å; L413-S417 PolarHBondContact O-OG 3.24Å
414	N	83.4	Confident	70.5	Confident	65 Å²	65	52.2 Å²	52.2	35%	0.348	30%	0.304	S	S	.	.	H	α-helix	trans	-53.9	-38.5	178	-77.7	-17.4	0	0	0	111.8	Q410 S418	Q410-N414 VanDerWaalsContact O-CB 3.24Å; Q410-N414 WeakPolarHBondContact O-CB 3.13Å; Q410-N414 PolarHBondContact O-N 3.09Å; Q410-N414 PolarHBondContact O-ND2 2.89Å; N414-S418 WeakPolarHBondContact O-CB 3.41Å; N414-S418 PolarHBondContact O-N 3.34Å; N414-S418 PolarHBondContact O-OG 3.15Å
415	R	83	Confident	67.9	Low	68 Å²	68	57.5 Å²	57.5	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-47.3	177	-177.4	-174.1	-57	174.8	-0.8	113.2	N260 A261 Q262 Q411 V412 L413 S417 S418 A419	N260-R415 PolarHBondContact O-NH2 3.15Å; A261-R415 VanDerWaalsContact O-CZ 3.31Å; A261-R415 PolarHBondContact O-NH1 3.45Å; Q262-R415 VanDerWaalsContact C-NH1 3.26Å; Q411-R415 WeakPolarHBondContact O-CB 3.22Å; Q411-R415 PolarHBondContact O-N 2.69Å; V412-R415 WeakPolarHBondContact O-CB 3.44Å; V412-R415 PolarHBondContact O-N 3.45Å; L413-R415 PolarHBondContact O-N 3.06Å; L413-R415 VanDerWaalsContact O-N 3.11Å; R415-S417 VanDerWaalsContact C-N 3.34Å; R415-S418 PolarHBondContact O-N 3.18Å; R415-A419 PolarHBondContact O-N 2.71Å
416	F	78.8	Confident	65.5	Low	34 Å²	34	63.4 Å²	63.4	15%	0.149	38%	0.375	C	S	.	.	H	α-helix	trans	-78	-23.4	-177.5	-70.7	-71.3	0	0	0	112.1	V362 Y364 P365 T370 V412 L413	V362-F416 HydrophobicContact CG1-CB 4.16Å; V362-F416 HydrophobicContact CG1-CD2 3.41Å; V362-F416 VanDerWaalsContact CG1-CD2 3.41Å; V362-F416 HydrophobicContact CG1-CE2 4.06Å; V362-F416 HydrophobicContact CG1-CG 3.99Å; Y364-F416 HydrophobicContact CD1-CD1 4Å; Y364-F416 AromaticContact CE1-CD1 3.55Å; Y364-F416 HydrophobicContact CE1-CD1 3.55Å; Y364-F416 AromaticContact CE1-CE1 3.91Å; Y364-F416 HydrophobicContact CE1-CE1 3.91Å; Y364-F416 AromaticContact CZ-CD1 3.94Å; Y364-F416 AromaticContact CZ-CE1 3.9Å; P365-F416 WeakPolarHBondContact CD-O 3.26Å; P365-F416 WeakPolarHBondContact CG-O 3.4Å; T370-F416 HydrophobicContact CG2-CB 4.47Å; T370-F416 HydrophobicContact CG2-CD1 3.59Å; T370-F416 HydrophobicContact CG2-CD2 4.21Å; T370-F416 HydrophobicContact CG2-CE1 3.74Å; T370-F416 HydrophobicContact CG2-CE2 4.34Å; T370-F416 HydrophobicContact CG2-CG 3.84Å; T370-F416 HydrophobicContact CG2-CZ 4.11Å; V412-F416 HydrophobicContact CG1-CD2 4Å; V412-F416 HydrophobicContact CG1-CE2 4.01Å; V412-F416 WeakPolarHBondContact O-CD2 3.32Å; V412-F416 PolarHBondContact O-N 2.75Å; L413-F416 PolarHBondContact O-N 3.46Å
417	S	71.9	Confident	63	Low	81 Å²	81	68.2 Å²	68.2	57%	0.566	41%	0.405	S	S	*	.	H	α-helix	trans	-73.3	-23.6	171.4	-56.9	0	0	0	0	113.7	L413 R415	L413-S417 WeakPolarHBondContact O-CB 3.32Å; L413-S417 PolarHBondContact O-N 3.14Å; L413-S417 PolarHBondContact O-OG 3.24Å; R415-S417 VanDerWaalsContact C-N 3.34Å
418	S	58	Low	60.6	Low	88 Å²	88	73.5 Å²	73.5	62%	0.615	44%	0.438	S	S	*	.	S	Bend	trans	-113.3	10.7	-172.4	58.1	0	0	0	0	115.4	N414 R415 P420	N414-S418 WeakPolarHBondContact O-CB 3.41Å; N414-S418 PolarHBondContact O-N 3.34Å; N414-S418 PolarHBondContact O-OG 3.15Å; R415-S418 PolarHBondContact O-N 3.18Å; S418-P420 WeakPolarHBondContact O-CD 3.44Å
419	A	45.2	Very low	58.2	Low	52 Å²	52	81 Å²	81	43%	0.43	48%	0.477	S	S	.	.			trans	-69.2	120.3	175	0	0	0	0	0	111.2	R415	R415-A419 PolarHBondContact O-N 2.71Å
420	P	40.6	Very low	55.6	Low	93 Å²	93	87.9 Å²	87.9	60%	0.604	51%	0.512	S	S	*	.			trans	-69.9	143.1	166.4	6	7.7	0	0	0	109.2	S418 I422	S418-P420 WeakPolarHBondContact O-CD 3.44Å; P420-I422 PolarHBondContact O-N 3.32Å
421	L	40.4	Very low	53.2	Low	158 Å²	158	93 Å²	93	83%	0.827	55%	0.546	S	S	*	.	S	Bend	trans	-67.9	14.5	178.2	-84.8	162.4	0	0	0	114.9
422	I	40.8	Very low	50.9	Low	120 Å²	120	98 Å²	98	62%	0.615	58%	0.578	S	S	*	*	S	Bend	trans	-149.3	134.8	178.8	-52.6	177.7	0	0	0	108.7	P420 L424	P420-I422 PolarHBondContact O-N 3.32Å; I422-L424 PolarHBondContact O-N 3.28Å
423	P	34.3	Very low	48.3	Very low	128 Å²	128	105.5 Å²	105.5	83%	0.831	62%	0.618	S	S	*	*			trans	-68.4	100.6	170.4	-0.4	15.1	0	0	0	108.7
424	L	34.3	Very low	46	Very low	135 Å²	135	110.7 Å²	110.7	71%	0.707	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-80.4	135	165.4	-77.8	160.1	0	0	0	108.4	I422 T426	I422-L424 PolarHBondContact O-N 3.28Å; L424-T426 PolarHBondContact O-N 3.43Å
425	P	35.2	Very low	43.6	Very low	117 Å²	117	116.3 Å²	116.3	76%	0.76	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-61.5	131.1	173.8	25	-30.7	0	0	0	109.4
426	T	35.3	Very low	41.5	Very low	128 Å²	128	122.1 Å²	122.1	79%	0.785	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-57.9	131.5	174.3	41	0	0	0	0	110.3	L424	L424-T426 PolarHBondContact O-N 3.43Å
427	P	31.9	Very low	39.3	Very low	111 Å²	111	130.4 Å²	130.4	72%	0.721	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-66.2	142.4	171.9	27.8	-31.4	0	0	0	109.5	I429	P427-I429 PolarHBondContact O-N 3.05Å
428	P	35.1	Very low	38	Very low	117 Å²	117	132 Å²	132	76%	0.76	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-70.5	129.2	-178.2	28.9	-31.4	0	0	0	109.8
429	I	37.4	Very low	37	Very low	161 Å²	161	131.8 Å²	131.8	83%	0.826	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-78.2	120.3	164.3	-62.2	170.1	0	0	0	105.9	P427 P431	P427-I429 PolarHBondContact O-N 3.05Å; I429-P431 VanDerWaalsContact O-CD 3.3Å; I429-P431 WeakPolarHBondContact O-CD 3.38Å
430	I	35	Very low	36.9	Very low	144 Å²	144	134.8 Å²	134.8	74%	0.738	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-83.8	118.3	174.8	-58.4	168.1	0	0	0	108.1
431	P	35.3	Very low	37.4	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-95.7	126.2	158.7	6.4	15.5	0	0	0	109	I429	I429-P431 VanDerWaalsContact O-CD 3.3Å; I429-P431 WeakPolarHBondContact O-CD 3.38Å
432	V	39.2	Very low	38.4	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	75%	0.748	S	S	*	*			trans	-78.8	112.2	176.4	177.2	0	0	0	0	109.5
433	L	33.1	Very low	40.3	Very low	158 Å²	158	129.6 Å²	129.6	83%	0.827	73%	0.734	S	S	*	*			trans	-170.4	150.3	146.1	-102.7	133.4	0	0	0	109.8	Q435	L433-Q435 PolarHBondContact O-N 3.14Å
434	P	37.1	Very low	42.8	Very low	122 Å²	122	127.9 Å²	127.9	79%	0.792	71%	0.711	S	S	*	*			trans	-85.6	110.6	-151.2	32.9	-30.9	0	0	0	111.1
435	Q	34.7	Very low	45.5	Very low	183 Å²	183	122.2 Å²	122.2	86%	0.855	68%	0.682	S	S	*	*			trans	-113.4	134.1	161.4	-76	-169.7	-26.2	0	0	109.5	L433 F437	L433-Q435 PolarHBondContact O-N 3.14Å; Q435-F437 PolarHBondContact O-N 2.73Å
436	Q	37.2	Very low	48.2	Very low	189 Å²	189	116.6 Å²	116.6	88%	0.883	65%	0.645	S	S	*	*			trans	-50.5	129	-171.3	-69.3	169.2	-18.5	0	0	110.8	V438	Q436-V438 PolarHBondContact O-N 2.92Å
437	F	33.8	Very low	50.9	Low	208 Å²	208	110.5 Å²	110.5	91%	0.912	61%	0.608	S	S	*	*			trans	-45.6	103.8	176.8	-97.8	-104.2	0	0	0	111.2	Q435	Q435-F437 PolarHBondContact O-N 2.73Å
438	V	43.4	Very low	53.9	Low	114 Å²	114	107.2 Å²	107.2	69%	0.691	58%	0.581	S	S	*	*			trans	-111	115.3	152.8	-170.9	0	0	0	0	105.1	Q436	Q436-V438 PolarHBondContact O-N 2.92Å
439	P	36.9	Very low	56.7	Low	84 Å²	84	101.7 Å²	101.7	55%	0.545	55%	0.545	S	S	.	.			trans	-61.5	138	-176.1	22.4	-30.7	0	0	0	110.5	T441	P439-T441 VanDerWaalsContact C-N 3.32Å; P439-T441 HydrophobicContact CB-CG2 4.49Å; P439-T441 PolarHBondContact O-N 3.4Å
440	P	43.5	Very low	59.2	Low	115 Å²	115	98.1 Å²	98.1	75%	0.747	52%	0.521	S	S	*	.			trans	-73.6	93.3	177.7	30.7	-31.3	0	0	0	107.5
441	T	50.9	Low	61.6	Low	80 Å²	80	92.2 Å²	92.2	49%	0.491	50%	0.496	S	S	.	.			trans	-110.7	129.7	168.7	60.5	0	0	0	0	105	P439 V443	P439-T441 VanDerWaalsContact C-N 3.32Å; P439-T441 HydrophobicContact CB-CG2 4.49Å; P439-T441 PolarHBondContact O-N 3.4Å; T441-V443 PolarHBondContact O-N 3.09Å; T441-V443 WeakPolarHBondContact OG1-CG2 3.43Å
442	N	62.4	Low	64.2	Low	130 Å²	130	86.7 Å²	86.7	70%	0.695	46%	0.46	S	S	*	.			trans	-71.8	40.6	178.6	-129.3	-36.2	0	0	0	110.8
443	V	79.8	Confident	66.5	Low	53 Å²	53	81.5 Å²	81.5	32%	0.321	43%	0.429	S	S	.	.			trans	-86.3	121.4	-169.8	170.3	0	0	0	0	106.2	T441 D445 T498	T441-V443 PolarHBondContact O-N 3.09Å; T441-V443 WeakPolarHBondContact OG1-CG2 3.43Å; V443-D445 HydrophobicContact CG1-CB 3.92Å; V443-D445 PolarHBondContact O-N 2.99Å; V443-D445 VanDerWaalsContact O-N 3.13Å; V443-T498 HydrophobicContact CB-CG2 4.4Å; V443-T498 HydrophobicContact CG1-CG2 3.24Å
444	R	87.2	Confident	68.9	Low	92 Å²	92	81.2 Å²	81.2	35%	0.347	42%	0.418	S	S	.	.			trans	-88.2	57.3	-179.1	-66.8	-172.7	169.9	-161.9	-7.6	110.5	C446 Q522 C523	R444-C446 VanDerWaalsContact C-N 3.31Å; R444-Q522 HydrophobicContact CB-CG 3.94Å; R444-Q522 PolarHBondContact O-NE2 3.02Å; R444-C523 CarbonylContact C-O 3.48Å; R444-C523 VanDerWaalsContact CA-O 3.27Å; R444-C523 WeakPolarHBondContact CA-O 3.26Å
445	D	90.4	Very high	71.1	Confident	15 Å²	15	79.4 Å²	79.4	8%	0.08	41%	0.413	C	S	.	.			trans	-91.1	10.9	177.6	67.4	-22.8	0	0	0	113	V443 R473 M495 T498	V443-D445 HydrophobicContact CG1-CB 3.92Å; V443-D445 PolarHBondContact O-N 2.99Å; V443-D445 VanDerWaalsContact O-N 3.13Å; D445-R473 IonicContact OD2-NH2 3.35Å; D445-R473 PolarHBondContact OD2-NH2 2.72Å; D445-M495 WeakPolarHBondContact O-CA 3.34Å; D445-M495 WeakPolarHBondContact O-CB 3.45Å; D445-M495 PolarHBondContact O-N 3.14Å; D445-T498 HydrophobicContact CB-CG2 4Å
446	C	91.8	Very high	73.5	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	158.9	174.9	-64.4	0	0	0	0	112.3	R444 I493 C523 M528	R444-C446 VanDerWaalsContact C-N 3.31Å; C446-I493 CarbonylContact C-O 3.49Å; C446-I493 VanDerWaalsContact CA-O 3.24Å; C446-I493 WeakPolarHBondContact CA-O 3.44Å; C446-C523 CarbonylContact C-O 3.38Å; C446-C523 WeakPolarHBondContact CA-O 3.47Å; C446-C523 WeakPolarHBondContact CB-O 3.34Å; C446-C523 VanDerWaalsContact CB-SG 3.6Å; C446-C523 PolarHBondContact N-O 2.85Å; C446-C523 VanDerWaalsContact N-O 3.07Å; C446-C523 PolarHBondContact O-N 3.47Å; C446-M528 HydrophobicContact CB-SD 4.45Å
447	I	93.9	Very high	76	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.1	173.9	-64.2	164.1	0	0	0	109.3	L449 F492 I493 M495 A501 A504 V520 F521	I447-L449 HydrophobicContact CG2-CD2 4.17Å; I447-F492 CarbonylContact O-C 3.5Å; I447-F492 WeakPolarHBondContact O-CA 3.43Å; I447-I493 PolarHBondContact N-O 3.27Å; I447-I493 PolarHBondContact O-N 3.47Å; I447-M495 HydrophobicContact CD1-CE 4.47Å; I447-M495 HydrophobicContact CD1-CG 3.85Å; I447-M495 HydrophobicContact CD1-SD 3.97Å; I447-M495 HydrophobicContact CG1-CG 4.29Å; I447-A501 HydrophobicContact CD1-CB 4.37Å; I447-A501 WeakPolarHBondContact CD1-O 3.48Å; I447-A501 HydrophobicContact CG1-CB 4.03Å; I447-A504 HydrophobicContact CD1-CB 3.67Å; I447-V520 HydrophobicContact CG2-CG1 3.19Å; I447-F521 CarbonylContact C-O 3.49Å; I447-F521 VanDerWaalsContact CA-O 3.32Å; I447-F521 WeakPolarHBondContact CA-O 3.43Å
448	R	93.5	Very high	78.5	Confident	42 Å²	42	58.9 Å²	58.9	16%	0.158	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.7	168	-175.4	-179.1	178.1	179.6	0.5	110.3	D490 A491 F492 V520 F521	R448-D490 IonicContact CZ-OD2 2.85Å; R448-D490 IonicContact NE-OD2 2.58Å; R448-D490 IonicContact NH2-OD2 2.73Å; R448-D490 PolarHBondContact NH2-OD2 3.05Å; R448-A491 CarbonylContact C-O 3.53Å; R448-A491 WeakPolarHBondContact CA-O 3.45Å; R448-F492 HydrophobicContact CB-CD1 3.89Å; R448-F492 HydrophobicContact CB-CE1 3.66Å; R448-F492 HydrophobicContact CB-CZ 4.36Å; R448-F492 HydrophobicContact CG-CD1 4.1Å; R448-F492 HydrophobicContact CG-CE1 3.61Å; R448-F492 HydrophobicContact CG-CE2 4.42Å; R448-F492 HydrophobicContact CG-CZ 3.79Å; R448-V520 WeakPolarHBondContact O-CA 3.3Å; R448-F521 PolarHBondContact N-O 3.36Å; R448-F521 PolarHBondContact O-N 3.24Å
449	L	93.3	Very high	80.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.2	167.7	-58.2	-175.8	0	0	0	109.3	I447 L452 I461 F464 D490 A491 I493 V518 E519 V520	I447-L449 HydrophobicContact CG2-CD2 4.17Å; L449-L452 HydrophobicContact CB-CD1 3.93Å; L449-L452 HydrophobicContact CB-CD2 4.17Å; L449-L452 HydrophobicContact CB-CG 4.04Å; L449-L452 HydrophobicContact CD1-CD1 4.3Å; L449-L452 HydrophobicContact CD1-CD2 4.08Å; L449-I461 HydrophobicContact CD1-CG1 4.49Å; L449-I461 HydrophobicContact CD1-CG2 3.77Å; L449-F464 HydrophobicContact CD2-CE1 4.41Å; L449-D490 CarbonylContact O-C 3.49Å; L449-D490 VanDerWaalsContact O-CA 3.27Å; L449-D490 WeakPolarHBondContact O-CA 3.5Å; L449-A491 HydrophobicContact CB-CB 4.42Å; L449-A491 PolarHBondContact N-O 2.94Å; L449-A491 PolarHBondContact O-N 2.91Å; L449-I493 HydrophobicContact CD1-CD1 3.51Å; L449-I493 HydrophobicContact CG-CD1 3.99Å; L449-V518 HydrophobicContact CB-CG1 4.11Å; L449-V518 HydrophobicContact CD2-CG1 4.1Å; L449-E519 WeakPolarHBondContact CA-O 3.46Å; L449-V520 HydrophobicContact CD2-CB 4.07Å; L449-V520 HydrophobicContact CD2-CG1 3.69Å; L449-V520 HydrophobicContact CD2-CG2 3.52Å
450	R	90.6	Very high	83.1	Confident	86 Å²	86	56.6 Å²	56.6	33%	0.325	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	139.7	176.3	-179.3	179.8	-170.3	-171.9	1.7	109.8	D490 V518 E519	R450-D490 WeakPolarHBondContact CG-OD1 3.42Å; R450-V518 WeakPolarHBondContact O-CA 3.36Å; R450-E519 HydrophobicContact CB-CB 4.32Å; R450-E519 PolarHBondContact N-O 2.9Å; R450-E519 PolarHBondContact O-N 2.8Å
451	G	85.9	Confident	85.4	Confident	20 Å²	20	51.1 Å²	51.1	21%	0.206	27%	0.268	C	S	.	.	S	Bend	trans	88.4	19.1	-180	0	0	0	0	0	113.9	G489 R516	G451-G489 PolarHBondContact N-O 2.9Å; G451-R516 VanDerWaalsContact O-CZ 3.28Å; G451-R516 PolarHBondContact O-NE 3.47Å; G451-R516 PolarHBondContact O-NH2 3.36Å
452	L	89.3	Confident	87.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.26	C	S	.	.			trans	-64.4	129.7	174.1	-66.3	175.5	0	0	0	111.2	L449 Y454 A456 I461 G489 A491 M513 R516 V518	L449-L452 HydrophobicContact CB-CD1 3.93Å; L449-L452 HydrophobicContact CB-CD2 4.17Å; L449-L452 HydrophobicContact CB-CG 4.04Å; L449-L452 HydrophobicContact CD1-CD1 4.3Å; L449-L452 HydrophobicContact CD1-CD2 4.08Å; L452-Y454 PolarHBondContact O-N 3.4Å; L452-A456 HydrophobicContact CB-CB 4.44Å; L452-I461 HydrophobicContact CD1-CD1 3.83Å; L452-I461 HydrophobicContact CD1-CG1 4.28Å; L452-I461 HydrophobicContact CD2-CG1 4.38Å; L452-G489 PolarHBondContact N-O 2.68Å; L452-G489 WeakPolarHBondContact O-CA 3.31Å; L452-A491 HydrophobicContact CD1-CB 3.44Å; L452-A491 VanDerWaalsContact CD1-CB 3.44Å; L452-M513 HydrophobicContact CD2-CE 3.56Å; L452-M513 HydrophobicContact CD2-SD 3.59Å; L452-M513 VanDerWaalsContact CD2-SD 3.59Å; L452-R516 PolarHBondContact O-NH2 2.82Å; L452-V518 HydrophobicContact CD2-CG1 3.92Å; L452-V518 HydrophobicContact CD2-CG2 4Å
453	P	87.6	Confident	88.5	Confident	19 Å²	19	50.2 Å²	50.2	12%	0.123	26%	0.26	C	S	.	.			trans	-46.5	141.2	175.8	-25.8	32.1	0	0	0	112	A455 A456 K514 R516	P453-A455 PolarHBondContact O-N 3.25Å; P453-A456 HydrophobicContact CB-CB 4.27Å; P453-A456 WeakPolarHBondContact O-CB 3.27Å; P453-A456 PolarHBondContact O-N 2.93Å; P453-K514 HydrophobicContact CG-CB 4.46Å; P453-R516 HydrophobicContact CG-CB 4.33Å; P453-R516 HydrophobicContact CG-CG 4.25Å
454	Y	83.3	Confident	89.1	Confident	153 Å²	153	48.8 Å²	48.8	60%	0.6	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.5	-175.9	-64.2	-58.9	0	0	0	114.1	L452 P487	L452-Y454 PolarHBondContact O-N 3.4Å; Y454-P487 WeakPolarHBondContact CD1-O 3.3Å
455	A	84.1	Confident	89.1	Confident	84 Å²	84	44.4 Å²	44.4	69%	0.694	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	8.7	173.9	0	0	0	0	0	113.5	P453	P453-A455 PolarHBondContact O-N 3.25Å
456	A	85.8	Confident	89.1	Confident	8 Å²	8	45.2 Å²	45.2	7%	0.066	24%	0.244	C	C	.	.			trans	-70.5	129.8	-179.3	0	0	0	0	0	111.2	L452 P453 D460 M513	L452-A456 HydrophobicContact CB-CB 4.44Å; P453-A456 HydrophobicContact CB-CB 4.27Å; P453-A456 WeakPolarHBondContact O-CB 3.27Å; P453-A456 PolarHBondContact O-N 2.93Å; A456-D460 WeakPolarHBondContact CA-OD2 3.34Å; A456-M513 HydrophobicContact CB-SD 4.19Å
457	T	88.2	Confident	88.9	Confident	63 Å²	63	50.7 Å²	50.7	39%	0.387	27%	0.27	S	S	.	.			trans	-95.9	175	176.5	73.2	0	0	0	0	111.7	E459 D460 I461	T457-E459 VanDerWaalsContact C-N 3.26Å; T457-E459 WeakPolarHBondContact CB-OE2 3.38Å; T457-E459 PolarHBondContact O-N 2.94Å; T457-E459 PolarHBondContact OG1-N 3.24Å; T457-E459 PolarHBondContact OG1-OE2 3.07Å; T457-D460 PolarHBondContact N-OD2 3.46Å; T457-D460 PolarHBondContact O-N 3.08Å; T457-D460 PolarHBondContact OG1-N 3.21Å; T457-I461 PolarHBondContact O-N 2.71Å
458	I	86.6	Confident	88.6	Confident	78 Å²	78	51.1 Å²	51.1	40%	0.4	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-37.9	175.9	-63.5	173.5	0	0	0	109.9	D460 I461 L462 V477	I458-D460 VanDerWaalsContact C-N 3.35Å; I458-D460 PolarHBondContact O-N 3.37Å; I458-I461 WeakPolarHBondContact O-CB 3.36Å; I458-I461 PolarHBondContact O-N 2.86Å; I458-I461 VanDerWaalsContact O-N 3.13Å; I458-L462 HydrophobicContact CG2-CD1 4.3Å; I458-L462 HydrophobicContact CG2-CG 4.45Å; I458-L462 WeakPolarHBondContact O-CG 3.37Å; I458-L462 PolarHBondContact O-N 2.95Å; I458-V477 HydrophobicContact CG2-CB 4.43Å; I458-V477 HydrophobicContact CG2-CG1 4.38Å
459	E	88.7	Confident	88.3	Confident	119 Å²	119	51 Å²	51	56%	0.556	28%	0.277	S	S	*	.	H	α-helix	trans	-59.7	-44.4	176.8	-60.7	73.3	-157.7	0	0	111.3	T457 I461 L462 D463	T457-E459 VanDerWaalsContact C-N 3.26Å; T457-E459 WeakPolarHBondContact CB-OE2 3.38Å; T457-E459 PolarHBondContact O-N 2.94Å; T457-E459 PolarHBondContact OG1-N 3.24Å; T457-E459 PolarHBondContact OG1-OE2 3.07Å; E459-I461 PolarHBondContact O-N 3.02Å; E459-L462 PolarHBondContact O-N 3.02Å; E459-L462 VanDerWaalsContact O-N 3.15Å; E459-D463 PolarHBondContact O-N 2.98Å
460	D	89.3	Confident	88	Confident	31 Å²	31	55.7 Å²	55.7	17%	0.166	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-35.3	176.4	-66.8	-47.2	0	0	0	112.5	A456 T457 I458 F464 M513 K514	A456-D460 WeakPolarHBondContact CA-OD2 3.34Å; T457-D460 PolarHBondContact N-OD2 3.46Å; T457-D460 PolarHBondContact O-N 3.08Å; T457-D460 PolarHBondContact OG1-N 3.21Å; I458-D460 VanDerWaalsContact C-N 3.35Å; I458-D460 PolarHBondContact O-N 3.37Å; D460-F464 VanDerWaalsContact O-CB 3.27Å; D460-F464 WeakPolarHBondContact O-CB 3.38Å; D460-F464 PolarHBondContact O-N 3.3Å; D460-M513 HydrophobicContact CB-SD 4.5Å; D460-K514 WeakPolarHBondContact OD1-CE 3.44Å; D460-K514 IonicContact OD1-NZ 2.86Å; D460-K514 PolarHBondContact OD1-NZ 2.92Å; D460-K514 IonicContact OD2-NZ 3.22Å; D460-K514 PolarHBondContact OD2-NZ 3.47Å
461	I	90.4	Very high	87.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-72.2	-40.1	179	-67.4	169.9	0	0	0	110.9	L449 L452 T457 I458 E459 F464 L465 V477 M479 A491 I493 M513	L449-I461 HydrophobicContact CD1-CG1 4.49Å; L449-I461 HydrophobicContact CD1-CG2 3.77Å; L452-I461 HydrophobicContact CD1-CD1 3.83Å; L452-I461 HydrophobicContact CD1-CG1 4.28Å; L452-I461 HydrophobicContact CD2-CG1 4.38Å; T457-I461 PolarHBondContact O-N 2.71Å; I458-I461 WeakPolarHBondContact O-CB 3.36Å; I458-I461 PolarHBondContact O-N 2.86Å; I458-I461 VanDerWaalsContact O-N 3.13Å; E459-I461 PolarHBondContact O-N 3.02Å; I461-F464 PolarHBondContact O-N 3.37Å; I461-L465 HydrophobicContact CG2-CD1 4.42Å; I461-L465 WeakPolarHBondContact O-CG 3.35Å; I461-L465 PolarHBondContact O-N 2.79Å; I461-V477 HydrophobicContact CD1-CG1 4.3Å; I461-M479 HydrophobicContact CD1-CE 4.24Å; I461-M479 HydrophobicContact CD1-SD 3.45Å; I461-M479 WeakPolarHBondContact CD1-SD 3.37Å; I461-A491 HydrophobicContact CD1-CB 4.24Å; I461-I493 HydrophobicContact CG2-CD1 3.5Å; I461-M513 HydrophobicContact CG1-CE 4.16Å
462	L	89.7	Confident	88	Confident	62 Å²	62	53.3 Å²	53.3	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-65.1	-44.6	176.5	-64.1	174.7	0	0	0	110.8	I458 E459 F464 L465 G466 I472	I458-L462 HydrophobicContact CG2-CD1 4.3Å; I458-L462 HydrophobicContact CG2-CG 4.45Å; I458-L462 WeakPolarHBondContact O-CG 3.37Å; I458-L462 PolarHBondContact O-N 2.95Å; E459-L462 PolarHBondContact O-N 3.02Å; E459-L462 VanDerWaalsContact O-N 3.15Å; L462-F464 VanDerWaalsContact C-N 3.34Å; L462-F464 PolarHBondContact O-N 2.91Å; L462-L465 PolarHBondContact O-N 3.36Å; L462-G466 PolarHBondContact O-N 3.43Å; L462-G466 VanDerWaalsContact O-N 3.09Å; L462-I472 HydrophobicContact CD2-CD1 3.61Å
463	D	90.1	Very high	87.8	Confident	129 Å²	129	58.2 Å²	58.2	69%	0.69	31%	0.313	S	S	*	.	H	α-helix	trans	-62.3	-40.8	175.6	-74.8	-13.2	0	0	0	111.6	E459 L465 G466	E459-D463 PolarHBondContact O-N 2.98Å; D463-L465 PolarHBondContact O-N 3.28Å; D463-G466 PolarHBondContact O-N 2.8Å
464	F	90.8	Very high	87.2	Confident	23 Å²	23	63.5 Å²	63.5	10%	0.101	35%	0.345	C	S	.	.	H	α-helix	trans	-64.7	-37.1	177	173.7	-99.4	0	0	0	113.2	L449 D460 I461 L462 G466 Y508 K511 M513 V518 V520	L449-F464 HydrophobicContact CD2-CE1 4.41Å; D460-F464 VanDerWaalsContact O-CB 3.27Å; D460-F464 WeakPolarHBondContact O-CB 3.38Å; D460-F464 PolarHBondContact O-N 3.3Å; I461-F464 PolarHBondContact O-N 3.37Å; L462-F464 VanDerWaalsContact C-N 3.34Å; L462-F464 PolarHBondContact O-N 2.91Å; F464-G466 VanDerWaalsContact C-N 3.34Å; F464-Y508 HydrophobicContact CE1-CD1 4.21Å; F464-Y508 HydrophobicContact CE1-CG 4.31Å; F464-Y508 HydrophobicContact CE2-CD1 4.43Å; F464-Y508 HydrophobicContact CZ-CD1 4.17Å; F464-Y508 HydrophobicContact CZ-CG 4.49Å; F464-Y508 WeakPolarHBondContact O-CD1 3.14Å; F464-Y508 WeakPolarHBondContact O-CE1 3.32Å; F464-K511 HydrophobicContact CE2-CB 3.76Å; F464-K511 HydrophobicContact CZ-CB 3.99Å; F464-M513 HydrophobicContact CB-CE 3.24Å; F464-M513 HydrophobicContact CD1-CE 3.83Å; F464-M513 HydrophobicContact CD2-CB 3.87Å; F464-M513 HydrophobicContact CD2-CE 3.97Å; F464-M513 HydrophobicContact CD2-CG 4.39Å; F464-M513 HydrophobicContact CE2-CB 4.16Å; F464-M513 HydrophobicContact CG-CE 3.42Å; F464-M513 VanDerWaalsContact CG-CE 3.42Å; F464-V518 HydrophobicContact CE1-CB 4.34Å; F464-V518 HydrophobicContact CE1-CG1 4.25Å; F464-V518 HydrophobicContact CE2-CB 4.37Å; F464-V518 HydrophobicContact CE2-CG2 4.41Å; F464-V518 HydrophobicContact CZ-CB 3.83Å; F464-V518 HydrophobicContact CZ-CG1 4.23Å; F464-V518 HydrophobicContact CZ-CG2 4.3Å; F464-V520 HydrophobicContact CE1-CG2 4.18Å; F464-V520 HydrophobicContact CZ-CG2 4.44Å
465	L	88.8	Confident	86.9	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-79.4	-16.9	177.9	-72	179.5	0	0	0	113.4	I461 L462 D463 E467 F468 I472 I493 Y508	I461-L465 HydrophobicContact CG2-CD1 4.42Å; I461-L465 WeakPolarHBondContact O-CG 3.35Å; I461-L465 PolarHBondContact O-N 2.79Å; L462-L465 PolarHBondContact O-N 3.36Å; D463-L465 PolarHBondContact O-N 3.28Å; L465-E467 PolarHBondContact O-N 3.43Å; L465-F468 PolarHBondContact O-N 3.29Å; L465-I472 HydrophobicContact CD1-CD1 3.85Å; L465-I493 HydrophobicContact CD1-CD1 3.44Å; L465-I493 VanDerWaalsContact CD1-CD1 3.44Å; L465-I493 HydrophobicContact CD1-CG2 4.41Å; L465-Y508 HydrophobicContact CD2-CD2 4.28Å; L465-Y508 HydrophobicContact CD2-CG 4.45Å; L465-Y508 WeakPolarHBondContact O-CE2 3.46Å; L465-Y508 VanDerWaalsContact O-CZ 3.3Å; L465-Y508 PolarHBondContact O-OH 3.05Å
466	G	88.6	Confident	86.8	Confident	31 Å²	31	60.9 Å²	60.9	32%	0.32	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	55.6	-123.8	174.6	0	0	0	0	0	111.9	L462 D463 F464 F468 S469	L462-G466 PolarHBondContact O-N 3.43Å; L462-G466 VanDerWaalsContact O-N 3.09Å; D463-G466 PolarHBondContact O-N 2.8Å; F464-G466 VanDerWaalsContact C-N 3.34Å; G466-F468 PolarHBondContact O-N 3.23Å; G466-F468 VanDerWaalsContact O-N 3.08Å; G466-S469 VanDerWaalsContact O-CB 3.26Å; G466-S469 WeakPolarHBondContact O-CB 3.49Å; G466-S469 PolarHBondContact O-N 3.35Å; G466-S469 PolarHBondContact O-OG 2.86Å
467	E	87.7	Confident	87	Confident	116 Å²	116	61.8 Å²	61.8	54%	0.542	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-55.3	-28.2	-178.9	68.1	-169.4	171.5	0	0	114.4	L465 S469 T470 K507	L465-E467 PolarHBondContact O-N 3.43Å; E467-S469 VanDerWaalsContact C-N 3.28Å; E467-S469 PolarHBondContact O-N 3.44Å; E467-T470 PolarHBondContact O-OG1 3.26Å; E467-K507 IonicContact OE1-NZ 2.67Å; E467-K507 PolarHBondContact OE1-NZ 2.86Å
468	F	88.8	Confident	86.9	Confident	9 Å²	9	61.7 Å²	61.7	4%	0.039	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-78.3	-10.8	180	-63.9	-92	0	0	0	113.1	L465 G466 T470 D471 M495 M503 A504 K507 Y508	L465-F468 PolarHBondContact O-N 3.29Å; G466-F468 PolarHBondContact O-N 3.23Å; G466-F468 VanDerWaalsContact O-N 3.08Å; F468-T470 PolarHBondContact O-N 3.24Å; F468-D471 PolarHBondContact O-N 2.99Å; F468-D471 VanDerWaalsContact O-N 3.17Å; F468-M495 HydrophobicContact CB-CE 4.18Å; F468-M495 WeakPolarHBondContact O-CE 3.37Å; F468-M503 HydrophobicContact CE1-CB 3.69Å; F468-M503 HydrophobicContact CZ-CB 4.04Å; F468-A504 HydrophobicContact CB-CB 3.96Å; F468-A504 HydrophobicContact CD1-CB 3.6Å; F468-A504 HydrophobicContact CD2-CB 4.24Å; F468-A504 HydrophobicContact CE1-CB 4.11Å; F468-A504 HydrophobicContact CG-CB 3.65Å; F468-K507 HydrophobicContact CE2-CD 3.63Å; F468-K507 HydrophobicContact CZ-CD 4.15Å; F468-Y508 HydrophobicContact CD2-CD2 4.43Å; F468-Y508 AromaticContact CD2-CE2 3.54Å; F468-Y508 HydrophobicContact CD2-CE2 3.54Å; F468-Y508 AromaticContact CE2-CE2 3.85Å; F468-Y508 HydrophobicContact CE2-CE2 3.85Å
469	S	87.3	Confident	86.9	Confident	38 Å²	38	60.3 Å²	60.3	27%	0.266	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-62.2	-31.1	175.5	63.1	0	0	0	0	112.6	G466 E467 D471 I472	G466-S469 VanDerWaalsContact O-CB 3.26Å; G466-S469 WeakPolarHBondContact O-CB 3.49Å; G466-S469 PolarHBondContact O-N 3.35Å; G466-S469 PolarHBondContact O-OG 2.86Å; E467-S469 VanDerWaalsContact C-N 3.28Å; E467-S469 PolarHBondContact O-N 3.44Å; S469-D471 PolarHBondContact O-N 2.93Å; S469-I472 WeakPolarHBondContact O-CB 3.34Å; S469-I472 WeakPolarHBondContact O-CG1 3.14Å; S469-I472 PolarHBondContact O-N 3.47Å
470	T	85.8	Confident	86.6	Confident	99 Å²	99	55.7 Å²	55.7	61%	0.607	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-68.1	-21.8	178	62.1	0	0	0	0	113.2	E467 F468 K496	E467-T470 PolarHBondContact O-OG1 3.26Å; F468-T470 PolarHBondContact O-N 3.24Å; T470-K496 PolarHBondContact O-NZ 2.95Å
471	D	88	Confident	86.2	Confident	41 Å²	41	58.9 Å²	58.9	22%	0.219	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-90.9	3.1	178.9	-69.2	-55.2	0	0	0	113.3	F468 S469 M495 K496 R500	F468-D471 PolarHBondContact O-N 2.99Å; F468-D471 VanDerWaalsContact O-N 3.17Å; S469-D471 PolarHBondContact O-N 2.93Å; D471-M495 HydrophobicContact CB-CE 3.74Å; D471-M495 CarbonylContact O-C 3.54Å; D471-M495 WeakPolarHBondContact O-CA 3.31Å; D471-K496 WeakPolarHBondContact O-CB 3.26Å; D471-K496 VanDerWaalsContact O-CG 3.3Å; D471-K496 WeakPolarHBondContact O-CG 3.27Å; D471-K496 PolarHBondContact O-N 2.79Å; D471-R500 HydrophobicContact CB-CB 4.23Å; D471-R500 HydrophobicContact CB-CG 4.27Å; D471-R500 VanDerWaalsContact OD2-CD 3.3Å; D471-R500 WeakPolarHBondContact OD2-CD 3.49Å
472	I	89.4	Confident	85.5	Confident	15 Å²	15	63.1 Å²	63.1	8%	0.077	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	140.7	175.6	-57.4	172.9	0	0	0	109.3	L462 L465 S469 V477 I493 M495 K496	L462-I472 HydrophobicContact CD2-CD1 3.61Å; L465-I472 HydrophobicContact CD1-CD1 3.85Å; S469-I472 WeakPolarHBondContact O-CB 3.34Å; S469-I472 WeakPolarHBondContact O-CG1 3.14Å; S469-I472 PolarHBondContact O-N 3.47Å; I472-V477 HydrophobicContact CD1-CG2 4.39Å; I472-V477 HydrophobicContact CG2-CG2 4.08Å; I472-I493 HydrophobicContact CB-CG2 4.42Å; I472-I493 HydrophobicContact CD1-CG2 3.77Å; I472-I493 HydrophobicContact CG1-CG2 3.72Å; I472-I493 HydrophobicContact CG2-CG2 3.85Å; I472-M495 HydrophobicContact CG1-SD 3.84Å; I472-K496 VanDerWaalsContact O-CE 3.26Å; I472-K496 WeakPolarHBondContact O-CE 3.14Å
473	R	85.5	Confident	84.7	Confident	105 Å²	105	69.4 Å²	69.4	40%	0.396	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	152.2	172.9	-64.5	-161.6	-170.3	-158.6	5.7	110.7	D445 H475 G476 Q494 M495 K496	D445-R473 IonicContact OD2-NH2 3.35Å; D445-R473 PolarHBondContact OD2-NH2 2.72Å; R473-H475 PolarHBondContact O-N 2.82Å; R473-G476 WeakPolarHBondContact O-CA 3.45Å; R473-G476 PolarHBondContact O-N 3.29Å; R473-Q494 HydrophobicContact CG-CG 4.19Å; R473-Q494 PolarHBondContact N-O 2.85Å; R473-M495 PolarHBondContact NE-O 2.92Å; R473-K496 HydrophobicContact CG-CG 4.02Å
474	T	75.3	Confident	83.7	Confident	130 Å²	130	70.5 Å²	70.5	80%	0.798	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.7	126.2	173.1	48.9	0	0	0	0	109.9	G476	T474-G476 PolarHBondContact O-N 3.38Å
475	H	76.8	Confident	82.7	Confident	180 Å²	180	71.7 Å²	71.7	83%	0.833	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	60.7	20.4	-172.4	-50.6	-67.3	0	0	0	115.5	R473 V477 H478	R473-H475 PolarHBondContact O-N 2.82Å; H475-V477 VanDerWaalsContact C-N 3.26Å; H475-V477 PolarHBondContact O-N 3.49Å; H475-H478 PolarHBondContact O-NE2 2.97Å
476	G	82.1	Confident	82.1	Confident	2 Å²	2	80 Å²	80	2%	0.021	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	8.3	-175.9	0	0	0	0	0	115.7	R473 T474 H478 I493 Q494	R473-G476 WeakPolarHBondContact O-CA 3.45Å; R473-G476 PolarHBondContact O-N 3.29Å; T474-G476 PolarHBondContact O-N 3.38Å; G476-H478 VanDerWaalsContact C-CD2 3.48Å; G476-H478 PolarHBondContact O-CD2 3.41Å; G476-I493 CarbonylContact O-C 3.5Å; G476-I493 VanDerWaalsContact O-CA 3.26Å; G476-I493 WeakPolarHBondContact O-CA 3.27Å; G476-Q494 PolarHBondContact O-N 3.19Å
477	V	88.1	Confident	81.8	Confident	26 Å²	26	80.8 Å²	80.8	16%	0.158	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.6	177.5	-177.7	0	0	0	0	109.4	I458 I461 I472 H475 I493	I458-V477 HydrophobicContact CG2-CB 4.43Å; I458-V477 HydrophobicContact CG2-CG1 4.38Å; I461-V477 HydrophobicContact CD1-CG1 4.3Å; I472-V477 HydrophobicContact CD1-CG2 4.39Å; I472-V477 HydrophobicContact CG2-CG2 4.08Å; H475-V477 VanDerWaalsContact C-N 3.26Å; H475-V477 PolarHBondContact O-N 3.49Å; V477-I493 HydrophobicContact CG1-CG1 4.48Å; V477-I493 HydrophobicContact CG2-CG1 4.45Å; V477-I493 HydrophobicContact CG2-CG2 4.5Å
478	H	87.6	Confident	81.5	Confident	61 Å²	61	77.7 Å²	77.7	28%	0.282	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	107.5	-174.3	-58	-101.9	0	0	0	110	H475 G476 A491 F492 M528 L532	H475-H478 PolarHBondContact O-NE2 2.97Å; G476-H478 VanDerWaalsContact C-CD2 3.48Å; G476-H478 PolarHBondContact O-CD2 3.41Å; H478-A491 CarbonylContact O-C 3.52Å; H478-A491 VanDerWaalsContact O-CA 3.31Å; H478-A491 WeakPolarHBondContact O-CA 3.46Å; H478-F492 HydrophobicContact CB-CB 4.4Å; H478-F492 PolarHBondContact N-O 3.13Å; H478-F492 PolarHBondContact O-N 3.43Å; H478-M528 HydrophobicContact CB-CE 3.96Å; H478-M528 WeakPolarHBondContact CD2-CE 3.19Å; H478-M528 VanDerWaalsContact NE2-CE 3.26Å; H478-M528 WeakPolarHBondContact NE2-CE 3.47Å; H478-L532 HydrophobicContact CB-CD1 4.04Å; H478-L532 HydrophobicContact CB-CD2 4.18Å
479	M	86.6	Confident	81.2	Confident	50 Å²	50	77.4 Å²	77.4	25%	0.246	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	129.5	176.6	-63.7	-61.5	-73.5	0	0	110	I461 L481 A491	I461-M479 HydrophobicContact CD1-CE 4.24Å; I461-M479 HydrophobicContact CD1-SD 3.45Å; I461-M479 WeakPolarHBondContact CD1-SD 3.37Å; M479-L481 PolarHBondContact O-N 2.9Å; M479-A491 HydrophobicContact SD-CB 3.73Å
480	V	82.6	Confident	81.3	Confident	21 Å²	21	76.6 Å²	76.6	13%	0.127	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.8	175.4	-175.4	0	0	0	0	108.7	S488 D490 F492 L532	V480-S488 WeakPolarHBondContact O-CB 3.34Å; V480-S488 PolarHBondContact O-N 3.29Å; V480-D490 HydrophobicContact CB-CB 4.04Å; V480-D490 WeakPolarHBondContact CB-O 3.26Å; V480-D490 HydrophobicContact CG2-CB 3.97Å; V480-D490 WeakPolarHBondContact CG2-O 2.95Å; V480-D490 PolarHBondContact N-O 3.49Å; V480-F492 HydrophobicContact CG2-CD2 3.75Å; V480-F492 HydrophobicContact CG2-CE2 3.69Å; V480-L532 HydrophobicContact CG2-CD2 4.4Å
481	L	80.8	Confident	81.6	Confident	99 Å²	99	71.9 Å²	71.9	52%	0.518	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.9	175.8	-56.9	179.5	0	0	0	110	M479 R486 P487	M479-L481 PolarHBondContact O-N 2.9Å; L481-R486 CarbonylContact C-O 3.55Å; L481-R486 WeakPolarHBondContact CA-O 3.17Å; L481-P487 HydrophobicContact CD2-CG 4.35Å
482	N	75.4	Confident	81.8	Confident	89 Å²	89	70 Å²	70	48%	0.476	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-74.6	170.1	171.7	-161.4	0.2	0	0	0	110.2	Q484 G485 R486	N482-Q484 PolarHBondContact O-N 3.24Å; N482-G485 PolarHBondContact O-N 2.91Å; N482-R486 PolarHBondContact N-O 3.19Å
483	H	72.1	Confident	82	Confident	193 Å²	193	69.2 Å²	69.2	89%	0.894	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.5	-177.8	-59.6	173.7	0	0	0	114.5
484	Q	70.6	Confident	82.3	Confident	152 Å²	152	66.3 Å²	66.3	71%	0.71	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	9.3	174.1	-63	179.7	-9	0	0	113.3	N482 R486	N482-Q484 PolarHBondContact O-N 3.24Å; Q484-R486 VanDerWaalsContact C-N 3.28Å; Q484-R486 PolarHBondContact O-N 3.05Å
485	G	69.1	Low	83	Confident	49 Å²	49	60.1 Å²	60.1	51%	0.505	31%	0.307	S	S	.	.	S	Bend	trans	74.8	8.8	-178.7	0	0	0	0	0	115.4	N482	N482-G485 PolarHBondContact O-N 2.91Å
486	R	76.4	Confident	83.5	Confident	174 Å²	174	57.4 Å²	57.4	66%	0.657	29%	0.292	S	S	*	.	S	Bend	trans	-93.7	147.1	-179.5	-63.7	-176.1	-178.5	-175.1	0.6	111.9	L481 N482 Q484 S488	L481-R486 CarbonylContact C-O 3.55Å; L481-R486 WeakPolarHBondContact CA-O 3.17Å; N482-R486 PolarHBondContact N-O 3.19Å; Q484-R486 VanDerWaalsContact C-N 3.28Å; Q484-R486 PolarHBondContact O-N 3.05Å; R486-S488 PolarHBondContact O-N 2.72Å
487	P	81.3	Confident	83.8	Confident	48 Å²	48	59.2 Å²	59.2	31%	0.312	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	126.8	176.5	-23.7	33.4	0	0	0	111.8	Y454 L481 G489	Y454-P487 WeakPolarHBondContact CD1-O 3.3Å; L481-P487 HydrophobicContact CD2-CG 4.35Å; P487-G489 PolarHBondContact O-N 3.47Å
488	S	81.6	Confident	83.8	Confident	50 Å²	50	60.2 Å²	60.2	35%	0.35	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-9.9	-180	-171.8	0	0	0	0	112.8	V480 R486 D490	V480-S488 WeakPolarHBondContact O-CB 3.34Å; V480-S488 PolarHBondContact O-N 3.29Å; R486-S488 PolarHBondContact O-N 2.72Å; S488-D490 VanDerWaalsContact C-N 3.32Å
489	G	83.3	Confident	83.9	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.7	11.1	-170.2	0	0	0	0	0	113.9	G451 L452 P487	G451-G489 PolarHBondContact N-O 2.9Å; L452-G489 PolarHBondContact N-O 2.68Å; L452-G489 WeakPolarHBondContact O-CA 3.31Å; P487-G489 PolarHBondContact O-N 3.47Å
490	D	88.8	Confident	84.1	Confident	22 Å²	22	65 Å²	65	12%	0.118	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.3	174.3	-77	17.5	0	0	0	109.5	R448 L449 R450 V480 S488	R448-D490 IonicContact CZ-OD2 2.85Å; R448-D490 IonicContact NE-OD2 2.58Å; R448-D490 IonicContact NH2-OD2 2.73Å; R448-D490 PolarHBondContact NH2-OD2 3.05Å; L449-D490 CarbonylContact O-C 3.49Å; L449-D490 VanDerWaalsContact O-CA 3.27Å; L449-D490 WeakPolarHBondContact O-CA 3.5Å; R450-D490 WeakPolarHBondContact CG-OD1 3.42Å; V480-D490 HydrophobicContact CB-CB 4.04Å; V480-D490 WeakPolarHBondContact CB-O 3.26Å; V480-D490 HydrophobicContact CG2-CB 3.97Å; V480-D490 WeakPolarHBondContact CG2-O 2.95Å; V480-D490 PolarHBondContact N-O 3.49Å; S488-D490 VanDerWaalsContact C-N 3.32Å
491	A	91.6	Very high	84.5	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154.4	172.8	0	0	0	0	0	111.3	R448 L449 L452 I461 H478 M479	R448-A491 CarbonylContact C-O 3.53Å; R448-A491 WeakPolarHBondContact CA-O 3.45Å; L449-A491 HydrophobicContact CB-CB 4.42Å; L449-A491 PolarHBondContact N-O 2.94Å; L449-A491 PolarHBondContact O-N 2.91Å; L452-A491 HydrophobicContact CD1-CB 3.44Å; L452-A491 VanDerWaalsContact CD1-CB 3.44Å; I461-A491 HydrophobicContact CD1-CB 4.24Å; H478-A491 CarbonylContact O-C 3.52Å; H478-A491 VanDerWaalsContact O-CA 3.31Å; H478-A491 WeakPolarHBondContact O-CA 3.46Å; M479-A491 HydrophobicContact SD-CB 3.73Å
492	F	93.1	Very high	85	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141	173.7	-69.1	-90.7	0	0	0	110.8	I447 R448 H478 V480 M528 V531	I447-F492 CarbonylContact O-C 3.5Å; I447-F492 WeakPolarHBondContact O-CA 3.43Å; R448-F492 HydrophobicContact CB-CD1 3.89Å; R448-F492 HydrophobicContact CB-CE1 3.66Å; R448-F492 HydrophobicContact CB-CZ 4.36Å; R448-F492 HydrophobicContact CG-CD1 4.1Å; R448-F492 HydrophobicContact CG-CE1 3.61Å; R448-F492 HydrophobicContact CG-CE2 4.42Å; R448-F492 HydrophobicContact CG-CZ 3.79Å; H478-F492 HydrophobicContact CB-CB 4.4Å; H478-F492 PolarHBondContact N-O 3.13Å; H478-F492 PolarHBondContact O-N 3.43Å; V480-F492 HydrophobicContact CG2-CD2 3.75Å; V480-F492 HydrophobicContact CG2-CE2 3.69Å; F492-M528 HydrophobicContact CB-CB 4.31Å; F492-M528 HydrophobicContact CB-CE 4.11Å; F492-M528 HydrophobicContact CB-CG 3.58Å; F492-M528 HydrophobicContact CB-SD 3.79Å; F492-M528 HydrophobicContact CD1-CB 3.66Å; F492-M528 HydrophobicContact CD1-CG 3.86Å; F492-M528 HydrophobicContact CD2-CG 4.46Å; F492-M528 HydrophobicContact CE1-CB 4.17Å; F492-M528 HydrophobicContact CG-CB 4.07Å; F492-M528 HydrophobicContact CG-CG 3.73Å; F492-V531 HydrophobicContact CE2-CB 3.75Å; F492-V531 HydrophobicContact CE2-CG1 3.59Å; F492-V531 HydrophobicContact CE2-CG2 4.39Å; F492-V531 HydrophobicContact CZ-CB 3.67Å; F492-V531 HydrophobicContact CZ-CG1 3.85Å; F492-V531 HydrophobicContact CZ-CG2 3.83Å
493	I	93.6	Very high	85.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	120.3	-175	-56.6	178.5	0	0	0	108.9	C446 I447 L449 I461 L465 I472 G476 V477 M495	C446-I493 CarbonylContact C-O 3.49Å; C446-I493 VanDerWaalsContact CA-O 3.24Å; C446-I493 WeakPolarHBondContact CA-O 3.44Å; I447-I493 PolarHBondContact N-O 3.27Å; I447-I493 PolarHBondContact O-N 3.47Å; L449-I493 HydrophobicContact CD1-CD1 3.51Å; L449-I493 HydrophobicContact CG-CD1 3.99Å; I461-I493 HydrophobicContact CG2-CD1 3.5Å; L465-I493 HydrophobicContact CD1-CD1 3.44Å; L465-I493 VanDerWaalsContact CD1-CD1 3.44Å; L465-I493 HydrophobicContact CD1-CG2 4.41Å; I472-I493 HydrophobicContact CB-CG2 4.42Å; I472-I493 HydrophobicContact CD1-CG2 3.77Å; I472-I493 HydrophobicContact CG1-CG2 3.72Å; I472-I493 HydrophobicContact CG2-CG2 3.85Å; G476-I493 CarbonylContact O-C 3.5Å; G476-I493 VanDerWaalsContact O-CA 3.26Å; G476-I493 WeakPolarHBondContact O-CA 3.27Å; V477-I493 HydrophobicContact CG1-CG1 4.48Å; V477-I493 HydrophobicContact CG2-CG1 4.45Å; V477-I493 HydrophobicContact CG2-CG2 4.5Å; I493-M495 HydrophobicContact CG2-SD 3.87Å
494	Q	90.8	Very high	86.5	Confident	43 Å²	43	54.1 Å²	54.1	20%	0.201	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	115.2	176	-169.4	173.9	45.3	0	0	110.1	R473 G476	R473-Q494 HydrophobicContact CG-CG 4.19Å; R473-Q494 PolarHBondContact N-O 2.85Å; G476-Q494 PolarHBondContact O-N 3.19Å
495	M	90.2	Very high	87.5	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	163	178.3	-52.5	-67.4	-71.3	0	0	110.4	D445 I447 F468 D471 I472 R473 I493 S497 R500 A501	D445-M495 WeakPolarHBondContact O-CA 3.34Å; D445-M495 WeakPolarHBondContact O-CB 3.45Å; D445-M495 PolarHBondContact O-N 3.14Å; I447-M495 HydrophobicContact CD1-CE 4.47Å; I447-M495 HydrophobicContact CD1-CG 3.85Å; I447-M495 HydrophobicContact CD1-SD 3.97Å; I447-M495 HydrophobicContact CG1-CG 4.29Å; F468-M495 HydrophobicContact CB-CE 4.18Å; F468-M495 WeakPolarHBondContact O-CE 3.37Å; D471-M495 HydrophobicContact CB-CE 3.74Å; D471-M495 CarbonylContact O-C 3.54Å; D471-M495 WeakPolarHBondContact O-CA 3.31Å; I472-M495 HydrophobicContact CG1-SD 3.84Å; R473-M495 PolarHBondContact NE-O 2.92Å; I493-M495 HydrophobicContact CG2-SD 3.87Å; M495-S497 VanDerWaalsContact C-N 3.31Å; M495-R500 HydrophobicContact CE-CB 4.13Å; M495-A501 HydrophobicContact CB-CB 4.16Å; M495-A501 HydrophobicContact CG-CB 3.87Å
496	K	87.6	Confident	88.5	Confident	123 Å²	123	50.9 Å²	50.9	54%	0.535	25%	0.246	S	C	.	.	S	Bend	trans	-77.4	-17.9	174.1	-70.1	170	-174.5	162.2	0	112.6	T470 D471 I472 R473	T470-K496 PolarHBondContact O-NZ 2.95Å; D471-K496 WeakPolarHBondContact O-CB 3.26Å; D471-K496 VanDerWaalsContact O-CG 3.3Å; D471-K496 WeakPolarHBondContact O-CG 3.27Å; D471-K496 PolarHBondContact O-N 2.79Å; I472-K496 VanDerWaalsContact O-CE 3.26Å; I472-K496 WeakPolarHBondContact O-CE 3.14Å; R473-K496 HydrophobicContact CG-CG 4.02Å
497	S	87.9	Confident	89.1	Confident	40 Å²	40	47.2 Å²	47.2	28%	0.28	24%	0.235	S	C	.	.			trans	-148.5	143.5	-175.1	166.9	0	0	0	0	112	M495 D499 R500 A501	M495-S497 VanDerWaalsContact C-N 3.31Å; S497-D499 VanDerWaalsContact C-N 3.32Å; S497-D499 PolarHBondContact O-N 2.91Å; S497-D499 PolarHBondContact OG-N 3.07Å; S497-R500 PolarHBondContact O-N 2.87Å; S497-A501 PolarHBondContact O-N 2.79Å
498	T	89.6	Confident	89.5	Confident	47 Å²	47	46.1 Å²	46.1	29%	0.288	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-39.2	173.9	48.6	0	0	0	0	113	V443 D445 R500 A501 F502 Q522	V443-T498 HydrophobicContact CB-CG2 4.4Å; V443-T498 HydrophobicContact CG1-CG2 3.24Å; D445-T498 HydrophobicContact CB-CG2 4Å; T498-R500 VanDerWaalsContact C-N 3.33Å; T498-A501 WeakPolarHBondContact O-CB 3.43Å; T498-A501 PolarHBondContact O-N 2.79Å; T498-F502 PolarHBondContact O-N 2.79Å; T498-Q522 PolarHBondContact O-NE2 3.4Å
499	D	89.4	Confident	89.9	Confident	107 Å²	107	46.7 Å²	46.7	57%	0.572	22%	0.222	S	C	*	.	H	α-helix	trans	-69.4	-38.5	-177.1	-62.6	-23.2	0	0	0	110.2	S497 F502 M503	S497-D499 VanDerWaalsContact C-N 3.32Å; S497-D499 PolarHBondContact O-N 2.91Å; S497-D499 PolarHBondContact OG-N 3.07Å; D499-F502 PolarHBondContact O-N 2.79Å; D499-M503 HydrophobicContact CB-CE 4.27Å; D499-M503 WeakPolarHBondContact O-CB 3.45Å; D499-M503 VanDerWaalsContact O-CE 3.31Å; D499-M503 WeakPolarHBondContact O-CE 3.32Å; D499-M503 WeakPolarHBondContact O-CG 3.46Å; D499-M503 PolarHBondContact O-N 3.25Å
500	R	90.8	Very high	90.1	Very high	106 Å²	106	53 Å²	53	40%	0.4	25%	0.248	S	C	.	.	H	α-helix	trans	-66.1	-40.6	173.8	-60.1	-67.2	131.4	172.4	1.3	110.8	D471 M495 S497 T498 M503 A504	D471-R500 HydrophobicContact CB-CB 4.23Å; D471-R500 HydrophobicContact CB-CG 4.27Å; D471-R500 VanDerWaalsContact OD2-CD 3.3Å; D471-R500 WeakPolarHBondContact OD2-CD 3.49Å; M495-R500 HydrophobicContact CE-CB 4.13Å; S497-R500 PolarHBondContact O-N 2.87Å; T498-R500 VanDerWaalsContact C-N 3.33Å; R500-M503 VanDerWaalsContact NE-CE 3.32Å; R500-M503 PolarHBondContact O-N 2.86Å; R500-A504 WeakPolarHBondContact O-CB 3.46Å; R500-A504 PolarHBondContact O-N 3.3Å
501	A	90.6	Very high	90	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-46.2	175.2	0	0	0	0	0	112.3	I447 M495 S497 T498 A505 Q522	I447-A501 HydrophobicContact CD1-CB 4.37Å; I447-A501 WeakPolarHBondContact CD1-O 3.48Å; I447-A501 HydrophobicContact CG1-CB 4.03Å; M495-A501 HydrophobicContact CB-CB 4.16Å; M495-A501 HydrophobicContact CG-CB 3.87Å; S497-A501 PolarHBondContact O-N 2.79Å; T498-A501 WeakPolarHBondContact O-CB 3.43Å; T498-A501 PolarHBondContact O-N 2.79Å; A501-A505 VanDerWaalsContact O-CB 3.31Å; A501-A505 WeakPolarHBondContact O-CB 3.14Å; A501-A505 PolarHBondContact O-N 3.13Å; A501-Q522 HydrophobicContact CB-CG 4.37Å
502	F	91.6	Very high	89.7	Confident	103 Å²	103	61 Å²	61	45%	0.452	29%	0.291	S	S	.	.	H	α-helix	trans	-63.7	-48.2	176.8	179.3	-102.8	0	0	0	112.3	T498 D499 A504 A505 Q506	T498-F502 PolarHBondContact O-N 2.79Å; D499-F502 PolarHBondContact O-N 2.79Å; F502-A504 PolarHBondContact O-N 3.36Å; F502-A505 PolarHBondContact O-N 3.45Å; F502-Q506 HydrophobicContact CD1-CG 4.47Å; F502-Q506 HydrophobicContact CD2-CG 4.49Å; F502-Q506 HydrophobicContact CE1-CG 4.07Å; F502-Q506 HydrophobicContact CE2-CG 4.1Å; F502-Q506 HydrophobicContact CZ-CG 3.87Å; F502-Q506 WeakPolarHBondContact O-CG 3.34Å; F502-Q506 PolarHBondContact O-N 3.21Å
503	M	89.2	Confident	89.3	Confident	69 Å²	69	61.4 Å²	61.4	34%	0.34	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-42.2	-179.5	-77.6	-173.8	-75.1	0	0	112.6	F468 D499 R500 A505 Q506 K507	F468-M503 HydrophobicContact CE1-CB 3.69Å; F468-M503 HydrophobicContact CZ-CB 4.04Å; D499-M503 HydrophobicContact CB-CE 4.27Å; D499-M503 WeakPolarHBondContact O-CB 3.45Å; D499-M503 VanDerWaalsContact O-CE 3.31Å; D499-M503 WeakPolarHBondContact O-CE 3.32Å; D499-M503 WeakPolarHBondContact O-CG 3.46Å; D499-M503 PolarHBondContact O-N 3.25Å; R500-M503 VanDerWaalsContact NE-CE 3.32Å; R500-M503 PolarHBondContact O-N 2.86Å; M503-A505 VanDerWaalsContact C-N 3.35Å; M503-Q506 PolarHBondContact O-N 3.31Å; M503-K507 VanDerWaalsContact O-CB 3.23Å; M503-K507 WeakPolarHBondContact O-CB 3.48Å; M503-K507 PolarHBondContact O-N 3.02Å
504	A	90.2	Very high	88.8	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-69	-36.9	177.6	0	0	0	0	0	111.1	I447 F468 R500 F502 K507 Y508	I447-A504 HydrophobicContact CD1-CB 3.67Å; F468-A504 HydrophobicContact CB-CB 3.96Å; F468-A504 HydrophobicContact CD1-CB 3.6Å; F468-A504 HydrophobicContact CD2-CB 4.24Å; F468-A504 HydrophobicContact CE1-CB 4.11Å; F468-A504 HydrophobicContact CG-CB 3.65Å; R500-A504 WeakPolarHBondContact O-CB 3.46Å; R500-A504 PolarHBondContact O-N 3.3Å; F502-A504 PolarHBondContact O-N 3.36Å; A504-K507 PolarHBondContact O-N 2.6Å; A504-Y508 HydrophobicContact CB-CD2 4.46Å; A504-Y508 WeakPolarHBondContact O-CB 3.43Å; A504-Y508 WeakPolarHBondContact O-CD2 3.31Å; A504-Y508 PolarHBondContact O-N 3.47Å
505	A	91.6	Very high	88.3	Confident	2 Å²	2	73.5 Å²	73.5	2%	0.017	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-48.6	173.2	0	0	0	0	0	112	A501 F502 M503 H509 V520 Q522	A501-A505 VanDerWaalsContact O-CB 3.31Å; A501-A505 WeakPolarHBondContact O-CB 3.14Å; A501-A505 PolarHBondContact O-N 3.13Å; F502-A505 PolarHBondContact O-N 3.45Å; M503-A505 VanDerWaalsContact C-N 3.35Å; A505-H509 WeakPolarHBondContact O-CB 3.24Å; A505-H509 PolarHBondContact O-N 3.23Å; A505-H509 VanDerWaalsContact O-N 3.14Å; A505-V520 HydrophobicContact CB-CG1 4.16Å; A505-Q522 HydrophobicContact CB-CB 4.2Å
506	Q	89.6	Confident	87.9	Confident	132 Å²	132	77.1 Å²	77.1	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-67.3	-40.8	178.2	-65.1	-59	-43.2	0	0	112.8	F502 M503	F502-Q506 HydrophobicContact CD1-CG 4.47Å; F502-Q506 HydrophobicContact CD2-CG 4.49Å; F502-Q506 HydrophobicContact CE1-CG 4.07Å; F502-Q506 HydrophobicContact CE2-CG 4.1Å; F502-Q506 HydrophobicContact CZ-CG 3.87Å; F502-Q506 WeakPolarHBondContact O-CG 3.34Å; F502-Q506 PolarHBondContact O-N 3.21Å; M503-Q506 PolarHBondContact O-N 3.31Å
507	K	88.9	Confident	88	Confident	97 Å²	97	78.5 Å²	78.5	42%	0.422	37%	0.37	S	S	.	.	H	α-helix	trans	-74.9	-29.3	-174.3	-169	179.9	-175.3	170.3	0	113.7	E467 F468 M503 A504 K511	E467-K507 IonicContact OE1-NZ 2.67Å; E467-K507 PolarHBondContact OE1-NZ 2.86Å; F468-K507 HydrophobicContact CE2-CD 3.63Å; F468-K507 HydrophobicContact CZ-CD 4.15Å; M503-K507 VanDerWaalsContact O-CB 3.23Å; M503-K507 WeakPolarHBondContact O-CB 3.48Å; M503-K507 PolarHBondContact O-N 3.02Å; A504-K507 PolarHBondContact O-N 2.6Å; K507-K511 WeakPolarHBondContact O-CE 3.4Å; K507-K511 PolarHBondContact O-NZ 2.91Å
508	Y	89.3	Confident	88.1	Confident	24 Å²	24	76.6 Å²	76.6	9%	0.094	36%	0.356	C	S	.	.	H	α-helix	trans	-110.8	-3.8	-174.9	-68.2	-83.9	0	0	0	114.4	F464 L465 F468 A504 K510 K511 V520	F464-Y508 HydrophobicContact CE1-CD1 4.21Å; F464-Y508 HydrophobicContact CE1-CG 4.31Å; F464-Y508 HydrophobicContact CE2-CD1 4.43Å; F464-Y508 HydrophobicContact CZ-CD1 4.17Å; F464-Y508 HydrophobicContact CZ-CG 4.49Å; F464-Y508 WeakPolarHBondContact O-CD1 3.14Å; F464-Y508 WeakPolarHBondContact O-CE1 3.32Å; L465-Y508 HydrophobicContact CD2-CD2 4.28Å; L465-Y508 HydrophobicContact CD2-CG 4.45Å; L465-Y508 WeakPolarHBondContact O-CE2 3.46Å; L465-Y508 VanDerWaalsContact O-CZ 3.3Å; L465-Y508 PolarHBondContact O-OH 3.05Å; F468-Y508 HydrophobicContact CD2-CD2 4.43Å; F468-Y508 AromaticContact CD2-CE2 3.54Å; F468-Y508 HydrophobicContact CD2-CE2 3.54Å; F468-Y508 AromaticContact CE2-CE2 3.85Å; F468-Y508 HydrophobicContact CE2-CE2 3.85Å; A504-Y508 HydrophobicContact CB-CD2 4.46Å; A504-Y508 WeakPolarHBondContact O-CB 3.43Å; A504-Y508 WeakPolarHBondContact O-CD2 3.31Å; A504-Y508 PolarHBondContact O-N 3.47Å; Y508-K510 PolarHBondContact O-N 2.85Å; Y508-K511 HydrophobicContact CD1-CD 3.63Å; Y508-K511 HydrophobicContact CE1-CD 4.14Å; Y508-K511 HydrophobicContact CG-CD 4.39Å; Y508-K511 PolarHBondContact O-N 2.87Å; Y508-K511 VanDerWaalsContact O-N 3.16Å; Y508-V520 VanDerWaalsContact C-CG2 3.47Å; Y508-V520 VanDerWaalsContact O-CG2 3.3Å; Y508-V520 WeakPolarHBondContact O-CG2 3.44Å
509	H	90.3	Very high	88.2	Confident	63 Å²	63	76.7 Å²	76.7	29%	0.292	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	126.5	172.6	-172.5	79.4	0	0	0	111.3	A505 K511 V520 F521	A505-H509 WeakPolarHBondContact O-CB 3.24Å; A505-H509 PolarHBondContact O-N 3.23Å; A505-H509 VanDerWaalsContact O-N 3.14Å; H509-K511 PolarHBondContact O-N 2.95Å; H509-V520 HydrophobicContact CB-CB 4.34Å; H509-V520 PolarHBondContact ND1-N 3.25Å; H509-V520 PolarHBondContact ND1-O 2.85Å; H509-F521 AromaticContact CE1-CE1 3.8Å; H509-F521 AromaticContact CE1-CZ 3.91Å
510	K	86.5	Confident	88.3	Confident	135 Å²	135	71.8 Å²	71.8	59%	0.587	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	16.1	-178.2	-64.5	173.3	178.2	179.7	0	115.5	Y508 V518	Y508-K510 PolarHBondContact O-N 2.85Å; K510-V518 VanDerWaalsContact CA-O 3.27Å; K510-V518 WeakPolarHBondContact CA-O 3.43Å; K510-V518 PolarHBondContact N-O 3.5Å
511	K	87.8	Confident	88.4	Confident	84 Å²	84	69 Å²	69	37%	0.365	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	150.5	167.8	-76.5	-169.6	177.3	162.8	0	111.2	F464 K507 Y508 H509 Y517 V518	F464-K511 HydrophobicContact CE2-CB 3.76Å; F464-K511 HydrophobicContact CZ-CB 3.99Å; K507-K511 WeakPolarHBondContact O-CE 3.4Å; K507-K511 PolarHBondContact O-NZ 2.91Å; Y508-K511 HydrophobicContact CD1-CD 3.63Å; Y508-K511 HydrophobicContact CE1-CD 4.14Å; Y508-K511 HydrophobicContact CG-CD 4.39Å; Y508-K511 PolarHBondContact O-N 2.87Å; Y508-K511 VanDerWaalsContact O-N 3.16Å; H509-K511 PolarHBondContact O-N 2.95Å; K511-Y517 WeakPolarHBondContact O-CA 3.41Å; K511-V518 PolarHBondContact O-N 3.05Å
512	T	86.1	Confident	88.4	Confident	106 Å²	106	71.2 Å²	71.2	65%	0.65	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	125.6	-179.8	49.2	0	0	0	0	111	R516	T512-R516 CarbonylContact C-O 3.59Å; T512-R516 WeakPolarHBondContact CA-O 3.18Å
513	M	84.6	Confident	88.3	Confident	9 Å²	9	66.6 Å²	66.6	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	112.7	165.6	-178.6	-170.1	-81	0	0	107.4	L452 A456 D460 I461 F464 D515 R516 V518	L452-M513 HydrophobicContact CD2-CE 3.56Å; L452-M513 HydrophobicContact CD2-SD 3.59Å; L452-M513 VanDerWaalsContact CD2-SD 3.59Å; A456-M513 HydrophobicContact CB-SD 4.19Å; D460-M513 HydrophobicContact CB-SD 4.5Å; I461-M513 HydrophobicContact CG1-CE 4.16Å; F464-M513 HydrophobicContact CB-CE 3.24Å; F464-M513 HydrophobicContact CD1-CE 3.83Å; F464-M513 HydrophobicContact CD2-CB 3.87Å; F464-M513 HydrophobicContact CD2-CE 3.97Å; F464-M513 HydrophobicContact CD2-CG 4.39Å; F464-M513 HydrophobicContact CE2-CB 4.16Å; F464-M513 HydrophobicContact CG-CE 3.42Å; F464-M513 VanDerWaalsContact CG-CE 3.42Å; M513-D515 PolarHBondContact O-N 3.43Å; M513-D515 VanDerWaalsContact O-N 3.17Å; M513-R516 PolarHBondContact N-O 3.35Å; M513-R516 PolarHBondContact O-N 2.72Å; M513-R516 VanDerWaalsContact O-N 3.11Å; M513-V518 HydrophobicContact CB-CG2 3.55Å; M513-V518 HydrophobicContact SD-CG2 4.49Å
514	K	81.6	Confident	88.2	Confident	130 Å²	130	63.4 Å²	63.4	57%	0.565	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	-119	-171.9	-57.3	176.3	177.5	174.7	0	109.2	P453 D460	P453-K514 HydrophobicContact CG-CB 4.46Å; D460-K514 WeakPolarHBondContact OD1-CE 3.44Å; D460-K514 IonicContact OD1-NZ 2.86Å; D460-K514 PolarHBondContact OD1-NZ 2.92Å; D460-K514 IonicContact OD2-NZ 3.22Å; D460-K514 PolarHBondContact OD2-NZ 3.47Å
515	D	81.1	Confident	87.9	Confident	167 Å²	167	65.2 Å²	65.2	89%	0.893	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	6.7	-178.2	-100.2	-33.7	0	0	0	115.1	M513	M513-D515 PolarHBondContact O-N 3.43Å; M513-D515 VanDerWaalsContact O-N 3.17Å
516	R	81.9	Confident	87.4	Confident	75 Å²	75	69.7 Å²	69.7	28%	0.283	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139	-178.3	-53.6	-146.7	-50.7	-175.5	5.8	112.6	G451 L452 P453 T512 M513	G451-R516 VanDerWaalsContact O-CZ 3.28Å; G451-R516 PolarHBondContact O-NE 3.47Å; G451-R516 PolarHBondContact O-NH2 3.36Å; L452-R516 PolarHBondContact O-NH2 2.82Å; P453-R516 HydrophobicContact CG-CB 4.33Å; P453-R516 HydrophobicContact CG-CG 4.25Å; T512-R516 CarbonylContact C-O 3.59Å; T512-R516 WeakPolarHBondContact CA-O 3.18Å; M513-R516 PolarHBondContact N-O 3.35Å; M513-R516 PolarHBondContact O-N 2.72Å; M513-R516 VanDerWaalsContact O-N 3.11Å
517	Y	88.5	Confident	86.9	Confident	153 Å²	153	66.2 Å²	66.2	60%	0.6	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	135.3	166.6	63.7	-92.6	0	0	0	109.9	K511 E519	K511-Y517 WeakPolarHBondContact O-CA 3.41Å; Y517-E519 HydrophobicContact CD2-CG 4.48Å; Y517-E519 HydrophobicContact CE2-CG 4.48Å
518	V	91.3	Very high	86.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.6	-179.2	-177.9	0	0	0	0	108.7	L449 R450 L452 F464 K510 K511 M513 V520	L449-V518 HydrophobicContact CB-CG1 4.11Å; L449-V518 HydrophobicContact CD2-CG1 4.1Å; R450-V518 WeakPolarHBondContact O-CA 3.36Å; L452-V518 HydrophobicContact CD2-CG1 3.92Å; L452-V518 HydrophobicContact CD2-CG2 4Å; F464-V518 HydrophobicContact CE1-CB 4.34Å; F464-V518 HydrophobicContact CE1-CG1 4.25Å; F464-V518 HydrophobicContact CE2-CB 4.37Å; F464-V518 HydrophobicContact CE2-CG2 4.41Å; F464-V518 HydrophobicContact CZ-CB 3.83Å; F464-V518 HydrophobicContact CZ-CG1 4.23Å; F464-V518 HydrophobicContact CZ-CG2 4.3Å; K510-V518 VanDerWaalsContact CA-O 3.27Å; K510-V518 WeakPolarHBondContact CA-O 3.43Å; K510-V518 PolarHBondContact N-O 3.5Å; K511-V518 PolarHBondContact O-N 3.05Å; M513-V518 HydrophobicContact CB-CG2 3.55Å; M513-V518 HydrophobicContact SD-CG2 4.49Å; V518-V520 HydrophobicContact CG1-CG2 4.25Å
519	E	91.3	Very high	86	Confident	49 Å²	49	65.3 Å²	65.3	23%	0.229	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128.4	172	-59.2	-176.6	120.9	0	0	109.3	L449 R450 Y517 F521	L449-E519 WeakPolarHBondContact CA-O 3.46Å; R450-E519 HydrophobicContact CB-CB 4.32Å; R450-E519 PolarHBondContact N-O 2.9Å; R450-E519 PolarHBondContact O-N 2.8Å; Y517-E519 HydrophobicContact CD2-CG 4.48Å; Y517-E519 HydrophobicContact CE2-CG 4.48Å; E519-F521 HydrophobicContact CB-CD2 4.4Å; E519-F521 HydrophobicContact CB-CE2 3.51Å; E519-F521 HydrophobicContact CB-CZ 3.84Å
520	V	92.6	Very high	85.3	Confident	4 Å²	4	67.6 Å²	67.6	2%	0.024	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.8	-176.8	-169	0	0	0	0	108.5	I447 R448 L449 F464 A505 Y508 H509 V518	I447-V520 HydrophobicContact CG2-CG1 3.19Å; R448-V520 WeakPolarHBondContact O-CA 3.3Å; L449-V520 HydrophobicContact CD2-CB 4.07Å; L449-V520 HydrophobicContact CD2-CG1 3.69Å; L449-V520 HydrophobicContact CD2-CG2 3.52Å; F464-V520 HydrophobicContact CE1-CG2 4.18Å; F464-V520 HydrophobicContact CZ-CG2 4.44Å; A505-V520 HydrophobicContact CB-CG1 4.16Å; Y508-V520 VanDerWaalsContact C-CG2 3.47Å; Y508-V520 VanDerWaalsContact O-CG2 3.3Å; Y508-V520 WeakPolarHBondContact O-CG2 3.44Å; H509-V520 HydrophobicContact CB-CB 4.34Å; H509-V520 PolarHBondContact ND1-N 3.25Å; H509-V520 PolarHBondContact ND1-O 2.85Å; V518-V520 HydrophobicContact CG1-CG2 4.25Å
521	F	91.6	Very high	84.8	Confident	47 Å²	47	62 Å²	62	21%	0.206	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.9	-178.6	-57.8	-79.9	0	0	0	110.6	I447 R448 H509 E519	I447-F521 CarbonylContact C-O 3.49Å; I447-F521 VanDerWaalsContact CA-O 3.32Å; I447-F521 WeakPolarHBondContact CA-O 3.43Å; R448-F521 PolarHBondContact N-O 3.36Å; R448-F521 PolarHBondContact O-N 3.24Å; H509-F521 AromaticContact CE1-CE1 3.8Å; H509-F521 AromaticContact CE1-CZ 3.91Å; E519-F521 HydrophobicContact CB-CD2 4.4Å; E519-F521 HydrophobicContact CB-CE2 3.51Å; E519-F521 HydrophobicContact CB-CZ 3.84Å
522	Q	91.9	Very high	84	Confident	46 Å²	46	61.2 Å²	61.2	22%	0.215	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	133.4	170.8	-165.1	-168.6	12.8	0	0	109.6	R444 T498 A501 A505	R444-Q522 HydrophobicContact CB-CG 3.94Å; R444-Q522 PolarHBondContact O-NE2 3.02Å; T498-Q522 PolarHBondContact O-NE2 3.4Å; A501-Q522 HydrophobicContact CB-CG 4.37Å; A505-Q522 HydrophobicContact CB-CB 4.2Å
523	C	88.4	Confident	83.2	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	169	178.6	61.3	0	0	0	0	111.7	R444 C446 E527	R444-C523 CarbonylContact C-O 3.48Å; R444-C523 VanDerWaalsContact CA-O 3.27Å; R444-C523 WeakPolarHBondContact CA-O 3.26Å; C446-C523 CarbonylContact C-O 3.38Å; C446-C523 WeakPolarHBondContact CA-O 3.47Å; C446-C523 WeakPolarHBondContact CB-O 3.34Å; C446-C523 VanDerWaalsContact CB-SG 3.6Å; C446-C523 PolarHBondContact N-O 2.85Å; C446-C523 VanDerWaalsContact N-O 3.07Å; C446-C523 PolarHBondContact O-N 3.47Å; C523-E527 WeakPolarHBondContact CA-OE2 3.3Å; C523-E527 HydrophobicContact CB-CB 4.21Å; C523-E527 WeakPolarHBondContact CB-OE2 3.18Å
524	S	87.9	Confident	82.1	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.021	34%	0.336	C	S	.	.			trans	-89.5	161.4	170.7	71.1	0	0	0	0	112.1	E526 E527 M528	S524-E526 PolarHBondContact O-N 2.75Å; S524-E526 PolarHBondContact OG-N 2.94Å; S524-E527 PolarHBondContact N-OE2 2.81Å; S524-E527 PolarHBondContact O-N 3.17Å; S524-E527 WeakPolarHBondContact OG-CG 3.27Å; S524-E527 PolarHBondContact OG-N 3.34Å; S524-M528 PolarHBondContact O-N 3.16Å
525	A	82.4	Confident	81.2	Confident	38 Å²	38	61.1 Å²	61.1	31%	0.314	32%	0.318	S	S	.	.	H	α-helix	trans	-59.1	-30.3	171.3	0	0	0	0	0	112.4	N529	A525-N529 WeakPolarHBondContact O-CB 3.27Å; A525-N529 PolarHBondContact O-N 3.27Å
526	E	80.9	Confident	80.1	Confident	95 Å²	95	59.3 Å²	59.3	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-68.1	-45.5	175.2	-65.5	177.5	-177.9	0	0	112	S524 M528 N529 F530	S524-E526 PolarHBondContact O-N 2.75Å; S524-E526 PolarHBondContact OG-N 2.94Å; E526-M528 VanDerWaalsContact C-N 3.3Å; E526-M528 PolarHBondContact O-N 2.8Å; E526-N529 PolarHBondContact O-N 3.11Å; E526-F530 WeakPolarHBondContact O-CB 3.49Å; E526-F530 PolarHBondContact O-N 2.82Å
527	E	80.3	Confident	78.9	Confident	60 Å²	60	58.5 Å²	58.5	28%	0.28	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-39	176.4	-72.8	172	152.1	0	0	111.5	C523 S524 V531 L537	C523-E527 WeakPolarHBondContact CA-OE2 3.3Å; C523-E527 HydrophobicContact CB-CB 4.21Å; C523-E527 WeakPolarHBondContact CB-OE2 3.18Å; S524-E527 PolarHBondContact N-OE2 2.81Å; S524-E527 PolarHBondContact O-N 3.17Å; S524-E527 WeakPolarHBondContact OG-CG 3.27Å; S524-E527 PolarHBondContact OG-N 3.34Å; E527-V531 WeakPolarHBondContact O-CG2 3.42Å; E527-V531 PolarHBondContact O-N 2.78Å; E527-L537 HydrophobicContact CB-CD1 4.08Å
528	M	80.9	Confident	77.2	Confident	13 Å²	13	58.8 Å²	58.8	6%	0.064	33%	0.327	C	S	.	.	H	α-helix	trans	-61.1	-50.4	172	167	-178.9	168.9	0	0	111.6	C446 H478 F492 S524 E526 F530 V531 L532	C446-M528 HydrophobicContact CB-SD 4.45Å; H478-M528 HydrophobicContact CB-CE 3.96Å; H478-M528 WeakPolarHBondContact CD2-CE 3.19Å; H478-M528 VanDerWaalsContact NE2-CE 3.26Å; H478-M528 WeakPolarHBondContact NE2-CE 3.47Å; F492-M528 HydrophobicContact CB-CB 4.31Å; F492-M528 HydrophobicContact CB-CE 4.11Å; F492-M528 HydrophobicContact CB-CG 3.58Å; F492-M528 HydrophobicContact CB-SD 3.79Å; F492-M528 HydrophobicContact CD1-CB 3.66Å; F492-M528 HydrophobicContact CD1-CG 3.86Å; F492-M528 HydrophobicContact CD2-CG 4.46Å; F492-M528 HydrophobicContact CE1-CB 4.17Å; F492-M528 HydrophobicContact CG-CB 4.07Å; F492-M528 HydrophobicContact CG-CG 3.73Å; S524-M528 PolarHBondContact O-N 3.16Å; E526-M528 VanDerWaalsContact C-N 3.3Å; E526-M528 PolarHBondContact O-N 2.8Å; M528-F530 VanDerWaalsContact C-N 3.32Å; M528-F530 PolarHBondContact O-N 2.66Å; M528-V531 PolarHBondContact O-N 3.42Å; M528-L532 HydrophobicContact CE-CD1 3.76Å; M528-L532 HydrophobicContact CG-CD1 3.88Å; M528-L532 WeakPolarHBondContact O-CG 3.41Å; M528-L532 PolarHBondContact O-N 3.48Å
529	N	78.3	Confident	75	Confident	88 Å²	88	68.5 Å²	68.5	47%	0.471	36%	0.363	S	S	.	.	H	α-helix	trans	-64.3	-38.4	-178.9	-164.4	27.8	0	0	0	111.8	A525 E526 V531 L532 M533	A525-N529 WeakPolarHBondContact O-CB 3.27Å; A525-N529 PolarHBondContact O-N 3.27Å; E526-N529 PolarHBondContact O-N 3.11Å; N529-V531 VanDerWaalsContact C-N 3.3Å; N529-V531 PolarHBondContact O-N 2.97Å; N529-L532 PolarHBondContact O-N 3.29Å; N529-M533 WeakPolarHBondContact O-CG 3.31Å; N529-M533 PolarHBondContact O-N 3.05Å
530	F	76.3	Confident	72.6	Confident	111 Å²	111	71.4 Å²	71.4	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-57.6	-41.3	175.4	-177.1	-101.3	0	0	0	112.3	E526 M528 G535 L537	E526-F530 WeakPolarHBondContact O-CB 3.49Å; E526-F530 PolarHBondContact O-N 2.82Å; M528-F530 VanDerWaalsContact C-N 3.32Å; M528-F530 PolarHBondContact O-N 2.66Å; F530-G535 VanDerWaalsContact O-CA 3.27Å; F530-G535 WeakPolarHBondContact O-CA 3.38Å; F530-G535 PolarHBondContact O-N 3.13Å; F530-L537 HydrophobicContact CD1-CD2 3.75Å; F530-L537 HydrophobicContact CD1-CG 4.31Å; F530-L537 HydrophobicContact CE1-CD2 4.17Å
531	V	74.4	Confident	70.3	Confident	18 Å²	18	73.4 Å²	73.4	11%	0.109	40%	0.402	C	S	.	.	H	α-helix	trans	-75.3	-39.2	177.2	178.9	0	0	0	0	112.1	F492 E527 M528 N529 M533 G534 L537	F492-V531 HydrophobicContact CE2-CB 3.75Å; F492-V531 HydrophobicContact CE2-CG1 3.59Å; F492-V531 HydrophobicContact CE2-CG2 4.39Å; F492-V531 HydrophobicContact CZ-CB 3.67Å; F492-V531 HydrophobicContact CZ-CG1 3.85Å; F492-V531 HydrophobicContact CZ-CG2 3.83Å; E527-V531 WeakPolarHBondContact O-CG2 3.42Å; E527-V531 PolarHBondContact O-N 2.78Å; M528-V531 PolarHBondContact O-N 3.42Å; N529-V531 VanDerWaalsContact C-N 3.3Å; N529-V531 PolarHBondContact O-N 2.97Å; V531-M533 PolarHBondContact O-N 3.14Å; V531-G534 PolarHBondContact O-N 3.41Å; V531-L537 HydrophobicContact CG2-CB 4.39Å; V531-L537 HydrophobicContact CG2-CD1 3.42Å; V531-L537 VanDerWaalsContact CG2-CD1 3.42Å; V531-L537 HydrophobicContact CG2-CG 3.46Å; V531-L537 VanDerWaalsContact CG2-CG 3.46Å
532	L	72.5	Confident	67.6	Low	68 Å²	68	78 Å²	78	36%	0.356	43%	0.428	S	S	.	.	H	α-helix	trans	-64.1	-25.4	176.5	-68.5	174	0	0	0	112.6	H478 V480 M528 N529 G534	H478-L532 HydrophobicContact CB-CD1 4.04Å; H478-L532 HydrophobicContact CB-CD2 4.18Å; V480-L532 HydrophobicContact CG2-CD2 4.4Å; M528-L532 HydrophobicContact CE-CD1 3.76Å; M528-L532 HydrophobicContact CG-CD1 3.88Å; M528-L532 WeakPolarHBondContact O-CG 3.41Å; M528-L532 PolarHBondContact O-N 3.48Å; N529-L532 PolarHBondContact O-N 3.29Å; L532-G534 VanDerWaalsContact C-N 3.34Å
533	M	69.3	Low	64.6	Low	158 Å²	158	80.7 Å²	80.7	78%	0.778	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	11.5	172.7	-63.7	-147.7	78.3	0	0	114.4	N529 V531	N529-M533 WeakPolarHBondContact O-CG 3.31Å; N529-M533 PolarHBondContact O-N 3.05Å; V531-M533 PolarHBondContact O-N 3.14Å
534	G	61	Low	61.6	Low	65 Å²	65	85.8 Å²	85.8	67%	0.67	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	10.6	174.3	0	0	0	0	0	115.6	V531 L532	V531-G534 PolarHBondContact O-N 3.41Å; L532-G534 VanDerWaalsContact C-N 3.34Å
535	G	63	Low	58.9	Low	19 Å²	19	90.7 Å²	90.7	20%	0.196	52%	0.517	C	S	.	.			trans	-77.8	153	172.6	0	0	0	0	0	113.3	F530	F530-G535 VanDerWaalsContact O-CA 3.27Å; F530-G535 WeakPolarHBondContact O-CA 3.38Å; F530-G535 PolarHBondContact O-N 3.13Å
536	T	57.8	Low	56.4	Low	130 Å²	130	94.8 Å²	94.8	80%	0.798	54%	0.54	S	S	*	.			trans	-108.5	124.1	178.7	59.1	0	0	0	0	111.7
537	L	55.9	Low	53.9	Low	58 Å²	58	96.3 Å²	96.3	30%	0.304	56%	0.56	S	S	.	*			trans	-92.6	145	174.4	-63.9	175.6	0	0	0	112.2	E527 F530 V531	E527-L537 HydrophobicContact CB-CD1 4.08Å; F530-L537 HydrophobicContact CD1-CD2 3.75Å; F530-L537 HydrophobicContact CD1-CG 4.31Å; F530-L537 HydrophobicContact CE1-CD2 4.17Å; V531-L537 HydrophobicContact CG2-CB 4.39Å; V531-L537 HydrophobicContact CG2-CD1 3.42Å; V531-L537 VanDerWaalsContact CG2-CD1 3.42Å; V531-L537 HydrophobicContact CG2-CG 3.46Å; V531-L537 VanDerWaalsContact CG2-CG 3.46Å
538	N	52.6	Low	51.5	Low	159 Å²	159	101.6 Å²	101.6	85%	0.85	59%	0.589	S	S	*	*			trans	-65.2	148.9	177.4	-97.8	-9.4	0	0	0	112.8	N540	N538-N540 PolarHBondContact O-N 3.24Å
539	R	44.7	Very low	49	Very low	203 Å²	203	106.1 Å²	106.1	77%	0.766	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-13.7	-162.4	-157.3	171.8	110.1	-177.7	3.9	117.1
540	N	42.8	Very low	46.7	Very low	110 Å²	110	107.1 Å²	107.1	59%	0.588	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.9	-3.9	-165.6	-86.2	23.2	0	0	0	118	N538 L542	N538-N540 PolarHBondContact O-N 3.24Å; N540-L542 WeakPolarHBondContact O-CB 3.41Å; N540-L542 PolarHBondContact O-N 2.99Å
541	G	43.7	Very low	44.4	Very low	47 Å²	47	107.8 Å²	107.8	49%	0.485	65%	0.649	S	S	.	*			trans	51.4	8.5	172	0	0	0	0	0	118
542	L	34.1	Very low	42.2	Very low	144 Å²	144	112.2 Å²	112.2	75%	0.754	68%	0.68	S	S	*	*			trans	-129.5	104.6	-174.9	-70.3	171.4	0	0	0	107.1	N540	N540-L542 WeakPolarHBondContact O-CB 3.41Å; N540-L542 PolarHBondContact O-N 2.99Å
543	S	29	Very low	40.1	Very low	102 Å²	102	119.7 Å²	119.7	71%	0.713	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66.4	130.7	160.5	-47.5	0	0	0	0	108
544	P	26	Very low	38	Very low	112 Å²	112	118.3 Å²	118.3	73%	0.727	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-68.2	145.2	163.8	28.2	-28.6	0	0	0	108.9
545	P	30.1	Very low	36.4	Very low	107 Å²	107	124.4 Å²	124.4	70%	0.695	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-65.2	154.7	172.5	28.4	-32.1	0	0	0	110.1	C547	P545-C547 PolarHBondContact O-N 3.46Å
546	P	31.2	Very low	34.7	Very low	123 Å²	123	129.1 Å²	129.1	80%	0.799	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.3	122.4	175.4	25.2	-31	0	0	0	109.3	L548	P546-L548 PolarHBondContact O-N 3.15Å; P546-L548 VanDerWaalsContact O-N 3.13Å
547	C	27.6	Very low	33.3	Very low	128 Å²	128	127.3 Å²	127.3	87%	0.865	74%	0.74	S	S	*	*			trans	-64.1	113.2	174.2	-51.8	0	0	0	0	108.8	P545 S549	P545-C547 PolarHBondContact O-N 3.46Å; C547-S549 PolarHBondContact O-N 2.95Å
548	L	29.2	Very low	31.9	Very low	171 Å²	171	130.4 Å²	130.4	90%	0.895	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-62.7	122	164.1	-71.1	161.4	0	0	0	108.5	P546	P546-L548 PolarHBondContact O-N 3.15Å; P546-L548 VanDerWaalsContact O-N 3.13Å
549	S	29.4	Very low	30.6	Very low	107 Å²	107	129.6 Å²	129.6	75%	0.748	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-61.3	147.5	166.5	31.9	0	0	0	0	111.4	C547	C547-S549 PolarHBondContact O-N 2.95Å
550	P	29.4	Very low	29.8	Very low	110 Å²	110	124.6 Å²	124.6	71%	0.714	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-70	156.8	176.3	27.6	-30.1	0	0	0	111.8	S552	P550-S552 PolarHBondContact O-N 2.93Å
551	P	29.4	Very low	29.1	Very low	125 Å²	125	125.9 Å²	125.9	81%	0.812	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-71.3	129.6	-166.3	29.4	-33	0	0	0	111.3
552	S	26.8	Very low	28.4	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-86.7	125.1	171.4	-56.5	0	0	0	0	109.3	P550 T554	P550-S552 PolarHBondContact O-N 2.93Å; S552-T554 PolarHBondContact O-N 3.46Å
553	Y	28.7	Very low	28.1	Very low	225 Å²	225	129.5 Å²	129.5	88%	0.882	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.7	131.9	171.5	-86.7	-94.8	0	0	0	110.9
554	T	24.7	Very low	28	Very low	128 Å²	128	130.5 Å²	130.5	79%	0.785	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-76.6	131.6	178.2	-42.6	0	0	0	0	110.9	S552	S552-T554 PolarHBondContact O-N 3.46Å
555	F	27.4	Very low	28.1	Very low	193 Å²	193	134.1 Å²	134.1	85%	0.846	80%	0.802	S	S	*	*			trans	-124.7	139.2	152.7	-81.2	-79.3	0	0	0	108.6
556	P	28.9	Very low	27.9	Very low	118 Å²	118	133.6 Å²	133.6	77%	0.766	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-79.3	143.9	-174.9	24.2	-18.9	0	0	0	112.2
557	A	27	Very low	27.7	Very low	92 Å²	92	131.8 Å²	131.8	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.8	146.9	169.9	0	0	0	0	0	111.2
558	P	27.1	Very low	27.6	Very low	123 Å²	123	133 Å²	133	80%	0.799	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-82.2	144.8	169	33.3	-30.3	0	0	0	111.1
559	T	26.3	Very low	27.5	Very low	143 Å²	143	135.5 Å²	135.5	88%	0.877	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-60.9	132.8	174.8	-6.9	0	0	0	0	111.7
560	A	26.8	Very low	27.4	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	80%	0.8	S	S	*	*			trans	-120.1	125.4	165	0	0	0	0	0	109.8
561	V	27.8	Very low	27.9	Very low	136 Å²	136	138.1 Å²	138.1	82%	0.824	80%	0.796	S	S	*	*			trans	-83.3	133.3	-176.7	176.4	0	0	0	0	109.4
562	I	29.5	Very low	27.8	Very low	143 Å²	143	137 Å²	137	73%	0.733	79%	0.791	S	S	*	*			trans	-81.3	145.3	170.5	-59.2	168.2	0	0	0	108.8
563	P	27.9	Very low	27.8	Very low	124 Å²	124	139 Å²	139	81%	0.805	79%	0.792	S	S	*	*			trans	-125.6	141.6	136.6	25.8	-10.1	0	0	0	112.6
564	T	26.8	Very low	27.8	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	79%	0.787	S	S	*	*			trans	-95.6	135.6	-177.9	-36.7	0	0	0	0	109.3
565	E	28.8	Very low	27.9	Very low	188 Å²	188	137.2 Å²	137.2	88%	0.879	79%	0.792	S	S	*	*				-177	129.8	129.7	-108.2	-179.4	156.7	0	0	115
566	A	26.3	Very low	27.9	Very low	95 Å²	95	135.2 Å²	135.2	79%	0.785	79%	0.79	S	S	*	*			trans	14	140.7	145.6	0	0	0	0	0	125
567	A	25.9	Very low	28.1	Very low	85 Å²	85	135.3 Å²	135.3	70%	0.702	79%	0.79	S	S	*	*				103.2	112.2	126.6	0	0	0	0	0	122.5
568	I	26.1	Very low	28.2	Very low	153 Å²	153	143.1 Å²	143.1	79%	0.785	80%	0.8	S	S	*	*			trans	68	137.6	133	-45.2	179.9	0	0	0	121.1
569	Y	27.6	Very low	28.1	Very low	224 Å²	224	141.6 Å²	141.6	88%	0.878	80%	0.798	S	S	*	*			trans	110.9	120.2	157.3	-89.2	-84.5	0	0	0	118.7
570	Q	26	Very low	28.2	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	80%	0.801	S	S	*	*			trans	-82.6	-179.6	159.7	-96.4	-161.4	-18.5	0	0	110.5
571	P	40.8	Very low	28.2	Very low	99 Å²	99	147.1 Å²	147.1	64%	0.643	80%	0.802	S	S	*	*			cis	-136.8	178.8	-24.6	29.7	-7.8	0	0	0	114.7
572	S	26.3	Very low	28.4	Very low	101 Å²	101	145.7 Å²	145.7	71%	0.706	80%	0.795	S	S	*	*			trans	109.1	136	141.1	-31.4	0	0	0	0	121.8
573	L	26.5	Very low	28.2	Very low	152 Å²	152	145 Å²	145	80%	0.796	80%	0.803	S	S	*	*			trans	90.3	115.2	148.6	-54.6	-176.3	0	0	0	122.8
574	L	29.1	Very low	28.1	Very low	148 Å²	148	145.3 Å²	145.3	78%	0.775	80%	0.803	S	S	*	*			trans	50.2	118.4	130.5	-70	161.5	0	0	0	120.9
575	L	27.1	Very low	27.9	Very low	169 Å²	169	143.3 Å²	143.3	89%	0.885	80%	0.799	S	S	*	*				172.4	134.1	106.4	-110.6	106.6	0	0	0	112.2
576	N	26.8	Very low	27.7	Very low	151 Å²	151	145.2 Å²	145.2	81%	0.807	80%	0.8	S	S	*	*			trans	-72	-173.5	164.7	-90.6	-2.5	0	0	0	111.5
577	P	34.3	Very low	27.8	Very low	119 Å²	119	151.1 Å²	151.1	77%	0.773	80%	0.803	S	S	*	*				-122.5	167.4	-64.2	35.5	-19.1	0	0	0	110
578	R	28.2	Very low	27.8	Very low	256 Å²	256	152.9 Å²	152.9	97%	0.966	81%	0.808	S	S	*	*			trans	-129.2	123.2	167.8	-131.7	176.9	-174.6	166.7	1.2	111.9
579	A	26.1	Very low	27.7	Very low	92 Å²	92	150.8 Å²	150.8	76%	0.76	81%	0.813	S	S	*	*			trans	-82.4	142.1	176.9	0	0	0	0	0	111.4
580	L	27.9	Very low	27.7	Very low	177 Å²	177	143.5 Å²	143.5	93%	0.927	81%	0.806	S	S	*	*			trans	-144.5	120.5	155.7	-85.6	169.2	0	0	0	108.9
581	Q	27.7	Very low	27.7	Very low	179 Å²	179	142 Å²	142	84%	0.836	81%	0.809	S	S	*	*			trans	-93	-171.1	160.6	-68.1	-152.1	-16.9	0	0	109.6
582	P	30.1	Very low	26.9	Very low	106 Å²	106	144.9 Å²	144.9	69%	0.688	81%	0.814	S	S	*	*				-118.6	153.8	-72.7	34.1	-19.3	0	0	0	110.2
583	S	26.1	Very low	26.8	Very low	128 Å²	128	148.3 Å²	148.3	90%	0.895	82%	0.823	S	S	*	*			trans	-112.8	112.9	169.6	29.1	0	0	0	0	111.4
584	T	25.8	Very low	26.7	Very low	132 Å²	132	149.1 Å²	149.1	81%	0.81	82%	0.821	S	S	*	*			trans	-63.6	144	177.3	-52.6	0	0	0	0	112.5
585	A	23.3	Very low	26.5	Very low	81 Å²	81	150.7 Å²	150.7	67%	0.669	83%	0.826	S	S	*	*			trans	-65.3	148.7	175.2	0	0	0	0	0	113.8
586	Y	24.8	Very low	26.3	Very low	228 Å²	228	150 Å²	150	89%	0.894	82%	0.824	S	S	*	*			trans	-139.2	115.1	159.1	-113.1	-92.3	0	0	0	108.7
587	Y	26.9	Very low	26.2	Very low	220 Å²	220	153.2 Å²	153.2	86%	0.863	83%	0.826	S	S	*	*			trans	-113.2	135.4	165.9	-95.4	-84.2	0	0	0	108.2
588	P	26.8	Very low	25.8	Very low	122 Å²	122	154 Å²	154	79%	0.792	83%	0.829	S	S	*	*			trans	-87.5	148.5	162.7	31.3	-23.3	0	0	0	111
589	A	24.5	Very low	25.7	Very low	109 Å²	109	146.1 Å²	146.1	90%	0.901	82%	0.818	S	S	*	*			trans	-86.4	156.7	-178.9	0	0	0	0	0	113.3
590	G	26.4	Very low	25.8	Very low	70 Å²	70	152.5 Å²	152.5	72%	0.722	82%	0.824	S	S	*	*			trans	124	132.1	171.4	0	0	0	0	0	110.9
591	T	25.7	Very low	25.9	Very low	144 Å²	144	154.5 Å²	154.5	88%	0.883	82%	0.821	S	S	*	*			cis	-160.6	147.1	10.2	-50.9	0	0	0	0	106.5
592	Q	24.3	Very low	26.2	Very low	158 Å²	158	151.5 Å²	151.5	74%	0.738	82%	0.817	S	S	*	*			trans	-71.5	137.7	-178.5	-65.3	-148	-15.3	0	0	113.2
593	L	24.8	Very low	26.4	Very low	173 Å²	173	151.7 Å²	151.7	91%	0.906	82%	0.821	S	S	*	*			trans	-131	113.5	156.4	-76.2	171.4	0	0	0	108.9
594	F	24.1	Very low	27	Very low	170 Å²	170	151.3 Å²	151.3	75%	0.746	82%	0.815	S	S	*	*			trans	-64.3	130.4	166.9	-91.9	-102.1	0	0	0	109.7
595	M	24.1	Very low	27.4	Very low	180 Å²	180	151.6 Å²	151.6	89%	0.887	82%	0.82	S	S	*	*			trans	-136.6	115	157.4	-93.8	-66.9	178.1	0	0	108.9
596	N	24.2	Very low	28.1	Very low	156 Å²	156	151.4 Å²	151.4	83%	0.834	83%	0.825	S	S	*	*			trans	-75	138.4	176.8	-104	-33.7	0	0	0	110.6
597	Y	24.8	Very low	28.4	Very low	217 Å²	217	145.3 Å²	145.3	85%	0.851	82%	0.816	S	S	*	*			trans	-75.9	135.6	175.4	-97.3	-101.6	0	0	0	112
598	T	24.1	Very low	28.6	Very low	137 Å²	137	141 Å²	141	84%	0.84	82%	0.815	S	S	*	*			trans	-160.3	102.9	139.9	17.7	0	0	0	0	109.3
599	A	26.8	Very low	28.7	Very low	89 Å²	89	143.3 Å²	143.3	74%	0.736	82%	0.821	S	S	*	*			trans	-123.2	109.6	165.9	0	0	0	0	0	108.3
600	Y	27.8	Very low	29.1	Very low	226 Å²	226	143.4 Å²	143.4	89%	0.886	82%	0.815	S	S	*	*			trans	-55.4	134.2	171.1	-87.4	-106.5	0	0	0	111.1
601	Y	31.5	Very low	29.2	Very low	219 Å²	219	147.5 Å²	147.5	86%	0.859	82%	0.819	S	S	*	*			trans	-125.6	144	160.2	-109.8	-93	0	0	0	110
602	P	33.3	Very low	29.2	Very low	116 Å²	116	144 Å²	144	75%	0.753	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-85.6	145.7	-172.8	19.5	-5.3	0	0	0	112.8
603	S	34.6	Very low	29.3	Very low	111 Å²	111	147 Å²	147	78%	0.776	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-74.6	153.3	175.1	-51.1	0	0	0	0	113.1
604	P	39.4	Very low	29.4	Very low	119 Å²	119	148 Å²	148	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72	154.6	169.1	-11.6	27.6	0	0	0	112.7
605	P	34	Very low	29.6	Very low	139 Å²	139	145.2 Å²	145.2	90%	0.903	81%	0.814	S	S	*	*	S	Bend	trans	-82.3	134.3	-169.7	31.5	-32.8	0	0	0	113.5
606	G	36.9	Very low	29.7	Very low	76 Å²	76	143.7 Å²	143.7	78%	0.784	82%	0.815	S	S	*	*			trans	148.2	46.5	169.1	0	0	0	0	0	116.5
607	S	32.5	Very low	30	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	81%	0.812	S	S	*	*	S	Bend	trans	-160.1	147.9	161.1	17.4	0	0	0	0	110.5
608	P	30.4	Very low	30.3	Very low	130 Å²	130	134.7 Å²	134.7	84%	0.844	81%	0.807	S	S	*	*			trans	-68.3	133	-172.5	24.7	-31.1	0	0	0	112.3	S610	P608-S610 PolarHBondContact O-N 3.28Å
609	N	29.2	Very low	30.5	Very low	169 Å²	169	135.3 Å²	135.3	90%	0.904	81%	0.805	S	S	*	*			trans	-81	110.9	177.5	-72.6	-25	0	0	0	111
610	S	32.3	Very low	30.7	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	81%	0.808	S	S	*	*			trans	-168.7	117.6	136.9	-172.1	0	0	0	0	108.7	P608	P608-S610 PolarHBondContact O-N 3.28Å
611	L	27.5	Very low	30.9	Very low	156 Å²	156	132.5 Å²	132.5	82%	0.817	80%	0.801	S	S	*	*			trans	-169.2	112.6	148.4	-101	154.5	0	0	0	108.7
612	G	27.4	Very low	31.2	Very low	69 Å²	69	127.5 Å²	127.5	71%	0.711	80%	0.797	S	S	*	*			trans	-66.5	144.6	172.3	0	0	0	0	0	111.6
613	Y	25.8	Very low	31.1	Very low	222 Å²	222	128.7 Å²	128.7	87%	0.871	80%	0.802	S	S	*	*			trans	-85.9	125.8	179	-134.8	-98	0	0	0	109.4
614	F	27.2	Very low	31.1	Very low	194 Å²	194	128.4 Å²	128.4	85%	0.851	80%	0.798	S	S	*	*			trans	-119.8	134.9	155.6	-82.9	-77	0	0	0	108.5
615	P	28.9	Very low	30.9	Very low	111 Å²	111	129 Å²	129	72%	0.721	80%	0.801	S	S	*	*			trans	-82.8	139.3	-174.1	32.8	-31.6	0	0	0	111.2
616	T	25.5	Very low	31.1	Very low	148 Å²	148	131.2 Å²	131.2	91%	0.908	80%	0.8	S	S	*	*			trans	-91.3	112.3	170.3	-37.7	0	0	0	0	109.2
617	A	29.5	Very low	31.3	Very low	93 Å²	93	133.8 Å²	133.8	77%	0.769	80%	0.803	S	S	*	*			trans	-103.4	133	163.1	0	0	0	0	0	108.7
618	A	32	Very low	32.5	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	80%	0.804	S	S	*	*			trans	-68.9	125.8	166.9	0	0	0	0	0	109.6
619	N	28.9	Very low	33.7	Very low	150 Å²	150	132.6 Å²	132.6	80%	0.802	80%	0.803	S	S	*	*			trans	-175.9	130.6	142.6	-94.8	-19.3	0	0	0	112.1
620	L	29.5	Very low	35.3	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	80%	0.801	S	S	*	*			trans	30.1	118.4	146.8	-70.7	146.6	0	0	0	121.2
621	S	33.1	Very low	36.7	Very low	104 Å²	104	130.3 Å²	130.3	73%	0.727	79%	0.79	S	S	*	*			trans	74	131.9	138.4	60.1	0	0	0	0	122.8
622	S	37.2	Very low	38.6	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	79%	0.786	S	S	*	*			trans	77.6	107.7	157.4	70.3	0	0	0	0	119.3
623	V	31.8	Very low	40.5	Very low	141 Å²	141	131.9 Å²	131.9	86%	0.855	77%	0.767	S	S	*	*			trans	173.4	144.4	144.5	154.7	0	0	0	0	108.6
624	P	34	Very low	42.6	Very low	106 Å²	106	129 Å²	129	69%	0.688	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-81	165.7	-165.9	22.5	-11.7	0	0	0	114
625	P	35.2	Very low	44.6	Very low	130 Å²	130	123.9 Å²	123.9	84%	0.844	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-77.3	128.4	-166	31.3	-33.2	0	0	0	111.9
626	Q	38.6	Very low	46.7	Very low	187 Å²	187	122.6 Å²	122.6	87%	0.874	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-81.7	141.4	166.6	-72.9	-156.3	-12.5	0	0	111
627	P	42	Very low	49	Very low	130 Å²	130	118.3 Å²	118.3	84%	0.844	73%	0.729	S	S	*	*	S	Bend	trans	-84.8	128.3	-179.1	32.3	-30.3	0	0	0	111.4
628	G	56	Low	50.9	Low	71 Å²	71	125.8 Å²	125.8	73%	0.732	74%	0.74	S	S	*	*			trans	124.4	115.3	167.8	0	0	0	0	0	113.7
629	T	56.2	Low	53.1	Low	135 Å²	135	128.1 Å²	128.1	83%	0.828	74%	0.739	S	S	*	*			trans	-100.5	123.6	172.9	-56.9	0	0	0	0	109
630	V	63.5	Low	55.4	Low	141 Å²	141	122.9 Å²	122.9	86%	0.855	71%	0.713	S	S	*	*			trans	-82.2	123.9	174.4	179.5	0	0	0	0	109
631	V	60.9	Low	57.7	Low	91 Å²	91	117 Å²	117	55%	0.552	69%	0.689	S	S	*	*			trans	-108.1	126.1	178.3	-178.3	0	0	0	0	109.3	F649	V631-F649 HydrophobicContact CB-CE1 4.39Å; V631-F649 HydrophobicContact CB-CZ 4.14Å; V631-F649 HydrophobicContact CG1-CE1 4.19Å; V631-F649 HydrophobicContact CG1-CZ 3.86Å; V631-F649 HydrophobicContact CG2-CE1 4.42Å
632	R	67.9	Low	59.7	Low	196 Å²	196	115.9 Å²	115.9	74%	0.74	68%	0.678	S	S	*	*			trans	-103.4	115.1	176.9	-172.9	177.6	-177.9	174.4	2.7	110
633	M	67.3	Low	61.5	Low	63 Å²	63	118.3 Å²	118.3	31%	0.31	67%	0.674	S	S	.	*			trans	-94	126	174.8	-60.2	-177.7	80	0	0	110	L636 I645 F648 F649	M633-L636 HydrophobicContact CB-CD1 4.08Å; M633-L636 HydrophobicContact CB-CG 4.38Å; M633-L636 HydrophobicContact CE-CD2 4.39Å; M633-I645 HydrophobicContact SD-CG2 4.26Å; M633-F648 HydrophobicContact CE-CB 4.47Å; M633-F648 HydrophobicContact CE-CD1 3.55Å; M633-F648 HydrophobicContact CE-CD2 4.08Å; M633-F648 HydrophobicContact CE-CE1 3.67Å; M633-F648 HydrophobicContact CE-CE2 4.19Å; M633-F648 HydrophobicContact CE-CG 3.76Å; M633-F648 HydrophobicContact CE-CZ 4Å; M633-F648 HydrophobicContact SD-CD1 4.08Å; M633-F648 HydrophobicContact SD-CE1 4.39Å; M633-F649 HydrophobicContact CG-CZ 4.42Å; M633-F649 HydrophobicContact SD-CE2 3.66Å; M633-F649 HydrophobicContact SD-CZ 3.9Å
634	Q	69.6	Low	63.6	Low	162 Å²	162	117.4 Å²	117.4	76%	0.757	66%	0.66	S	S	*	*			trans	-110.5	141.9	175.5	-65	-174.7	7	0	0	109.7
635	G	69	Low	65.7	Low	85 Å²	85	113.9 Å²	113.9	88%	0.876	64%	0.635	S	S	*	*			trans	92.7	15.2	176.1	0	0	0	0	0	116.1
636	L	73.9	Confident	67.6	Low	84 Å²	84	110.9 Å²	110.9	44%	0.44	61%	0.612	S	S	.	*			trans	-69.8	140.3	172	-65	176.1	0	0	0	110.8	M633 T640 I645	M633-L636 HydrophobicContact CB-CD1 4.08Å; M633-L636 HydrophobicContact CB-CG 4.38Å; M633-L636 HydrophobicContact CE-CD2 4.39Å; L636-T640 HydrophobicContact CD2-CG2 4.32Å; L636-I645 HydrophobicContact CD1-CD1 4.03Å; L636-I645 HydrophobicContact CD1-CG1 3.99Å
637	A	73.4	Confident	69.4	Low	58 Å²	58	106.2 Å²	106.2	48%	0.479	59%	0.593	S	S	.	*			trans	-66.2	147.6	174.4	0	0	0	0	0	110.3	N639 T640	A637-N639 VanDerWaalsContact CB-OD1 3.31Å; A637-N639 WeakPolarHBondContact CB-OD1 3.47Å; A637-N639 PolarHBondContact O-N 3.49Å; A637-T640 PolarHBondContact N-OG1 2.95Å; A637-T640 WeakPolarHBondContact O-CB 3.44Å; A637-T640 PolarHBondContact O-N 3.01Å; A637-T640 PolarHBondContact O-OG1 3.09Å
638	Y	69.1	Low	71	Confident	251 Å²	251	106.6 Å²	106.6	98%	0.984	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-18.8	-172.6	-152.4	-88.3	0	0	0	113.9
639	N	77.6	Confident	71.9	Confident	140 Å²	140	105 Å²	105	75%	0.749	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	4	177.6	65.1	-26.3	0	0	0	114.2	A637 G641	A637-N639 VanDerWaalsContact CB-OD1 3.31Å; A637-N639 WeakPolarHBondContact CB-OD1 3.47Å; A637-N639 PolarHBondContact O-N 3.49Å; N639-G641 PolarHBondContact O-N 3.44Å
640	T	77.2	Confident	72.3	Confident	40 Å²	40	106 Å²	106	25%	0.245	55%	0.55	C	S	.	*			trans	-64.6	118.9	-178.3	-49.1	0	0	0	0	109.9	L636 A637 E644 I645	L636-T640 HydrophobicContact CD2-CG2 4.32Å; A637-T640 PolarHBondContact N-OG1 2.95Å; A637-T640 WeakPolarHBondContact O-CB 3.44Å; A637-T640 PolarHBondContact O-N 3.01Å; A637-T640 PolarHBondContact O-OG1 3.09Å; T640-E644 WeakPolarHBondContact CA-OE2 2.86Å; T640-E644 HydrophobicContact CG2-CB 4.06Å; T640-E644 WeakPolarHBondContact CG2-OE2 3.02Å; T640-I645 HydrophobicContact CG2-CD1 4.4Å; T640-I645 HydrophobicContact CG2-CG1 3.97Å
641	G	78.8	Confident	72.3	Confident	30 Å²	30	103.2 Å²	103.2	31%	0.309	55%	0.55	S	S	.	.			trans	-81.3	154.2	-177.4	0	0	0	0	0	112.8	N639 K643 E644 I645	N639-G641 PolarHBondContact O-N 3.44Å; G641-K643 PolarHBondContact O-N 3.24Å; G641-K643 VanDerWaalsContact O-N 3.08Å; G641-E644 PolarHBondContact N-OE2 3.42Å; G641-E644 WeakPolarHBondContact O-CB 3.48Å; G641-E644 PolarHBondContact O-N 3.17Å; G641-I645 PolarHBondContact O-N 3.34Å
642	V	75.3	Confident	72.6	Confident	79 Å²	79	107.4 Å²	107.4	48%	0.479	56%	0.557	S	S	.	*	H	α-helix	trans	-53.4	-34.1	176.1	179.9	0	0	0	0	112	E644 I645 L646 W659	V642-E644 PolarHBondContact O-N 3.31Å; V642-I645 PolarHBondContact O-N 3.27Å; V642-L646 HydrophobicContact CG1-CD1 3.95Å; V642-L646 HydrophobicContact CG1-CG 4.33Å; V642-L646 WeakPolarHBondContact O-CB 3.18Å; V642-L646 WeakPolarHBondContact O-CG 3.23Å; V642-L646 PolarHBondContact O-N 2.84Å; V642-W659 HydrophobicContact CG1-CD2 4.32Å
643	K	75.1	Confident	72.2	Confident	165 Å²	165	108 Å²	108	72%	0.717	57%	0.568	S	S	*	*	H	α-helix	trans	-64.4	-35.8	177.5	-169	178.3	178.5	-176.4	0	113.1	G641 N647	G641-K643 PolarHBondContact O-N 3.24Å; G641-K643 VanDerWaalsContact O-N 3.08Å; K643-N647 PolarHBondContact O-N 2.91Å
644	E	75.6	Confident	71.9	Confident	121 Å²	121	107.9 Å²	107.9	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-74	-38.9	178.6	-66	170.9	158.6	0	0	111	T640 G641 V642 N647 F648	T640-E644 WeakPolarHBondContact CA-OE2 2.86Å; T640-E644 HydrophobicContact CG2-CB 4.06Å; T640-E644 WeakPolarHBondContact CG2-OE2 3.02Å; G641-E644 PolarHBondContact N-OE2 3.42Å; G641-E644 WeakPolarHBondContact O-CB 3.48Å; G641-E644 PolarHBondContact O-N 3.17Å; V642-E644 PolarHBondContact O-N 3.31Å; E644-N647 PolarHBondContact O-N 3.41Å; E644-F648 PolarHBondContact O-N 3.29Å; E644-F648 VanDerWaalsContact O-N 3.14Å
645	I	77.9	Confident	71.4	Confident	32 Å²	32	107.3 Å²	107.3	16%	0.164	57%	0.574	C	S	.	*	H	α-helix	trans	-64.4	-43.2	174	-62.5	161.4	0	0	0	110.6	M633 L636 T640 G641 V642 N647 F648 F649 W659	M633-I645 HydrophobicContact SD-CG2 4.26Å; L636-I645 HydrophobicContact CD1-CD1 4.03Å; L636-I645 HydrophobicContact CD1-CG1 3.99Å; T640-I645 HydrophobicContact CG2-CD1 4.4Å; T640-I645 HydrophobicContact CG2-CG1 3.97Å; G641-I645 PolarHBondContact O-N 3.34Å; V642-I645 PolarHBondContact O-N 3.27Å; I645-N647 VanDerWaalsContact C-N 3.34Å; I645-N647 PolarHBondContact O-N 3Å; I645-F648 VanDerWaalsContact O-CB 3.32Å; I645-F648 WeakPolarHBondContact O-CB 3.42Å; I645-F648 PolarHBondContact O-N 2.93Å; I645-F648 VanDerWaalsContact O-N 3.15Å; I645-F649 HydrophobicContact CG2-CD2 4.47Å; I645-F649 HydrophobicContact CG2-CE2 4.27Å; I645-F649 WeakPolarHBondContact O-CD2 3.26Å; I645-W659 HydrophobicContact CG2-CH2 3.94Å; I645-W659 HydrophobicContact CG2-CZ3 4.02Å
646	L	74.6	Confident	70.6	Confident	67 Å²	67	111.8 Å²	111.8	35%	0.351	57%	0.569	S	S	.	*	H	α-helix	trans	-65.5	-35.7	176.8	-76.7	172.1	0	0	0	112.7	V642 F648 F649 Q650 W659	V642-L646 HydrophobicContact CG1-CD1 3.95Å; V642-L646 HydrophobicContact CG1-CG 4.33Å; V642-L646 WeakPolarHBondContact O-CB 3.18Å; V642-L646 WeakPolarHBondContact O-CG 3.23Å; V642-L646 PolarHBondContact O-N 2.84Å; L646-F648 VanDerWaalsContact C-N 3.28Å; L646-F648 PolarHBondContact O-N 3.28Å; L646-F649 CarbonylContact O-C 3.55Å; L646-F649 PolarHBondContact O-N 3.18Å; L646-F649 VanDerWaalsContact O-N 3.14Å; L646-Q650 PolarHBondContact O-N 2.65Å; L646-W659 HydrophobicContact CD2-CH2 4.16Å; L646-W659 HydrophobicContact CD2-CZ2 3.56Å; L646-W659 HydrophobicContact CG-CH2 4.42Å; L646-W659 HydrophobicContact CG-CZ2 4.03Å
647	N	75.9	Confident	69.4	Low	89 Å²	89	115.3 Å²	115.3	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-31.5	172.5	-87.8	2.3	0	0	0	112.4	K643 E644 I645 F649 Q650	K643-N647 PolarHBondContact O-N 2.91Å; E644-N647 PolarHBondContact O-N 3.41Å; I645-N647 VanDerWaalsContact C-N 3.34Å; I645-N647 PolarHBondContact O-N 3Å; N647-F649 PolarHBondContact O-N 3Å; N647-Q650 WeakPolarHBondContact O-CB 3.3Å; N647-Q650 PolarHBondContact O-N 3.46Å
648	F	77.4	Confident	68.3	Low	138 Å²	138	118.7 Å²	118.7	61%	0.605	60%	0.603	S	S	*	*	H	α-helix	trans	-62.4	-31.2	173.3	-179.1	-92.7	0	0	0	112.2	M633 E644 I645 L646	M633-F648 HydrophobicContact CE-CB 4.47Å; M633-F648 HydrophobicContact CE-CD1 3.55Å; M633-F648 HydrophobicContact CE-CD2 4.08Å; M633-F648 HydrophobicContact CE-CE1 3.67Å; M633-F648 HydrophobicContact CE-CE2 4.19Å; M633-F648 HydrophobicContact CE-CG 3.76Å; M633-F648 HydrophobicContact CE-CZ 4Å; M633-F648 HydrophobicContact SD-CD1 4.08Å; M633-F648 HydrophobicContact SD-CE1 4.39Å; E644-F648 PolarHBondContact O-N 3.29Å; E644-F648 VanDerWaalsContact O-N 3.14Å; I645-F648 VanDerWaalsContact O-CB 3.32Å; I645-F648 WeakPolarHBondContact O-CB 3.42Å; I645-F648 PolarHBondContact O-N 2.93Å; I645-F648 VanDerWaalsContact O-N 3.15Å; L646-F648 VanDerWaalsContact C-N 3.28Å; L646-F648 PolarHBondContact O-N 3.28Å
649	F	73.8	Confident	67.1	Low	38 Å²	38	116 Å²	116	17%	0.167	59%	0.591	C	S	.	*	T	Hydrogen-bonded Turn	trans	-99	18.5	177.7	-64.2	-74.6	0	0	0	113.8	V631 M633 I645 L646 N647 G651 Y652	V631-F649 HydrophobicContact CB-CE1 4.39Å; V631-F649 HydrophobicContact CB-CZ 4.14Å; V631-F649 HydrophobicContact CG1-CE1 4.19Å; V631-F649 HydrophobicContact CG1-CZ 3.86Å; V631-F649 HydrophobicContact CG2-CE1 4.42Å; M633-F649 HydrophobicContact CG-CZ 4.42Å; M633-F649 HydrophobicContact SD-CE2 3.66Å; M633-F649 HydrophobicContact SD-CZ 3.9Å; I645-F649 HydrophobicContact CG2-CD2 4.47Å; I645-F649 HydrophobicContact CG2-CE2 4.27Å; I645-F649 WeakPolarHBondContact O-CD2 3.26Å; L646-F649 CarbonylContact O-C 3.55Å; L646-F649 PolarHBondContact O-N 3.18Å; L646-F649 VanDerWaalsContact O-N 3.14Å; N647-F649 PolarHBondContact O-N 3Å; F649-G651 PolarHBondContact O-N 3.08Å; F649-Y652 HydrophobicContact CB-CD2 4.48Å; F649-Y652 HydrophobicContact CD1-CD2 4.41Å; F649-Y652 PolarHBondContact O-N 2.98Å
650	Q	64.4	Low	66.6	Low	157 Å²	157	114.8 Å²	114.8	73%	0.734	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	115.8	177.6	-133.7	176.4	8.5	0	0	109.9	L646 N647	L646-Q650 PolarHBondContact O-N 2.65Å; N647-Q650 WeakPolarHBondContact O-CB 3.3Å; N647-Q650 PolarHBondContact O-N 3.46Å
651	G	63.3	Low	66	Low	82 Å²	82	118.7 Å²	118.7	85%	0.845	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.9	-10.1	-174.1	0	0	0	0	0	114.8	F649	F649-G651 PolarHBondContact O-N 3.08Å
652	Y	66.8	Low	65.3	Low	179 Å²	179	123.7 Å²	123.7	70%	0.702	62%	0.617	S	S	*	*	S	Bend	trans	-105.2	143.6	172.8	-62.3	-86	0	0	0	111.1	F649 C654	F649-Y652 HydrophobicContact CB-CD2 4.48Å; F649-Y652 HydrophobicContact CD1-CD2 4.41Å; F649-Y652 PolarHBondContact O-N 2.98Å; Y652-C654 PolarHBondContact O-N 2.91Å; Y652-C654 VanDerWaalsContact O-N 3.09Å
653	Q	60.6	Low	64.7	Low	208 Å²	208	126.3 Å²	126.3	97%	0.972	63%	0.625	S	S	*	*			trans	-75.4	94.8	172.4	-80.6	-178.1	-9.4	0	0	109.8
654	C	60.9	Low	64.1	Low	60 Å²	60	123.9 Å²	123.9	41%	0.405	62%	0.62	S	S	.	*			trans	-89.6	131.8	174.2	-61.1	0	0	0	0	111.1	Y652	Y652-C654 PolarHBondContact O-N 2.91Å; Y652-C654 VanDerWaalsContact O-N 3.09Å
655	L	58.1	Low	63.3	Low	150 Å²	150	124.1 Å²	124.1	79%	0.785	62%	0.623	S	S	*	*			trans	-72.6	127.2	170.8	-77.1	161.2	0	0	0	109.3	D657	L655-D657 VanDerWaalsContact C-N 3.34Å; L655-D657 PolarHBondContact O-N 2.58Å
656	K	52	Low	62.3	Low	180 Å²	180	130.6 Å²	130.6	78%	0.783	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-13.3	-171.2	-78.5	-178	176.2	177.9	0	115
657	D	48.5	Very low	61.3	Low	157 Å²	157	135.5 Å²	135.5	84%	0.84	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	19	-161.9	-62.9	-25.5	0	0	0	115.5	L655	L655-D657 VanDerWaalsContact C-N 3.34Å; L655-D657 PolarHBondContact O-N 2.58Å
658	V	52.1	Low	60.1	Low	129 Å²	129	139.4 Å²	139.4	78%	0.782	70%	0.697	S	S	*	*			trans	-136.5	92.2	172.5	-170.4	0	0	0	0	108.8
659	W	43.1	Very low	58.5	Low	195 Å²	195	139.5 Å²	139.5	74%	0.739	71%	0.705	S	S	*	*			trans	-126.6	0	170.8	-70.5	97.2	0	0	0	110	V642 I645 L646	V642-W659 HydrophobicContact CG1-CD2 4.32Å; I645-W659 HydrophobicContact CG2-CH2 3.94Å; I645-W659 HydrophobicContact CG2-CZ3 4.02Å; L646-W659 HydrophobicContact CD2-CH2 4.16Å; L646-W659 HydrophobicContact CD2-CZ2 3.56Å; L646-W659 HydrophobicContact CG-CH2 4.42Å; L646-W659 HydrophobicContact CG-CZ2 4.03Å

Retrieved 659 of 659 residues in 151.9 ms (Link to these results)

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