A0A087XG62_POEFO Loading...

Leucine rich repeat containing 61

AlphaFold DB , UniProt , Accession A0A087XG62, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 261 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	39.4	Very low	227 Å²	227	182.1 Å²	182.1	100%	1.118	90%	0.899	S	S	*	*				0	57.7	0	-63.8	-150.5	-118.2	0	0	107.8
2	D	43	Very low	40.8	Very low	160 Å²	160	180 Å²	180	86%	0.856	89%	0.885	S	S	*	*				52.1	77.4	66.4	-58.7	-56.4	0	0	0	112.6
3	C	35.6	Very low	42.6	Very low	128 Å²	128	168.4 Å²	168.4	87%	0.865	83%	0.832	S	S	*	*			trans	-170.5	49.2	151.5	-136.3	0	0	0	0	112.1
4	K	38.4	Very low	45.8	Very low	210 Å²	210	163.7 Å²	163.7	91%	0.913	81%	0.807	S	S	*	*	S	Bend	trans	-140.4	26.1	177.9	-79.6	-163.7	177.2	-176	0	115.2
5	R	41.7	Very low	49	Very low	236 Å²	236	159.5 Å²	159.5	89%	0.891	78%	0.782	S	S	*	*	S	Bend	trans	-136.8	73.1	173.9	-69.5	-174.4	-166.4	172.5	4.6	110.4
6	E	39.8	Very low	51.9	Low	192 Å²	192	149.6 Å²	149.6	90%	0.897	73%	0.734	S	S	*	*	S	Bend	trans	-165.2	16.1	170.4	-114.6	160.1	-140	0	0	115.9
7	K	34.6	Very low	54.4	Low	208 Å²	208	144.2 Å²	144.2	90%	0.904	71%	0.712	S	S	*	*	S	Bend	trans	-134	23.4	-175.5	-76	-165.6	175.4	-175.3	0	117.3
8	E	36.5	Very low	56.6	Low	199 Å²	199	139.3 Å²	139.3	93%	0.93	70%	0.698	S	S	*	*	S	Bend	trans	-128.7	17	-179.3	-75.3	-177.7	168.8	0	0	115.3
9	Q	40	Very low	58.5	Low	187 Å²	187	139.3 Å²	139.3	87%	0.874	70%	0.699	S	S	*	*			trans	-114.1	5.2	-172	-100.1	179.9	20.3	0	0	118.3
10	D	41	Very low	60.2	Low	163 Å²	163	133.2 Å²	133.2	87%	0.872	67%	0.669	S	S	*	*			trans	-111.4	53.7	177.3	-64.7	-34.6	0	0	0	111.6	E12	D10-E12 PolarHBondContact O-N 3.13Å
11	A	46.2	Very low	61.7	Low	93 Å²	93	126.9 Å²	126.9	77%	0.769	64%	0.637	S	S	*	*			trans	-71.6	106	158.3	0	0	0	0	0	106.8	C13	A11-C13 PolarHBondContact O-N 2.91Å
12	E	56.2	Low	64.4	Low	157 Å²	157	120.5 Å²	120.5	73%	0.734	60%	0.603	S	S	*	*			trans	-43.4	108.7	169.3	-76.9	177.2	138.5	0	0	108.3	D10 E14	D10-E12 PolarHBondContact O-N 3.13Å; E12-E14 HydrophobicContact CB-CG 4.38Å; E12-E14 PolarHBondContact O-N 3.21Å
13	C	65	Low	66.7	Low	29 Å²	29	116.8 Å²	116.8	20%	0.196	59%	0.589	C	S	.	*			trans	-82.1	77.2	-177.7	-162.1	0	0	0	0	107.5	A11 K15 L20 L41 I43	A11-C13 PolarHBondContact O-N 2.91Å; C13-K15 PolarHBondContact O-N 2.97Å; C13-L20 WeakPolarHBondContact SG-CD2 3.4Å; C13-L41 HydrophobicContact CB-CB 4.45Å; C13-L41 PolarHBondContact N-O 3.33Å; C13-I43 VanDerWaalsContact O-CA 3.27Å; C13-I43 WeakPolarHBondContact O-CA 3.17Å; C13-I43 WeakPolarHBondContact O-CG1 3.27Å; C13-I43 PolarHBondContact O-N 2.9Å
14	E	87.2	Confident	69.2	Low	103 Å²	103	117.4 Å²	117.4	48%	0.481	57%	0.574	S	S	.	*			trans	-60.3	-31.4	-175.6	-83.6	-170.4	176.9	0	0	112.9	E12 H44 D45	E12-E14 HydrophobicContact CB-CG 4.38Å; E12-E14 PolarHBondContact O-N 3.21Å; E14-H44 WeakPolarHBondContact CB-CE1 3.4Å; E14-H44 PolarHBondContact O-CD2 2.91Å; E14-H44 VanDerWaalsContact O-CG 3.3Å; E14-H44 PolarHBondContact O-N 3.09Å; E14-H44 PolarHBondContact O-ND1 3.48Å; E14-H44 IonicContact OE2-CE1 2.75Å; E14-H44 PolarHBondContact OE2-CE1 3.26Å; E14-D45 PolarHBondContact O-N 2.92Å
15	K	94.4	Very high	71.5	Confident	100 Å²	100	109.3 Å²	109.3	44%	0.435	54%	0.542	S	S	.	.	B	Isolated β-bridge	trans	-134.6	138.6	-174.7	-178.8	170.3	-177.1	138	0	112.7	C13 T17 D45	C13-K15 PolarHBondContact O-N 2.97Å; K15-T17 PolarHBondContact O-N 2.68Å; K15-D45 CarbonylContact C-O 3.43Å; K15-D45 VanDerWaalsContact CA-O 3.31Å; K15-D45 WeakPolarHBondContact CA-O 3.31Å; K15-D45 HydrophobicContact CB-CB 4.05Å; K15-D45 HydrophobicContact CD-CB 4.33Å; K15-D45 VanDerWaalsContact CD-OD2 3.22Å; K15-D45 WeakPolarHBondContact CD-OD2 3.45Å; K15-D45 WeakPolarHBondContact CE-OD2 3.4Å; K15-D45 HydrophobicContact CG-CB 3.91Å; K15-D45 IonicContact NZ-OD2 3.41Å; K15-D45 PolarHBondContact NZ-OD2 3.16Å
16	V	94.8	Very high	73.6	Confident	1 Å²	1	100.3 Å²	100.3	1%	0.006	52%	0.523	C	S	.	.			trans	-71	116.5	170.2	-177.7	0	0	0	0	109.8	L21 L38 I43 D45 L46 G47 C48 I49	V16-L21 HydrophobicContact CG1-CD1 4.05Å; V16-L21 HydrophobicContact CG1-CD2 3.67Å; V16-L21 HydrophobicContact CG1-CG 3.84Å; V16-L38 HydrophobicContact CG1-CD1 4.34Å; V16-L38 HydrophobicContact CG2-CD1 4.01Å; V16-I43 HydrophobicContact CG2-CD1 4.11Å; V16-I43 HydrophobicContact CG2-CG2 3.83Å; V16-D45 PolarHBondContact N-O 2.94Å; V16-L46 WeakPolarHBondContact CB-O 3.3Å; V16-G47 WeakPolarHBondContact O-CA 3.32Å; V16-C48 PolarHBondContact O-N 3.28Å; V16-I49 HydrophobicContact CG1-CB 4.35Å
17	T	95.1	Very high	75.7	Confident	59 Å²	59	95.3 Å²	95.3	36%	0.362	50%	0.499	S	S	.	.			trans	-118.6	158.8	177.9	60.9	0	0	0	0	110.8	K15 L19 L20 L21 C48	K15-T17 PolarHBondContact O-N 2.68Å; T17-L19 PolarHBondContact O-N 3.25Å; T17-L20 WeakPolarHBondContact O-CB 3.43Å; T17-L20 PolarHBondContact O-N 2.89Å; T17-L20 PolarHBondContact OG1-N 3.4Å; T17-L21 WeakPolarHBondContact O-CG 3.43Å; T17-L21 PolarHBondContact O-N 3.21Å; T17-C48 VanDerWaalsContact C-SG 3.53Å
18	A	93.1	Very high	78	Confident	55 Å²	55	92.9 Å²	92.9	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-57.7	-33.7	175.7	0	0	0	0	0	112.4	L21 K22 C48	A18-L21 PolarHBondContact O-N 3.49Å; A18-K22 VanDerWaalsContact O-CB 3.3Å; A18-K22 WeakPolarHBondContact O-CB 3.35Å; A18-K22 PolarHBondContact O-N 3.05Å; A18-C48 PolarHBondContact N-SG 3.42Å; A18-C48 VanDerWaalsContact N-SG 3.37Å
19	L	92.1	Very high	80.7	Confident	139 Å²	139	89 Å²	89	73%	0.728	48%	0.475	S	S	*	.	H	α-helix	trans	-65.2	-43.5	174.7	-68.7	175.9	0	0	0	112.1	T17 S23	T17-L19 PolarHBondContact O-N 3.25Å; L19-S23 WeakPolarHBondContact O-CB 3.46Å; L19-S23 PolarHBondContact O-N 3.44Å
20	L	92.8	Very high	83.1	Confident	18 Å²	18	81.6 Å²	81.6	9%	0.094	44%	0.441	C	S	.	.	H	α-helix	trans	-60	-49.1	174	177.8	69.8	0	0	0	110.3	C13 T17 K22 S23 R24 L38 I43	C13-L20 WeakPolarHBondContact SG-CD2 3.4Å; T17-L20 WeakPolarHBondContact O-CB 3.43Å; T17-L20 PolarHBondContact O-N 2.89Å; T17-L20 PolarHBondContact OG1-N 3.4Å; L20-K22 PolarHBondContact O-N 2.85Å; L20-S23 PolarHBondContact O-N 3.17Å; L20-S23 VanDerWaalsContact O-N 3.16Å; L20-S23 PolarHBondContact O-OG 3.15Å; L20-R24 HydrophobicContact CD1-CG 4.29Å; L20-R24 WeakPolarHBondContact O-CG 3.27Å; L20-R24 PolarHBondContact O-N 3.44Å; L20-R24 VanDerWaalsContact O-N 3.09Å; L20-L38 HydrophobicContact CD2-CD1 4.48Å; L20-L38 HydrophobicContact CD2-CD2 4.08Å; L20-L38 HydrophobicContact CG-CD2 4.32Å; L20-I43 HydrophobicContact CD2-CD1 4.48Å
21	L	93.3	Very high	85.6	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-58.7	-51	-179.2	-65.7	-179.7	0	0	0	110.8	V16 T17 A18 S23 R24 T25 L30 I33 L36 L38	V16-L21 HydrophobicContact CG1-CD1 4.05Å; V16-L21 HydrophobicContact CG1-CD2 3.67Å; V16-L21 HydrophobicContact CG1-CG 3.84Å; T17-L21 WeakPolarHBondContact O-CG 3.43Å; T17-L21 PolarHBondContact O-N 3.21Å; A18-L21 PolarHBondContact O-N 3.49Å; L21-S23 VanDerWaalsContact C-N 3.29Å; L21-S23 PolarHBondContact O-N 3.33Å; L21-R24 PolarHBondContact O-N 2.96Å; L21-T25 PolarHBondContact O-N 2.92Å; L21-T25 PolarHBondContact O-OG1 2.86Å; L21-L30 HydrophobicContact CB-CD2 4.33Å; L21-L30 HydrophobicContact CD1-CD2 3.62Å; L21-I33 HydrophobicContact CB-CD1 4.17Å; L21-I33 HydrophobicContact CD1-CD1 4.48Å; L21-L36 HydrophobicContact CD2-CD1 3.83Å; L21-L36 HydrophobicContact CD2-CD2 3.48Å; L21-L36 VanDerWaalsContact CD2-CD2 3.48Å; L21-L36 HydrophobicContact CD2-CG 4.3Å; L21-L38 HydrophobicContact CD2-CD1 4.25Å
22	K	91.4	Very high	87.8	Confident	94 Å²	94	77.6 Å²	77.6	41%	0.409	41%	0.406	S	S	.	.	H	α-helix	trans	-55.7	-41.7	175.1	-177.6	176.2	179.2	178.9	0	112.7	A18 L20 R24 G26 F28	A18-K22 VanDerWaalsContact O-CB 3.3Å; A18-K22 WeakPolarHBondContact O-CB 3.35Å; A18-K22 PolarHBondContact O-N 3.05Å; L20-K22 PolarHBondContact O-N 2.85Å; K22-R24 PolarHBondContact O-N 3.4Å; K22-G26 VanDerWaalsContact O-CA 3.31Å; K22-G26 WeakPolarHBondContact O-CA 3.38Å; K22-G26 PolarHBondContact O-N 3.41Å; K22-F28 HydrophobicContact CD-CD1 4.4Å
23	S	91.3	Very high	89.5	Confident	81 Å²	81	70.2 Å²	70.2	57%	0.566	37%	0.372	S	S	*	.	H	α-helix	trans	-66.4	-25.1	178.3	78.5	0	0	0	0	113.5	L19 L20 L21	L19-S23 WeakPolarHBondContact O-CB 3.46Å; L19-S23 PolarHBondContact O-N 3.44Å; L20-S23 PolarHBondContact O-N 3.17Å; L20-S23 VanDerWaalsContact O-N 3.16Å; L20-S23 PolarHBondContact O-OG 3.15Å; L21-S23 VanDerWaalsContact C-N 3.29Å; L21-S23 PolarHBondContact O-N 3.33Å
24	R	88.5	Confident	90.8	Very high	142 Å²	142	72.1 Å²	72.1	54%	0.536	38%	0.38	S	S	.	.	H	α-helix	trans	-96.4	-35.1	-176.6	-67.9	-65.8	180	-138.8	2.2	113.2	L20 L21 K22 L38	L20-R24 HydrophobicContact CD1-CG 4.29Å; L20-R24 WeakPolarHBondContact O-CG 3.27Å; L20-R24 PolarHBondContact O-N 3.44Å; L20-R24 VanDerWaalsContact O-N 3.09Å; L21-R24 PolarHBondContact O-N 2.96Å; K22-R24 PolarHBondContact O-N 3.4Å; R24-L38 HydrophobicContact CB-CD2 4.46Å; R24-L38 HydrophobicContact CG-CD2 3.9Å
25	T	86.9	Confident	91.1	Very high	40 Å²	40	72.3 Å²	72.3	25%	0.245	38%	0.379	C	S	.	.	H	α-helix	trans	-102.5	-26.7	-175.7	62.7	0	0	0	0	112.6	L21 E27 I33 L36	L21-T25 PolarHBondContact O-N 2.92Å; L21-T25 PolarHBondContact O-OG1 2.86Å; T25-E27 PolarHBondContact O-N 3.16Å; T25-E27 WeakPolarHBondContact OG1-CB 3.16Å; T25-E27 PolarHBondContact OG1-N 3.35Å; T25-E27 VanDerWaalsContact OG1-N 3.16Å; T25-I33 HydrophobicContact CG2-CD1 4.12Å; T25-I33 HydrophobicContact CG2-CG1 4.22Å; T25-I33 HydrophobicContact CG2-CG2 3.91Å; T25-L36 HydrophobicContact CG2-CD1 3.8Å
26	G	85.3	Confident	91	Very high	47 Å²	47	67.7 Å²	67.7	49%	0.485	36%	0.359	S	S	.	.			trans	75.4	-3.6	-168.5	0	0	0	0	0	113.8	K22	K22-G26 VanDerWaalsContact O-CA 3.31Å; K22-G26 WeakPolarHBondContact O-CA 3.38Å; K22-G26 PolarHBondContact O-N 3.41Å
27	E	84.2	Confident	91	Very high	86 Å²	86	75.3 Å²	75.3	40%	0.402	39%	0.392	S	S	.	.			trans	-79.9	140.8	179.4	-63	-62.2	153.5	0	0	110.7	T25 S32 I33	T25-E27 PolarHBondContact O-N 3.16Å; T25-E27 WeakPolarHBondContact OG1-CB 3.16Å; T25-E27 PolarHBondContact OG1-N 3.35Å; T25-E27 VanDerWaalsContact OG1-N 3.16Å; E27-S32 WeakPolarHBondContact CB-OG 3.44Å; E27-S32 VanDerWaalsContact CD-OG 3.28Å; E27-S32 WeakPolarHBondContact CG-OG 3.29Å; E27-S32 WeakPolarHBondContact OE2-CB 3.31Å; E27-S32 PolarHBondContact OE2-OG 2.94Å; E27-I33 HydrophobicContact CB-CD1 4.49Å; E27-I33 HydrophobicContact CB-CG1 3.86Å; E27-I33 HydrophobicContact CG-CG1 4.11Å
28	F	83.3	Confident	90.9	Very high	157 Å²	157	72.5 Å²	72.5	69%	0.689	38%	0.375	S	S	*	.	S	Bend	trans	-93.9	-32.6	178.8	-69.1	-103.6	0	0	0	111.7	K22	K22-F28 HydrophobicContact CD-CD1 4.4Å
29	D	92.2	Very high	90.8	Very high	118 Å²	118	75.9 Å²	75.9	63%	0.631	38%	0.376	S	S	*	.	S	Bend	trans	-98.6	134.3	177.3	-61.4	-39	0	0	0	109.8	E31 S32	D29-E31 PolarHBondContact O-N 3.49Å; D29-S32 PolarHBondContact O-N 2.66Å; D29-S32 PolarHBondContact O-OG 3.5Å
30	L	91.7	Very high	90.9	Very high	32 Å²	32	74 Å²	74	17%	0.168	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-68.5	-28.1	-179.5	-60.8	-176.9	0	0	0	112	L21 S32 I33 C48 E51 C52	L21-L30 HydrophobicContact CB-CD2 4.33Å; L21-L30 HydrophobicContact CD1-CD2 3.62Å; L30-S32 VanDerWaalsContact C-N 3.29Å; L30-S32 PolarHBondContact O-N 3.21Å; L30-I33 HydrophobicContact CD2-CD1 4.11Å; L30-I33 PolarHBondContact O-N 3.21Å; L30-C48 HydrophobicContact CD1-CB 4.44Å; L30-E51 HydrophobicContact CB-CB 4.42Å; L30-E51 HydrophobicContact CD1-CB 3.64Å; L30-E51 HydrophobicContact CD1-CG 4.46Å; L30-E51 VanDerWaalsContact CD1-OE2 3.28Å; L30-E51 WeakPolarHBondContact CD1-OE2 3.37Å; L30-C52 WeakPolarHBondContact O-CA 3.49Å
31	E	92.4	Very high	90.9	Very high	124 Å²	124	75 Å²	75	58%	0.579	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-71.6	-18.7	179.6	-58.7	-172	-176.2	0	0	113.5	D29 I33 V53 N54	D29-E31 PolarHBondContact O-N 3.49Å; E31-I33 VanDerWaalsContact C-N 3.31Å; E31-V53 HydrophobicContact CG-CG2 4.13Å; E31-N54 WeakPolarHBondContact O-CB 3.44Å; E31-N54 PolarHBondContact O-ND2 2.8Å
32	S	92.8	Very high	90.9	Very high	47 Å²	47	76.2 Å²	76.2	33%	0.329	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-82	-11.1	176.5	67.3	0	0	0	0	113	E27 D29 L30 L34	E27-S32 WeakPolarHBondContact CB-OG 3.44Å; E27-S32 VanDerWaalsContact CD-OG 3.28Å; E27-S32 WeakPolarHBondContact CG-OG 3.29Å; E27-S32 WeakPolarHBondContact OE2-CB 3.31Å; E27-S32 PolarHBondContact OE2-OG 2.94Å; D29-S32 PolarHBondContact O-N 2.66Å; D29-S32 PolarHBondContact O-OG 3.5Å; L30-S32 VanDerWaalsContact C-N 3.29Å; L30-S32 PolarHBondContact O-N 3.21Å; S32-L34 PolarHBondContact O-N 3.33Å; S32-L34 VanDerWaalsContact O-N 3.16Å
33	I	92.8	Very high	91.1	Very high	3 Å²	3	71.8 Å²	71.8	2%	0.015	37%	0.368	C	S	.	.			trans	-77.5	105.5	-176.6	-56	173.8	0	0	0	110.2	L21 T25 E27 L30 E31 L36 L55	L21-I33 HydrophobicContact CB-CD1 4.17Å; L21-I33 HydrophobicContact CD1-CD1 4.48Å; T25-I33 HydrophobicContact CG2-CD1 4.12Å; T25-I33 HydrophobicContact CG2-CG1 4.22Å; T25-I33 HydrophobicContact CG2-CG2 3.91Å; E27-I33 HydrophobicContact CB-CD1 4.49Å; E27-I33 HydrophobicContact CB-CG1 3.86Å; E27-I33 HydrophobicContact CG-CG1 4.11Å; L30-I33 HydrophobicContact CD2-CD1 4.11Å; L30-I33 PolarHBondContact O-N 3.21Å; E31-I33 VanDerWaalsContact C-N 3.31Å; I33-L36 HydrophobicContact CG2-CB 4.23Å; I33-L55 HydrophobicContact CG2-CD1 3.8Å; I33-L55 WeakPolarHBondContact O-CA 3.36Å; I33-L55 PolarHBondContact O-N 2.74Å
34	L	91.5	Very high	91.3	Very high	69 Å²	69	71.8 Å²	71.8	36%	0.361	36%	0.359	S	S	.	.			trans	-92.2	-30.9	175	-56.4	-179.4	0	0	0	113	S32 N54 E56 R57	S32-L34 PolarHBondContact O-N 3.33Å; S32-L34 VanDerWaalsContact O-N 3.16Å; L34-N54 HydrophobicContact CD2-CB 3.91Å; L34-N54 VanDerWaalsContact CD2-O 3.28Å; L34-N54 WeakPolarHBondContact CD2-O 3.22Å; L34-E56 PolarHBondContact O-N 2.96Å; L34-R57 PolarHBondContact O-N 2.85Å; L34-R57 VanDerWaalsContact O-N 3.13Å
35	F	93.3	Very high	91.6	Very high	106 Å²	106	67.5 Å²	67.5	47%	0.465	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.5	-174.4	-49.8	-62.1	0	0	0	110.5	E56 R57	F35-E56 HydrophobicContact CE1-CB 4.23Å; F35-R57 WeakPolarHBondContact CA-O 3.26Å; F35-R57 HydrophobicContact CD1-CB 3.81Å; F35-R57 HydrophobicContact CD1-CG 3.66Å; F35-R57 HydrophobicContact CE1-CB 4.44Å; F35-R57 HydrophobicContact CE1-CG 3.78Å
36	L	92.9	Very high	92.1	Very high	4 Å²	4	65.7 Å²	65.7	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	128.8	-177.4	-176.3	59.8	0	0	0	111.3	L21 T25 I33 L38 I49 L55 R57 L58 D59	L21-L36 HydrophobicContact CD2-CD1 3.83Å; L21-L36 HydrophobicContact CD2-CD2 3.48Å; L21-L36 VanDerWaalsContact CD2-CD2 3.48Å; L21-L36 HydrophobicContact CD2-CG 4.3Å; T25-L36 HydrophobicContact CG2-CD1 3.8Å; I33-L36 HydrophobicContact CG2-CB 4.23Å; L36-L38 HydrophobicContact CD1-CD1 4.24Å; L36-L38 HydrophobicContact CD1-CD2 4.13Å; L36-L38 HydrophobicContact CD1-CG 3.93Å; L36-L38 HydrophobicContact CD2-CD1 3.81Å; L36-L38 HydrophobicContact CD2-CG 4.29Å; L36-L38 HydrophobicContact CG-CD1 4Å; L36-L38 HydrophobicContact CG-CG 3.9Å; L36-I49 HydrophobicContact CD2-CD1 3.94Å; L36-I49 HydrophobicContact CD2-CG1 4.12Å; L36-L55 HydrophobicContact CB-CD1 3.67Å; L36-L55 HydrophobicContact CB-CD2 4.47Å; L36-R57 PolarHBondContact N-O 3.28Å; L36-L58 HydrophobicContact CB-CD1 4.02Å; L36-L58 HydrophobicContact CD2-CD1 4Å; L36-L58 HydrophobicContact CG-CD1 4.05Å; L36-L58 WeakPolarHBondContact O-CA 3.15Å; L36-D59 PolarHBondContact O-N 2.97Å
37	K	93.4	Very high	92.6	Very high	160 Å²	160	64.4 Å²	64.4	70%	0.696	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	113.4	176.5	-63.6	-179	-178	175	0	109.4	D59	K37-D59 HydrophobicContact CG-CB 4.23Å
38	L	93.3	Very high	93.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.31	C	S	.	.			trans	-130.4	66.2	-179.4	-65.7	178	0	0	0	108.5	V16 L20 L21 R24 L36 L41 I43 D59 L60 N63	V16-L38 HydrophobicContact CG1-CD1 4.34Å; V16-L38 HydrophobicContact CG2-CD1 4.01Å; L20-L38 HydrophobicContact CD2-CD1 4.48Å; L20-L38 HydrophobicContact CD2-CD2 4.08Å; L20-L38 HydrophobicContact CG-CD2 4.32Å; L21-L38 HydrophobicContact CD2-CD1 4.25Å; R24-L38 HydrophobicContact CB-CD2 4.46Å; R24-L38 HydrophobicContact CG-CD2 3.9Å; L36-L38 HydrophobicContact CD1-CD1 4.24Å; L36-L38 HydrophobicContact CD1-CD2 4.13Å; L36-L38 HydrophobicContact CD1-CG 3.93Å; L36-L38 HydrophobicContact CD2-CD1 3.81Å; L36-L38 HydrophobicContact CD2-CG 4.29Å; L36-L38 HydrophobicContact CG-CD1 4Å; L36-L38 HydrophobicContact CG-CG 3.9Å; L38-L41 HydrophobicContact CB-CD1 4.11Å; L38-L41 HydrophobicContact CD2-CD1 3.83Å; L38-I43 HydrophobicContact CB-CD1 3.77Å; L38-I43 HydrophobicContact CD1-CD1 4.07Å; L38-I43 HydrophobicContact CG-CD1 4.39Å; L38-D59 CarbonylContact C-O 3.57Å; L38-D59 PolarHBondContact N-O 3.33Å; L38-L60 HydrophobicContact CB-CD2 3.94Å; L38-L60 HydrophobicContact CD1-CD2 4.32Å; L38-N63 PolarHBondContact O-ND2 3.46Å
39	R	92.3	Very high	93.7	Very high	126 Å²	126	53.8 Å²	53.8	48%	0.475	28%	0.277	S	S	.	.			trans	-92.1	137.4	-175.3	-55.9	179.4	73.5	-146.2	-2	111	L41 D59 F61	R39-L41 PolarHBondContact O-N 2.99Å; R39-D59 WeakPolarHBondContact CD-OD2 3.43Å; R39-D59 HydrophobicContact CG-CB 4.43Å; R39-D59 IonicContact NE-OD2 2.72Å; R39-F61 CarbonylContact C-O 3.44Å; R39-F61 VanDerWaalsContact CA-O 3.29Å; R39-F61 WeakPolarHBondContact CA-O 3.42Å; R39-F61 HydrophobicContact CB-CD1 4.44Å; R39-F61 HydrophobicContact CG-CB 4.2Å
40	V	92.9	Very high	93.8	Very high	99 Å²	99	48.9 Å²	48.9	60%	0.6	25%	0.254	S	S	*	.	S	Bend	trans	53	51.5	170.3	-161.4	0	0	0	0	112.6	F61 G62	V40-F61 HydrophobicContact CG2-CD1 3.93Å; V40-F61 HydrophobicContact CG2-CE1 3.94Å; V40-F61 PolarHBondContact N-O 3.29Å; V40-G62 WeakPolarHBondContact CA-O 3.36Å
41	L	92.8	Very high	94.1	Very high	41 Å²	41	52.9 Å²	52.9	22%	0.215	27%	0.272	C	S	.	.	S	Bend	trans	-113.1	-1.1	179.5	-66	178.7	0	0	0	113.4	C13 L38 R39 I43 N63	C13-L41 HydrophobicContact CB-CB 4.45Å; C13-L41 PolarHBondContact N-O 3.33Å; L38-L41 HydrophobicContact CB-CD1 4.11Å; L38-L41 HydrophobicContact CD2-CD1 3.83Å; R39-L41 PolarHBondContact O-N 2.99Å; L41-I43 VanDerWaalsContact C-N 3.29Å; L41-I43 HydrophobicContact CB-CD1 3.93Å; L41-I43 HydrophobicContact CB-CG1 3.93Å; L41-I43 HydrophobicContact CD1-CD1 4.04Å; L41-I43 PolarHBondContact O-N 3.37Å; L41-N63 PolarHBondContact N-OD1 2.88Å
42	G	93.9	Very high	94.3	Very high	25 Å²	25	47 Å²	47	26%	0.258	25%	0.245	S	C	.	.			trans	74.4	17.2	-176.6	0	0	0	0	0	114.1	H44 N63	G42-H44 PolarHBondContact O-N 3.34Å; G42-N63 PolarHBondContact N-OD1 3.41Å
43	I	95.7	Very high	94.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.246	C	C	.	.			trans	-63.2	127.1	-176.5	-65	161.1	0	0	0	110.3	C13 V16 L20 L38 L41 L46 L60 N63 N64 V65	C13-I43 VanDerWaalsContact O-CA 3.27Å; C13-I43 WeakPolarHBondContact O-CA 3.17Å; C13-I43 WeakPolarHBondContact O-CG1 3.27Å; C13-I43 PolarHBondContact O-N 2.9Å; V16-I43 HydrophobicContact CG2-CD1 4.11Å; V16-I43 HydrophobicContact CG2-CG2 3.83Å; L20-I43 HydrophobicContact CD2-CD1 4.48Å; L38-I43 HydrophobicContact CB-CD1 3.77Å; L38-I43 HydrophobicContact CD1-CD1 4.07Å; L38-I43 HydrophobicContact CG-CD1 4.39Å; L41-I43 VanDerWaalsContact C-N 3.29Å; L41-I43 HydrophobicContact CB-CD1 3.93Å; L41-I43 HydrophobicContact CB-CG1 3.93Å; L41-I43 HydrophobicContact CD1-CD1 4.04Å; L41-I43 PolarHBondContact O-N 3.37Å; I43-L46 HydrophobicContact CG2-CD2 4.42Å; I43-L60 HydrophobicContact CD1-CD2 4.48Å; I43-N63 HydrophobicContact CB-CB 4.21Å; I43-N63 PolarHBondContact N-OD1 2.72Å; I43-N63 WeakPolarHBondContact O-CB 3.36Å; I43-N64 CarbonylContact O-C 3.58Å; I43-N64 VanDerWaalsContact O-C 3.22Å; I43-N64 WeakPolarHBondContact O-CA 3.41Å; I43-N64 PolarHBondContact O-N 3.1Å; I43-V65 HydrophobicContact CG2-CG2 4.28Å; I43-V65 PolarHBondContact O-N 2.99Å
44	H	95	Very high	94.5	Very high	82 Å²	82	50.2 Å²	50.2	38%	0.38	26%	0.26	S	S	.	.			trans	-111.5	-31.5	171.1	66.3	-122.2	0	0	0	112.2	E14 G42 N64	E14-H44 WeakPolarHBondContact CB-CE1 3.4Å; E14-H44 PolarHBondContact O-CD2 2.91Å; E14-H44 VanDerWaalsContact O-CG 3.3Å; E14-H44 PolarHBondContact O-N 3.09Å; E14-H44 PolarHBondContact O-ND1 3.48Å; E14-H44 IonicContact OE2-CE1 2.75Å; E14-H44 PolarHBondContact OE2-CE1 3.26Å; G42-H44 PolarHBondContact O-N 3.34Å; H44-N64 HydrophobicContact CB-CB 4.32Å
45	D	96	Very high	94.7	Very high	52 Å²	52	47 Å²	47	28%	0.278	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-111.6	121	-179.8	-176.7	1.9	0	0	0	110.7	E14 K15 V16 G47	E14-D45 PolarHBondContact O-N 2.92Å; K15-D45 CarbonylContact C-O 3.43Å; K15-D45 VanDerWaalsContact CA-O 3.31Å; K15-D45 WeakPolarHBondContact CA-O 3.31Å; K15-D45 HydrophobicContact CB-CB 4.05Å; K15-D45 HydrophobicContact CD-CB 4.33Å; K15-D45 VanDerWaalsContact CD-OD2 3.22Å; K15-D45 WeakPolarHBondContact CD-OD2 3.45Å; K15-D45 WeakPolarHBondContact CE-OD2 3.4Å; K15-D45 HydrophobicContact CG-CB 3.91Å; K15-D45 IonicContact NZ-OD2 3.41Å; K15-D45 PolarHBondContact NZ-OD2 3.16Å; V16-D45 PolarHBondContact N-O 2.94Å; D45-G47 PolarHBondContact O-N 3.24Å; D45-G47 PolarHBondContact OD1-N 2.92Å
46	L	96.4	Very high	94.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.237	C	C	.	.			trans	-73.9	-9.2	178.6	-69.9	-174.6	0	0	0	113.7	V16 I43 C48 I49 L60 V65 N67 L68 P70 L71	V16-L46 WeakPolarHBondContact CB-O 3.3Å; I43-L46 HydrophobicContact CG2-CD2 4.42Å; L46-C48 PolarHBondContact O-N 2.73Å; L46-I49 HydrophobicContact CB-CG2 3.73Å; L46-I49 HydrophobicContact CD1-CG2 4.48Å; L46-I49 WeakPolarHBondContact O-CB 3.36Å; L46-I49 WeakPolarHBondContact O-CG2 3.18Å; L46-I49 PolarHBondContact O-N 2.95Å; L46-L60 HydrophobicContact CD2-CD1 3.65Å; L46-L60 HydrophobicContact CD2-CD2 4.09Å; L46-V65 HydrophobicContact CD1-CG1 4.14Å; L46-V65 HydrophobicContact CD2-CG1 4.26Å; L46-V65 HydrophobicContact CD2-CG2 3.97Å; L46-V65 HydrophobicContact CG-CG1 4.06Å; L46-N67 WeakPolarHBondContact CD1-O 3.22Å; L46-L68 HydrophobicContact CD1-CD2 4.23Å; L46-P70 HydrophobicContact CB-CB 3.91Å; L46-P70 HydrophobicContact CB-CG 3.8Å; L46-L71 HydrophobicContact CD1-CD1 4.18Å; L46-L71 HydrophobicContact CD1-CD2 3.87Å; L46-L71 HydrophobicContact CD1-CG 3.75Å
47	G	94.8	Very high	95	Very high	21 Å²	21	51.5 Å²	51.5	22%	0.216	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	46.3	-126.5	166.7	0	0	0	0	0	114.3	V16 D45 I49	V16-G47 WeakPolarHBondContact O-CA 3.32Å; D45-G47 PolarHBondContact O-N 3.24Å; D45-G47 PolarHBondContact OD1-N 2.92Å; G47-I49 PolarHBondContact O-N 3Å
48	C	95.1	Very high	95.2	Very high	20 Å²	20	44 Å²	44	14%	0.135	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-80.2	11.3	-177	67.6	0	0	0	0	114.2	V16 T17 A18 L30 L46 G50 E51	V16-C48 PolarHBondContact O-N 3.28Å; T17-C48 VanDerWaalsContact C-SG 3.53Å; A18-C48 PolarHBondContact N-SG 3.42Å; A18-C48 VanDerWaalsContact N-SG 3.37Å; L30-C48 HydrophobicContact CD1-CB 4.44Å; L46-C48 PolarHBondContact O-N 2.73Å; C48-G50 PolarHBondContact O-N 3.49Å; C48-E51 WeakPolarHBondContact CB-OE1 3.2Å; C48-E51 WeakPolarHBondContact O-CB 3.29Å; C48-E51 PolarHBondContact O-N 3.29Å; C48-E51 VanDerWaalsContact O-N 3.1Å
49	I	96.4	Very high	95.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-60.7	-29.5	179.7	-154.8	166	0	0	0	112.2	V16 L36 L46 G47 E51 C52 L58 P70 L71	V16-I49 HydrophobicContact CG1-CB 4.35Å; L36-I49 HydrophobicContact CD2-CD1 3.94Å; L36-I49 HydrophobicContact CD2-CG1 4.12Å; L46-I49 HydrophobicContact CB-CG2 3.73Å; L46-I49 HydrophobicContact CD1-CG2 4.48Å; L46-I49 WeakPolarHBondContact O-CB 3.36Å; L46-I49 WeakPolarHBondContact O-CG2 3.18Å; L46-I49 PolarHBondContact O-N 2.95Å; G47-I49 PolarHBondContact O-N 3Å; I49-E51 PolarHBondContact O-N 3.34Å; I49-C52 WeakPolarHBondContact O-CB 3.48Å; I49-C52 PolarHBondContact O-N 3.45Å; I49-C52 VanDerWaalsContact O-N 3.1Å; I49-L58 HydrophobicContact CD1-CD1 3.75Å; I49-L58 HydrophobicContact CD1-CD2 3.6Å; I49-L58 HydrophobicContact CD1-CG 4.35Å; I49-P70 HydrophobicContact CG2-CB 3.67Å; I49-L71 HydrophobicContact CG2-CD2 3.98Å
50	G	95.3	Very high	95.7	Very high	14 Å²	14	39.6 Å²	39.6	14%	0.144	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-67.7	-14.1	179.3	0	0	0	0	0	114.2	C48 C52 P70 S73	C48-G50 PolarHBondContact O-N 3.49Å; G50-C52 VanDerWaalsContact C-N 3.33Å; G50-P70 WeakPolarHBondContact CA-O 3.27Å; G50-S73 VanDerWaalsContact CA-OG 3.25Å; G50-S73 WeakPolarHBondContact CA-OG 3.38Å; G50-S73 PolarHBondContact O-OG 3.08Å
51	E	96.9	Very high	95.8	Very high	117 Å²	117	36.3 Å²	36.3	55%	0.547	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-82.7	-13.7	174.8	-62.5	170.3	-142.1	0	0	111.9	L30 C48 I49 V53	L30-E51 HydrophobicContact CB-CB 4.42Å; L30-E51 HydrophobicContact CD1-CB 3.64Å; L30-E51 HydrophobicContact CD1-CG 4.46Å; L30-E51 VanDerWaalsContact CD1-OE2 3.28Å; L30-E51 WeakPolarHBondContact CD1-OE2 3.37Å; C48-E51 WeakPolarHBondContact CB-OE1 3.2Å; C48-E51 WeakPolarHBondContact O-CB 3.29Å; C48-E51 PolarHBondContact O-N 3.29Å; C48-E51 VanDerWaalsContact O-N 3.1Å; I49-E51 PolarHBondContact O-N 3.34Å; E51-V53 PolarHBondContact O-N 2.92Å
52	C	96.6	Very high	95.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.			trans	-78.1	59.4	175.6	-55.7	0	0	0	0	110.7	L30 I49 G50 N54 L55 L74	L30-C52 WeakPolarHBondContact O-CA 3.49Å; I49-C52 WeakPolarHBondContact O-CB 3.48Å; I49-C52 PolarHBondContact O-N 3.45Å; I49-C52 VanDerWaalsContact O-N 3.1Å; G50-C52 VanDerWaalsContact C-N 3.33Å; C52-N54 PolarHBondContact O-N 2.89Å; C52-L55 HydrophobicContact CB-CB 4.12Å; C52-L55 WeakPolarHBondContact O-CB 3.48Å; C52-L55 PolarHBondContact O-N 2.92Å; C52-L74 VanDerWaalsContact O-CD2 3.26Å; C52-L74 WeakPolarHBondContact O-CD2 3.44Å
53	V	95.7	Very high	96	Very high	59 Å²	59	34.1 Å²	34.1	36%	0.358	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.7	-167.4	-64.4	0	0	0	0	114.8	E31 E51	E31-V53 HydrophobicContact CG-CG2 4.13Å; E51-V53 PolarHBondContact O-N 2.92Å
54	N	95.1	Very high	96.1	Very high	59 Å²	59	37.3 Å²	37.3	32%	0.316	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	7.4	176.9	-61.5	-40.7	0	0	0	114.2	E31 L34 C52 E56	E31-N54 WeakPolarHBondContact O-CB 3.44Å; E31-N54 PolarHBondContact O-ND2 2.8Å; L34-N54 HydrophobicContact CD2-CB 3.91Å; L34-N54 VanDerWaalsContact CD2-O 3.28Å; L34-N54 WeakPolarHBondContact CD2-O 3.22Å; C52-N54 PolarHBondContact O-N 2.89Å; N54-E56 PolarHBondContact O-N 3.16Å
55	L	95.9	Very high	96.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.177	C	C	.	.			trans	-64.6	120	-177.9	-168.9	72.5	0	0	0	111.3	I33 L36 C52 L58 L74 L76 L77	I33-L55 HydrophobicContact CG2-CD1 3.8Å; I33-L55 WeakPolarHBondContact O-CA 3.36Å; I33-L55 PolarHBondContact O-N 2.74Å; L36-L55 HydrophobicContact CB-CD1 3.67Å; L36-L55 HydrophobicContact CB-CD2 4.47Å; C52-L55 HydrophobicContact CB-CB 4.12Å; C52-L55 WeakPolarHBondContact O-CB 3.48Å; C52-L55 PolarHBondContact O-N 2.92Å; L55-L58 HydrophobicContact CD2-CB 3.87Å; L55-L58 HydrophobicContact CD2-CD1 4.18Å; L55-L58 HydrophobicContact CD2-CD2 4.02Å; L55-L58 HydrophobicContact CD2-CG 4.24Å; L55-L74 HydrophobicContact CD2-CD1 3.98Å; L55-L76 CarbonylContact O-C 3.58Å; L55-L77 HydrophobicContact CD2-CD1 4.28Å; L55-L77 HydrophobicContact CG-CD1 4.22Å; L55-L77 VanDerWaalsContact O-CA 3.3Å; L55-L77 WeakPolarHBondContact O-CA 3.46Å; L55-L77 PolarHBondContact O-N 3.34Å
56	E	94.8	Very high	96.2	Very high	71 Å²	71	34.6 Å²	34.6	33%	0.332	19%	0.186	S	C	.	.			trans	-99	-33.4	-179.5	-65.2	-173.6	-176.9	0	0	112.7	L34 F35 N54 S78 V79	L34-E56 PolarHBondContact O-N 2.96Å; F35-E56 HydrophobicContact CE1-CB 4.23Å; N54-E56 PolarHBondContact O-N 3.16Å; E56-S78 PolarHBondContact O-N 2.87Å; E56-S78 PolarHBondContact O-OG 3.24Å; E56-V79 PolarHBondContact O-N 2.84Å
57	R	97.4	Very high	96.2	Very high	134 Å²	134	39.4 Å²	39.4	51%	0.506	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129.1	-179.5	-45.6	179.8	-176.7	163.4	1.7	112	L34 F35 L36 V79	L34-R57 PolarHBondContact O-N 2.85Å; L34-R57 VanDerWaalsContact O-N 3.13Å; F35-R57 WeakPolarHBondContact CA-O 3.26Å; F35-R57 HydrophobicContact CD1-CB 3.81Å; F35-R57 HydrophobicContact CD1-CG 3.66Å; F35-R57 HydrophobicContact CE1-CB 4.44Å; F35-R57 HydrophobicContact CE1-CG 3.78Å; L36-R57 PolarHBondContact N-O 3.28Å; R57-V79 WeakPolarHBondContact CA-O 3.48Å; R57-V79 HydrophobicContact CB-CB 4.16Å; R57-V79 HydrophobicContact CG-CB 3.98Å; R57-V79 HydrophobicContact CG-CG2 4.19Å
58	L	97.9	Very high	96.4	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.8	-177.7	178.7	54.9	0	0	0	111	L36 I49 L55 L60 L71 L77 V79 L80 N81	L36-L58 HydrophobicContact CB-CD1 4.02Å; L36-L58 HydrophobicContact CD2-CD1 4Å; L36-L58 HydrophobicContact CG-CD1 4.05Å; L36-L58 WeakPolarHBondContact O-CA 3.15Å; I49-L58 HydrophobicContact CD1-CD1 3.75Å; I49-L58 HydrophobicContact CD1-CD2 3.6Å; I49-L58 HydrophobicContact CD1-CG 4.35Å; L55-L58 HydrophobicContact CD2-CB 3.87Å; L55-L58 HydrophobicContact CD2-CD1 4.18Å; L55-L58 HydrophobicContact CD2-CD2 4.02Å; L55-L58 HydrophobicContact CD2-CG 4.24Å; L58-L60 HydrophobicContact CD1-CD1 4.25Å; L58-L60 HydrophobicContact CD1-CD2 4.41Å; L58-L60 HydrophobicContact CD1-CG 3.9Å; L58-L60 HydrophobicContact CD2-CD1 3.69Å; L58-L60 HydrophobicContact CD2-CG 4.26Å; L58-L60 HydrophobicContact CG-CD1 3.93Å; L58-L60 HydrophobicContact CG-CG 3.95Å; L58-L71 HydrophobicContact CD2-CD2 3.68Å; L58-L77 HydrophobicContact CB-CD1 3.8Å; L58-V79 PolarHBondContact N-O 3.1Å; L58-L80 HydrophobicContact CB-CD1 3.93Å; L58-L80 HydrophobicContact CD2-CD1 3.91Å; L58-L80 HydrophobicContact CG-CD1 3.94Å; L58-L80 WeakPolarHBondContact O-CA 3.39Å; L58-N81 PolarHBondContact O-N 3.19Å
59	D	97.3	Very high	96.5	Very high	32 Å²	32	38.7 Å²	38.7	17%	0.171	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	110.7	172.9	-169.8	-1.2	0	0	0	110.9	L36 K37 L38 R39 F61 N81	L36-D59 PolarHBondContact O-N 2.97Å; K37-D59 HydrophobicContact CG-CB 4.23Å; L38-D59 CarbonylContact C-O 3.57Å; L38-D59 PolarHBondContact N-O 3.33Å; R39-D59 WeakPolarHBondContact CD-OD2 3.43Å; R39-D59 HydrophobicContact CG-CB 4.43Å; R39-D59 IonicContact NE-OD2 2.72Å; D59-F61 VanDerWaalsContact OD1-CB 3.27Å; D59-F61 WeakPolarHBondContact OD1-CB 3.36Å; D59-F61 PolarHBondContact OD1-N 3.36Å; D59-F61 VanDerWaalsContact OD1-N 3.11Å; D59-N81 HydrophobicContact CB-CB 4.43Å; D59-N81 WeakPolarHBondContact OD1-CB 3.45Å; D59-N81 PolarHBondContact OD1-ND2 3.23Å
60	L	96.8	Very high	96.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.			trans	-116.4	25	179	-74	167.1	0	0	0	111.6	L38 I43 L46 L58 G62 N63 N81 L82 N85	L38-L60 HydrophobicContact CB-CD2 3.94Å; L38-L60 HydrophobicContact CD1-CD2 4.32Å; I43-L60 HydrophobicContact CD1-CD2 4.48Å; L46-L60 HydrophobicContact CD2-CD1 3.65Å; L46-L60 HydrophobicContact CD2-CD2 4.09Å; L58-L60 HydrophobicContact CD1-CD1 4.25Å; L58-L60 HydrophobicContact CD1-CD2 4.41Å; L58-L60 HydrophobicContact CD1-CG 3.9Å; L58-L60 HydrophobicContact CD2-CD1 3.69Å; L58-L60 HydrophobicContact CD2-CG 4.26Å; L58-L60 HydrophobicContact CG-CD1 3.93Å; L58-L60 HydrophobicContact CG-CG 3.95Å; L60-G62 PolarHBondContact O-N 3.46Å; L60-N63 VanDerWaalsContact C-ND2 3.31Å; L60-N63 PolarHBondContact O-ND2 3.4Å; L60-N81 WeakPolarHBondContact CA-O 3.2Å; L60-N81 PolarHBondContact N-O 3.28Å; L60-L82 HydrophobicContact CB-CD2 4Å; L60-L82 HydrophobicContact CD1-CD2 3.69Å; L60-N85 PolarHBondContact O-ND2 2.96Å
61	F	95.9	Very high	96.7	Very high	31 Å²	31	39.6 Å²	39.6	14%	0.136	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	134.9	179.1	168.7	-99	0	0	0	113.3	R39 V40 D59 N63 S83 Y136	R39-F61 CarbonylContact C-O 3.44Å; R39-F61 VanDerWaalsContact CA-O 3.29Å; R39-F61 WeakPolarHBondContact CA-O 3.42Å; R39-F61 HydrophobicContact CB-CD1 4.44Å; R39-F61 HydrophobicContact CG-CB 4.2Å; V40-F61 HydrophobicContact CG2-CD1 3.93Å; V40-F61 HydrophobicContact CG2-CE1 3.94Å; V40-F61 PolarHBondContact N-O 3.29Å; D59-F61 VanDerWaalsContact OD1-CB 3.27Å; D59-F61 WeakPolarHBondContact OD1-CB 3.36Å; D59-F61 PolarHBondContact OD1-N 3.36Å; D59-F61 VanDerWaalsContact OD1-N 3.11Å; F61-N63 PolarHBondContact O-ND2 3.35Å; F61-S83 WeakPolarHBondContact CA-O 3.22Å; F61-S83 WeakPolarHBondContact CD2-OG 3.28Å; F61-Y136 AromaticContact CE2-CE2 3.82Å; F61-Y136 HydrophobicContact CE2-CE2 3.82Å; F61-Y136 HydrophobicContact CZ-CE2 4.24Å
62	G	94.3	Very high	96.6	Very high	17 Å²	17	36.5 Å²	36.5	18%	0.175	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	37.1	167.4	0	0	0	0	0	113.8	V40 L60 S83 S84	V40-G62 WeakPolarHBondContact CA-O 3.36Å; L60-G62 PolarHBondContact O-N 3.46Å; G62-S83 PolarHBondContact N-O 3.34Å; G62-S84 CarbonylContact C-O 3.39Å; G62-S84 WeakPolarHBondContact CA-O 3.5Å; G62-S84 PolarHBondContact N-O 3.32Å
63	N	96.8	Very high	96.6	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.016	22%	0.218	C	C	.	.	S	Bend	trans	-111.7	-170.8	175.3	-70	-70.1	0	0	0	111	L38 L41 G42 I43 L60 F61 V65 S84 N85	L38-N63 PolarHBondContact O-ND2 3.46Å; L41-N63 PolarHBondContact N-OD1 2.88Å; G42-N63 PolarHBondContact N-OD1 3.41Å; I43-N63 HydrophobicContact CB-CB 4.21Å; I43-N63 PolarHBondContact N-OD1 2.72Å; I43-N63 WeakPolarHBondContact O-CB 3.36Å; L60-N63 VanDerWaalsContact C-ND2 3.31Å; L60-N63 PolarHBondContact O-ND2 3.4Å; F61-N63 PolarHBondContact O-ND2 3.35Å; N63-V65 HydrophobicContact CB-CG2 4.1Å; N63-S84 PolarHBondContact N-O 2.99Å; N63-N85 WeakPolarHBondContact CA-OD1 3.28Å; N63-N85 VanDerWaalsContact CB-OD1 3.26Å; N63-N85 WeakPolarHBondContact CB-OD1 3.4Å; N63-N85 WeakPolarHBondContact O-CA 3.32Å; N63-N85 PolarHBondContact O-OD1 3.25Å; N63-N85 VanDerWaalsContact O-OD1 3.1Å
64	N	97	Very high	96.7	Very high	66 Å²	66	36 Å²	36	35%	0.353	20%	0.201	S	C	.	.			trans	-111.2	27.7	-178.9	-67.5	2.4	0	0	0	111.6	I43 H44 T66	I43-N64 CarbonylContact O-C 3.58Å; I43-N64 VanDerWaalsContact O-C 3.22Å; I43-N64 WeakPolarHBondContact O-CA 3.41Å; I43-N64 PolarHBondContact O-N 3.1Å; H44-N64 HydrophobicContact CB-CB 4.32Å; N64-T66 PolarHBondContact O-N 3.19Å
65	V	97.7	Very high	96.8	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.			trans	-67	132.2	-175.2	-179	0	0	0	0	110.2	I43 L46 N63 L68 N85 R86 I87	I43-V65 HydrophobicContact CG2-CG2 4.28Å; I43-V65 PolarHBondContact O-N 2.99Å; L46-V65 HydrophobicContact CD1-CG1 4.14Å; L46-V65 HydrophobicContact CD2-CG1 4.26Å; L46-V65 HydrophobicContact CD2-CG2 3.97Å; L46-V65 HydrophobicContact CG-CG1 4.06Å; N63-V65 HydrophobicContact CB-CG2 4.1Å; V65-L68 HydrophobicContact CG1-CD2 3.8Å; V65-N85 HydrophobicContact CB-CB 4.46Å; V65-N85 WeakPolarHBondContact CB-OD1 3.34Å; V65-N85 WeakPolarHBondContact CG2-OD1 3.48Å; V65-N85 PolarHBondContact N-OD1 3.37Å; V65-R86 CarbonylContact O-C 3.47Å; V65-R86 PolarHBondContact O-N 3.27Å; V65-I87 WeakPolarHBondContact O-CG1 3.13Å
66	T	96.3	Very high	96.8	Very high	78 Å²	78	44.7 Å²	44.7	48%	0.479	24%	0.235	S	C	.	.			trans	-120.3	-31.6	175.4	55	0	0	0	0	112.4	N64 R86	N64-T66 PolarHBondContact O-N 3.19Å; T66-R86 HydrophobicContact CG2-CB 3.81Å
67	N	96.8	Very high	96.9	Very high	101 Å²	101	41.3 Å²	41.3	54%	0.54	22%	0.219	S	C	.	.			trans	-112.6	122.7	-176	-173.6	-4.3	0	0	0	111.2	L46 G69	L46-N67 WeakPolarHBondContact CD1-O 3.22Å; N67-G69 PolarHBondContact OD1-N 2.83Å
68	L	98.1	Very high	96.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.201	C	C	.	.			trans	-99.1	6.7	179.2	-57.4	-175.4	0	0	0	113.7	L46 V65 P70 L71 L82 I87 I90 P92 L93	L46-L68 HydrophobicContact CD1-CD2 4.23Å; V65-L68 HydrophobicContact CG1-CD2 3.8Å; L68-P70 VanDerWaalsContact C-N 3.32Å; L68-L71 HydrophobicContact CB-CD1 4.24Å; L68-L71 HydrophobicContact CD2-CD1 3.88Å; L68-L71 HydrophobicContact CG-CD1 4.49Å; L68-L71 WeakPolarHBondContact O-CB 3.33Å; L68-L71 PolarHBondContact O-N 3.43Å; L68-L82 HydrophobicContact CD1-CD1 3.9Å; L68-L82 HydrophobicContact CD2-CD1 4.02Å; L68-L82 HydrophobicContact CD2-CD2 4Å; L68-I87 HydrophobicContact CD1-CD1 4.33Å; L68-I87 HydrophobicContact CD1-CG2 3.92Å; L68-I87 HydrophobicContact CD2-CD1 3.89Å; L68-I87 HydrophobicContact CD2-CG1 4.25Å; L68-I87 HydrophobicContact CG-CD1 4.46Å; L68-I87 HydrophobicContact CG-CG2 4.26Å; L68-I90 HydrophobicContact CD1-CG2 4.15Å; L68-P92 HydrophobicContact CB-CB 4.04Å; L68-P92 HydrophobicContact CB-CG 4.05Å; L68-P92 WeakPolarHBondContact O-CB 3.5Å; L68-L93 HydrophobicContact CD1-CD1 4Å; L68-L93 HydrophobicContact CD1-CD2 4.04Å; L68-L93 HydrophobicContact CD1-CG 3.88Å
69	G	97.5	Very high	96.9	Very high	26 Å²	26	37.9 Å²	37.9	27%	0.268	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-46.3	-47.4	-177.7	0	0	0	0	0	114.2	N67 L71 S72	N67-G69 PolarHBondContact OD1-N 2.83Å; G69-L71 PolarHBondContact O-N 3.05Å; G69-L71 VanDerWaalsContact O-N 3.15Å; G69-S72 WeakPolarHBondContact O-CB 3.21Å; G69-S72 PolarHBondContact O-N 2.9Å; G69-S72 VanDerWaalsContact O-N 3.1Å; G69-S72 PolarHBondContact O-OG 2.7Å
70	P	97.3	Very high	97	Very high	33 Å²	33	36.4 Å²	36.4	21%	0.214	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-61.4	-19.7	177.3	-30.3	40.7	0	0	0	115.4	L46 I49 G50 L68 S72 S73	L46-P70 HydrophobicContact CB-CB 3.91Å; L46-P70 HydrophobicContact CB-CG 3.8Å; I49-P70 HydrophobicContact CG2-CB 3.67Å; G50-P70 WeakPolarHBondContact CA-O 3.27Å; L68-P70 VanDerWaalsContact C-N 3.32Å; P70-S72 VanDerWaalsContact C-N 3.28Å; P70-S72 PolarHBondContact O-N 2.98Å; P70-S73 PolarHBondContact O-OG 3.42Å
71	L	97.9	Very high	97	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-76.6	-15.1	177.2	-54.9	-174.4	0	0	0	113	L46 I49 L58 L68 G69 S73 L74 L80 L82 L93 C96	L46-L71 HydrophobicContact CD1-CD1 4.18Å; L46-L71 HydrophobicContact CD1-CD2 3.87Å; L46-L71 HydrophobicContact CD1-CG 3.75Å; I49-L71 HydrophobicContact CG2-CD2 3.98Å; L58-L71 HydrophobicContact CD2-CD2 3.68Å; L68-L71 HydrophobicContact CB-CD1 4.24Å; L68-L71 HydrophobicContact CD2-CD1 3.88Å; L68-L71 HydrophobicContact CG-CD1 4.49Å; L68-L71 WeakPolarHBondContact O-CB 3.33Å; L68-L71 PolarHBondContact O-N 3.43Å; G69-L71 PolarHBondContact O-N 3.05Å; G69-L71 VanDerWaalsContact O-N 3.15Å; L71-S73 PolarHBondContact O-N 3.03Å; L71-L74 HydrophobicContact CD2-CD1 3.68Å; L71-L74 WeakPolarHBondContact O-CB 3.32Å; L71-L74 PolarHBondContact O-N 3.32Å; L71-L80 HydrophobicContact CD1-CD1 4.45Å; L71-L80 HydrophobicContact CD1-CD2 4.02Å; L71-L82 HydrophobicContact CD1-CD1 4.45Å; L71-L93 HydrophobicContact CB-CD2 4.35Å; L71-L93 HydrophobicContact CD1-CD2 3.95Å; L71-C96 PolarHBondContact O-SG 3.1Å
72	S	96.6	Very high	97.1	Very high	51 Å²	51	36.4 Å²	36.4	36%	0.357	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-63.3	-22.1	-176.6	61.3	0	0	0	0	114.4	G69 P70 S95	G69-S72 WeakPolarHBondContact O-CB 3.21Å; G69-S72 PolarHBondContact O-N 2.9Å; G69-S72 VanDerWaalsContact O-N 3.1Å; G69-S72 PolarHBondContact O-OG 2.7Å; P70-S72 VanDerWaalsContact C-N 3.28Å; P70-S72 PolarHBondContact O-N 2.98Å; S72-S95 WeakPolarHBondContact O-CB 3.08Å
73	S	96.6	Very high	97.3	Very high	48 Å²	48	35.9 Å²	35.9	34%	0.336	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-84.2	-13.6	175.5	53.4	0	0	0	0	113.8	G50 P70 L71 R75	G50-S73 VanDerWaalsContact CA-OG 3.25Å; G50-S73 WeakPolarHBondContact CA-OG 3.38Å; G50-S73 PolarHBondContact O-OG 3.08Å; P70-S73 PolarHBondContact O-OG 3.42Å; L71-S73 PolarHBondContact O-N 3.03Å; S73-R75 VanDerWaalsContact C-N 3.33Å; S73-R75 PolarHBondContact O-N 3.38Å
74	L	97.6	Very high	97.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.211	C	C	.	.			trans	-86	66.9	-169.9	-54.5	-174	0	0	0	112.3	C52 L55 L71 L76 L77	C52-L74 VanDerWaalsContact O-CD2 3.26Å; C52-L74 WeakPolarHBondContact O-CD2 3.44Å; L55-L74 HydrophobicContact CD2-CD1 3.98Å; L71-L74 HydrophobicContact CD2-CD1 3.68Å; L71-L74 WeakPolarHBondContact O-CB 3.32Å; L71-L74 PolarHBondContact O-N 3.32Å; L74-L76 VanDerWaalsContact C-N 3.27Å; L74-L76 PolarHBondContact O-N 2.93Å; L74-L77 HydrophobicContact CB-CB 4.18Å; L74-L77 VanDerWaalsContact O-CB 3.25Å; L74-L77 WeakPolarHBondContact O-CB 3.48Å; L74-L77 PolarHBondContact O-N 2.65Å
75	R	96.3	Very high	97.4	Very high	164 Å²	164	34.5 Å²	34.5	62%	0.619	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.8	-173.2	-62.6	-175	-177.8	-176.8	0.9	114.2	S73 L77 N98	S73-R75 VanDerWaalsContact C-N 3.33Å; S73-R75 PolarHBondContact O-N 3.38Å; R75-L77 VanDerWaalsContact C-N 3.33Å; R75-N98 WeakPolarHBondContact O-CB 3.36Å; R75-N98 PolarHBondContact O-ND2 3.23Å
76	L	95.9	Very high	97.3	Very high	79 Å²	79	41.7 Å²	41.7	41%	0.414	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.6	178.6	-62.3	-170.6	0	0	0	113.5	L55 L74 S78	L55-L76 CarbonylContact O-C 3.58Å; L74-L76 VanDerWaalsContact C-N 3.27Å; L74-L76 PolarHBondContact O-N 2.93Å; L76-S78 PolarHBondContact O-N 3.11Å
77	L	97.8	Very high	97.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.			trans	-63.5	120.5	-177.7	-165.8	70.6	0	0	0	110.8	L55 L58 L74 R75 L80 N98 L99	L55-L77 HydrophobicContact CD2-CD1 4.28Å; L55-L77 HydrophobicContact CG-CD1 4.22Å; L55-L77 VanDerWaalsContact O-CA 3.3Å; L55-L77 WeakPolarHBondContact O-CA 3.46Å; L55-L77 PolarHBondContact O-N 3.34Å; L58-L77 HydrophobicContact CB-CD1 3.8Å; L74-L77 HydrophobicContact CB-CB 4.18Å; L74-L77 VanDerWaalsContact O-CB 3.25Å; L74-L77 WeakPolarHBondContact O-CB 3.48Å; L74-L77 PolarHBondContact O-N 2.65Å; R75-L77 VanDerWaalsContact C-N 3.33Å; L77-L80 HydrophobicContact CD2-CB 4.02Å; L77-L80 HydrophobicContact CD2-CD1 4.17Å; L77-L80 HydrophobicContact CD2-CD2 3.89Å; L77-L80 HydrophobicContact CD2-CG 4.25Å; L77-N98 CarbonylContact O-C 3.55Å; L77-L99 HydrophobicContact CD2-CD1 4.33Å; L77-L99 HydrophobicContact CG-CD1 4.21Å; L77-L99 VanDerWaalsContact O-CA 3.26Å; L77-L99 WeakPolarHBondContact O-CA 3.14Å; L77-L99 PolarHBondContact O-N 2.87Å; L77-L99 VanDerWaalsContact O-N 3.11Å
78	S	96.4	Very high	97.4	Very high	18 Å²	18	36.4 Å²	36.4	13%	0.126	20%	0.197	C	C	.	.			trans	-110	-31.9	-176.8	66.4	0	0	0	0	112.7	E56 L76 N98 Q100 T101	E56-S78 PolarHBondContact O-N 2.87Å; E56-S78 PolarHBondContact O-OG 3.24Å; L76-S78 PolarHBondContact O-N 3.11Å; S78-N98 WeakPolarHBondContact CA-O 3.35Å; S78-Q100 PolarHBondContact O-N 2.86Å; S78-T101 PolarHBondContact O-N 3.3Å
79	V	98	Very high	97.4	Very high	48 Å²	48	40.8 Å²	40.8	29%	0.291	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	122.3	-179.9	-176.8	0	0	0	0	109.7	E56 R57 L58 T101	E56-V79 PolarHBondContact O-N 2.84Å; R57-V79 WeakPolarHBondContact CA-O 3.48Å; R57-V79 HydrophobicContact CB-CB 4.16Å; R57-V79 HydrophobicContact CG-CB 3.98Å; R57-V79 HydrophobicContact CG-CG2 4.19Å; L58-V79 PolarHBondContact N-O 3.1Å; V79-T101 WeakPolarHBondContact CA-O 3.35Å; V79-T101 HydrophobicContact CG1-CG2 4.38Å
80	L	98.5	Very high	97.4	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	119.9	-179.9	-179.9	54.3	0	0	0	110.9	L58 L71 L77 L82 L93 L99 T101 L102 N103	L58-L80 HydrophobicContact CB-CD1 3.93Å; L58-L80 HydrophobicContact CD2-CD1 3.91Å; L58-L80 HydrophobicContact CG-CD1 3.94Å; L58-L80 WeakPolarHBondContact O-CA 3.39Å; L71-L80 HydrophobicContact CD1-CD1 4.45Å; L71-L80 HydrophobicContact CD1-CD2 4.02Å; L77-L80 HydrophobicContact CD2-CB 4.02Å; L77-L80 HydrophobicContact CD2-CD1 4.17Å; L77-L80 HydrophobicContact CD2-CD2 3.89Å; L77-L80 HydrophobicContact CD2-CG 4.25Å; L80-L82 HydrophobicContact CD1-CD1 4.16Å; L80-L82 HydrophobicContact CD1-CD2 4.21Å; L80-L82 HydrophobicContact CD1-CG 3.8Å; L80-L82 HydrophobicContact CD2-CD1 3.57Å; L80-L82 HydrophobicContact CD2-CG 4.14Å; L80-L82 HydrophobicContact CG-CD1 3.8Å; L80-L82 HydrophobicContact CG-CG 3.8Å; L80-L93 HydrophobicContact CD2-CD1 4.39Å; L80-L93 HydrophobicContact CD2-CD2 3.63Å; L80-L99 HydrophobicContact CB-CD1 3.72Å; L80-T101 PolarHBondContact N-O 3.27Å; L80-L102 HydrophobicContact CB-CD1 4.09Å; L80-L102 HydrophobicContact CD2-CD1 3.96Å; L80-L102 HydrophobicContact CG-CD1 4.02Å; L80-L102 WeakPolarHBondContact O-CA 3.28Å; L80-N103 PolarHBondContact O-N 2.94Å
81	N	98.2	Very high	97.4	Very high	31 Å²	31	41.8 Å²	41.8	17%	0.166	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.2	170.7	-174.3	19.8	0	0	0	110.5	L58 D59 L60 S83 N103	L58-N81 PolarHBondContact O-N 3.19Å; D59-N81 HydrophobicContact CB-CB 4.43Å; D59-N81 WeakPolarHBondContact OD1-CB 3.45Å; D59-N81 PolarHBondContact OD1-ND2 3.23Å; L60-N81 WeakPolarHBondContact CA-O 3.2Å; L60-N81 PolarHBondContact N-O 3.28Å; N81-S83 PolarHBondContact OD1-N 2.82Å; N81-S83 PolarHBondContact OD1-OG 3.13Å; N81-N103 WeakPolarHBondContact OD1-CB 3.27Å; N81-N103 PolarHBondContact OD1-ND2 3.44Å
82	L	98.1	Very high	97.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.			trans	-117.5	16.1	177.4	-73	167.4	0	0	0	111.5	L60 L68 L71 L80 N85 I87 L93 L102 N103 L104 N107	L60-L82 HydrophobicContact CB-CD2 4Å; L60-L82 HydrophobicContact CD1-CD2 3.69Å; L68-L82 HydrophobicContact CD1-CD1 3.9Å; L68-L82 HydrophobicContact CD2-CD1 4.02Å; L68-L82 HydrophobicContact CD2-CD2 4Å; L71-L82 HydrophobicContact CD1-CD1 4.45Å; L80-L82 HydrophobicContact CD1-CD1 4.16Å; L80-L82 HydrophobicContact CD1-CD2 4.21Å; L80-L82 HydrophobicContact CD1-CG 3.8Å; L80-L82 HydrophobicContact CD2-CD1 3.57Å; L80-L82 HydrophobicContact CD2-CG 4.14Å; L80-L82 HydrophobicContact CG-CD1 3.8Å; L80-L82 HydrophobicContact CG-CG 3.8Å; L82-N85 PolarHBondContact O-ND2 2.97Å; L82-I87 HydrophobicContact CB-CD1 3.77Å; L82-I87 HydrophobicContact CD1-CD1 3.97Å; L82-I87 HydrophobicContact CD2-CD1 3.93Å; L82-I87 HydrophobicContact CG-CD1 4.1Å; L82-L93 HydrophobicContact CD1-CD1 4.38Å; L82-L102 HydrophobicContact CD1-CD1 4.5Å; L82-N103 CarbonylContact C-O 3.55Å; L82-N103 WeakPolarHBondContact CA-O 3.36Å; L82-N103 PolarHBondContact N-O 2.89Å; L82-L104 HydrophobicContact CB-CD2 3.94Å; L82-L104 HydrophobicContact CD1-CD2 3.86Å; L82-N107 PolarHBondContact O-ND2 2.79Å
83	S	97.5	Very high	97.4	Very high	6 Å²	6	40.5 Å²	40.5	4%	0.042	21%	0.206	C	C	.	.			trans	-64.1	149.8	-177.4	51.2	0	0	0	0	112.8	F61 G62 N81 N85 N103 A105	F61-S83 WeakPolarHBondContact CA-O 3.22Å; F61-S83 WeakPolarHBondContact CD2-OG 3.28Å; G62-S83 PolarHBondContact N-O 3.34Å; N81-S83 PolarHBondContact OD1-N 2.82Å; N81-S83 PolarHBondContact OD1-OG 3.13Å; S83-N85 PolarHBondContact O-ND2 2.95Å; S83-N103 PolarHBondContact N-O 2.9Å; S83-N103 PolarHBondContact OG-ND2 2.82Å; S83-A105 CarbonylContact C-O 3.47Å; S83-A105 WeakPolarHBondContact CA-O 3.48Å; S83-A105 WeakPolarHBondContact CB-O 3.16Å
84	S	97.2	Very high	97.4	Very high	30 Å²	30	44.6 Å²	44.6	21%	0.21	21%	0.214	C	C	.	.	S	Bend	trans	55.2	59.5	-175.3	-174.7	0	0	0	0	112.6	G62 N63 A105 G106	G62-S84 CarbonylContact C-O 3.39Å; G62-S84 WeakPolarHBondContact CA-O 3.5Å; G62-S84 PolarHBondContact N-O 3.32Å; N63-S84 PolarHBondContact N-O 2.99Å; S84-A105 PolarHBondContact N-O 3.22Å; S84-G106 VanDerWaalsContact CA-O 3.32Å; S84-G106 WeakPolarHBondContact CA-O 3.47Å
85	N	98.2	Very high	97.4	Very high	10 Å²	10	46.7 Å²	46.7	5%	0.053	23%	0.229	C	C	.	.	S	Bend	trans	-129.3	-166.3	173.2	-82.3	-83.9	0	0	0	109.9	L60 N63 V65 L82 S83 I87 G106 N107	L60-N85 PolarHBondContact O-ND2 2.96Å; N63-N85 WeakPolarHBondContact CA-OD1 3.28Å; N63-N85 VanDerWaalsContact CB-OD1 3.26Å; N63-N85 WeakPolarHBondContact CB-OD1 3.4Å; N63-N85 WeakPolarHBondContact O-CA 3.32Å; N63-N85 PolarHBondContact O-OD1 3.25Å; N63-N85 VanDerWaalsContact O-OD1 3.1Å; V65-N85 HydrophobicContact CB-CB 4.46Å; V65-N85 WeakPolarHBondContact CB-OD1 3.34Å; V65-N85 WeakPolarHBondContact CG2-OD1 3.48Å; V65-N85 PolarHBondContact N-OD1 3.37Å; L82-N85 PolarHBondContact O-ND2 2.97Å; S83-N85 PolarHBondContact O-ND2 2.95Å; N85-I87 HydrophobicContact CB-CD1 3.91Å; N85-I87 HydrophobicContact CB-CG1 4.05Å; N85-G106 PolarHBondContact N-O 2.92Å; N85-N107 WeakPolarHBondContact CA-OD1 3.37Å; N85-N107 WeakPolarHBondContact CB-OD1 3.45Å; N85-N107 PolarHBondContact O-OD1 3.03Å
86	R	97.4	Very high	97.4	Very high	151 Å²	151	38.9 Å²	38.9	57%	0.57	20%	0.2	S	C	*	.			trans	-119.2	34.9	-178.5	-59.6	-176.8	-171.3	-168.3	3.4	112.2	V65 T66 N107	V65-R86 CarbonylContact O-C 3.47Å; V65-R86 PolarHBondContact O-N 3.27Å; T66-R86 HydrophobicContact CG2-CB 3.81Å; R86-N107 PolarHBondContact N-OD1 2.94Å
87	I	98.3	Very high	97.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.			trans	-81.7	129.5	-172.6	-56.8	159.1	0	0	0	109.8	V65 L68 L82 N85 N89 I90 L104 N107 V108	V65-I87 WeakPolarHBondContact O-CG1 3.13Å; L68-I87 HydrophobicContact CD1-CD1 4.33Å; L68-I87 HydrophobicContact CD1-CG2 3.92Å; L68-I87 HydrophobicContact CD2-CD1 3.89Å; L68-I87 HydrophobicContact CD2-CG1 4.25Å; L68-I87 HydrophobicContact CG-CD1 4.46Å; L68-I87 HydrophobicContact CG-CG2 4.26Å; L82-I87 HydrophobicContact CB-CD1 3.77Å; L82-I87 HydrophobicContact CD1-CD1 3.97Å; L82-I87 HydrophobicContact CD2-CD1 3.93Å; L82-I87 HydrophobicContact CG-CD1 4.1Å; N85-I87 HydrophobicContact CB-CD1 3.91Å; N85-I87 HydrophobicContact CB-CG1 4.05Å; I87-N89 WeakPolarHBondContact CG2-O 3.37Å; I87-I90 HydrophobicContact CG2-CG2 3.71Å; I87-L104 HydrophobicContact CD1-CD2 4.36Å; I87-N107 HydrophobicContact CB-CB 4.31Å; I87-N107 VanDerWaalsContact CB-OD1 3.28Å; I87-N107 WeakPolarHBondContact CB-OD1 3.49Å; I87-N107 WeakPolarHBondContact CD1-OD1 3.2Å; I87-N107 WeakPolarHBondContact CG1-OD1 3.25Å; I87-N107 PolarHBondContact N-OD1 3.42Å; I87-V108 CarbonylContact O-C 3.58Å; I87-V108 WeakPolarHBondContact O-CA 3.33Å; I87-V108 PolarHBondContact O-N 2.89Å
88	S	96.7	Very high	97.3	Very high	67 Å²	67	43 Å²	43	47%	0.469	22%	0.218	S	C	.	.			trans	-116.8	-30.8	169.9	57.1	0	0	0	0	112.3
89	N	97.1	Very high	97.4	Very high	94 Å²	94	42.2 Å²	42.2	50%	0.503	21%	0.212	S	C	.	.			trans	-107	120.7	178.4	-176.6	6.9	0	0	0	111	I87 E91	I87-N89 WeakPolarHBondContact CG2-O 3.37Å; N89-E91 WeakPolarHBondContact OD1-CB 3.35Å; N89-E91 PolarHBondContact OD1-N 3.04Å
90	I	97.7	Very high	97.3	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.217	C	C	.	.			trans	-114.1	7.6	179.3	51.7	160.2	0	0	0	113.3	L68 I87 P92 L93 L104 I109 S114 L115 L118	L68-I90 HydrophobicContact CD1-CG2 4.15Å; I87-I90 HydrophobicContact CG2-CG2 3.71Å; I90-P92 VanDerWaalsContact C-N 3.29Å; I90-L93 HydrophobicContact CB-CD1 4.2Å; I90-L93 HydrophobicContact CG2-CD1 4.3Å; I90-L93 WeakPolarHBondContact O-CB 3.25Å; I90-L93 PolarHBondContact O-N 3.47Å; I90-L104 HydrophobicContact CD1-CD1 4.44Å; I90-L104 HydrophobicContact CG2-CD1 4.15Å; I90-L104 HydrophobicContact CG2-CD2 4.05Å; I90-I109 HydrophobicContact CG2-CD1 4.15Å; I90-S114 WeakPolarHBondContact CD1-O 3.38Å; I90-S114 WeakPolarHBondContact CG1-O 3.26Å; I90-L115 HydrophobicContact CD1-CD2 3.91Å; I90-L118 HydrophobicContact CD1-CD1 3.69Å; I90-L118 HydrophobicContact CD1-CD2 4.28Å; I90-L118 HydrophobicContact CD1-CG 3.9Å
91	E	97.3	Very high	97.3	Very high	79 Å²	79	46.2 Å²	46.2	37%	0.369	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-48	-41.8	176.9	-173	66.8	-162.1	0	0	113.6	N89 L93 R94 C117	N89-E91 WeakPolarHBondContact OD1-CB 3.35Å; N89-E91 PolarHBondContact OD1-N 3.04Å; E91-L93 PolarHBondContact O-N 3.02Å; E91-R94 WeakPolarHBondContact O-CB 3.45Å; E91-R94 WeakPolarHBondContact O-CG 3.49Å; E91-R94 PolarHBondContact O-N 2.8Å; E91-R94 VanDerWaalsContact O-N 3.11Å; E91-R94 WeakPolarHBondContact OE1-CD 3.06Å; E91-R94 IonicContact OE1-CZ 3.43Å; E91-R94 IonicContact OE1-NE 2.72Å; E91-R94 IonicContact OE1-NH1 2.73Å; E91-R94 PolarHBondContact OE1-NH1 2.91Å; E91-C117 WeakPolarHBondContact OE2-CB 3.47Å
92	P	97.4	Very high	97.3	Very high	24 Å²	24	44.8 Å²	44.8	16%	0.156	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.8	-22.2	-179.9	-26.5	37.4	0	0	0	114.9	L68 I90 R94	L68-P92 HydrophobicContact CB-CB 4.04Å; L68-P92 HydrophobicContact CB-CG 4.05Å; L68-P92 WeakPolarHBondContact O-CB 3.5Å; I90-P92 VanDerWaalsContact C-N 3.29Å; P92-R94 PolarHBondContact O-N 3.15Å
93	L	97.8	Very high	97.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-71.1	-15.6	-179.9	-61.3	-175.7	0	0	0	113.1	L68 L71 L80 L82 I90 E91 S95 C96 L102 L118	L68-L93 HydrophobicContact CD1-CD1 4Å; L68-L93 HydrophobicContact CD1-CD2 4.04Å; L68-L93 HydrophobicContact CD1-CG 3.88Å; L71-L93 HydrophobicContact CB-CD2 4.35Å; L71-L93 HydrophobicContact CD1-CD2 3.95Å; L80-L93 HydrophobicContact CD2-CD1 4.39Å; L80-L93 HydrophobicContact CD2-CD2 3.63Å; L82-L93 HydrophobicContact CD1-CD1 4.38Å; I90-L93 HydrophobicContact CB-CD1 4.2Å; I90-L93 HydrophobicContact CG2-CD1 4.3Å; I90-L93 WeakPolarHBondContact O-CB 3.25Å; I90-L93 PolarHBondContact O-N 3.47Å; E91-L93 PolarHBondContact O-N 3.02Å; L93-S95 PolarHBondContact O-N 2.87Å; L93-C96 WeakPolarHBondContact O-CB 3.37Å; L93-C96 PolarHBondContact O-N 3.47Å; L93-L102 HydrophobicContact CD1-CD1 4.1Å; L93-L102 HydrophobicContact CD1-CD2 4.02Å; L93-L118 HydrophobicContact CB-CD2 3.82Å; L93-L118 HydrophobicContact CD1-CD2 4.37Å
94	R	96.9	Very high	97.3	Very high	134 Å²	134	45.3 Å²	45.3	51%	0.506	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-56.3	-25.7	177.5	73.2	-176.1	-79.4	-179.1	-4.8	113.8	E91 P92 C117	E91-R94 WeakPolarHBondContact O-CB 3.45Å; E91-R94 WeakPolarHBondContact O-CG 3.49Å; E91-R94 PolarHBondContact O-N 2.8Å; E91-R94 VanDerWaalsContact O-N 3.11Å; E91-R94 WeakPolarHBondContact OE1-CD 3.06Å; E91-R94 IonicContact OE1-CZ 3.43Å; E91-R94 IonicContact OE1-NE 2.72Å; E91-R94 IonicContact OE1-NH1 2.73Å; E91-R94 PolarHBondContact OE1-NH1 2.91Å; P92-R94 PolarHBondContact O-N 3.15Å; R94-C117 WeakPolarHBondContact CB-O 3.36Å
95	S	96.5	Very high	97.3	Very high	44 Å²	44	43.9 Å²	43.9	31%	0.308	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-84.8	-10.5	-179.4	-60	0	0	0	0	113.4	S72 L93 E97	S72-S95 WeakPolarHBondContact O-CB 3.08Å; L93-S95 PolarHBondContact O-N 2.87Å; S95-E97 PolarHBondContact O-N 3.23Å
96	C	97.2	Very high	97.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.			trans	-82.6	62.8	177.6	-61.9	0	0	0	0	110.7	L71 L93 N98 L99 L121	L71-C96 PolarHBondContact O-SG 3.1Å; L93-C96 WeakPolarHBondContact O-CB 3.37Å; L93-C96 PolarHBondContact O-N 3.47Å; C96-N98 PolarHBondContact O-N 3.25Å; C96-L99 HydrophobicContact CB-CB 4.14Å; C96-L99 WeakPolarHBondContact O-CB 3.48Å; C96-L99 PolarHBondContact O-N 2.66Å; C96-L121 WeakPolarHBondContact O-CD2 3.47Å
97	E	95	Very high	97.3	Very high	125 Å²	125	37.4 Å²	37.4	58%	0.584	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.3	-170.5	-63.7	176.7	-174.2	0	0	114.8	S95	S95-E97 PolarHBondContact O-N 3.23Å
98	N	96.3	Very high	97.3	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.219	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	2.5	177.8	-71.1	-61.1	0	0	0	114.6	R75 L77 S78 C96 Q100 K123	R75-N98 WeakPolarHBondContact O-CB 3.36Å; R75-N98 PolarHBondContact O-ND2 3.23Å; L77-N98 CarbonylContact O-C 3.55Å; S78-N98 WeakPolarHBondContact CA-O 3.35Å; C96-N98 PolarHBondContact O-N 3.25Å; N98-Q100 PolarHBondContact O-N 3.41Å; N98-K123 PolarHBondContact OD1-NZ 3.47Å
99	L	97.9	Very high	97.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.			trans	-66.6	122.8	-175.3	-162.9	70.5	0	0	0	111.1	L77 L80 C96 L102 L121 K123 L124	L77-L99 HydrophobicContact CD2-CD1 4.33Å; L77-L99 HydrophobicContact CG-CD1 4.21Å; L77-L99 VanDerWaalsContact O-CA 3.26Å; L77-L99 WeakPolarHBondContact O-CA 3.14Å; L77-L99 PolarHBondContact O-N 2.87Å; L77-L99 VanDerWaalsContact O-N 3.11Å; L80-L99 HydrophobicContact CB-CD1 3.72Å; C96-L99 HydrophobicContact CB-CB 4.14Å; C96-L99 WeakPolarHBondContact O-CB 3.48Å; C96-L99 PolarHBondContact O-N 2.66Å; L99-L102 HydrophobicContact CD2-CB 4Å; L99-L102 HydrophobicContact CD2-CD1 4.21Å; L99-L102 HydrophobicContact CD2-CD2 4.03Å; L99-L102 HydrophobicContact CD2-CG 4.31Å; L99-L121 HydrophobicContact CB-CD1 4.4Å; L99-L121 HydrophobicContact CD2-CD1 4.1Å; L99-K123 CarbonylContact O-C 3.31Å; L99-K123 VanDerWaalsContact O-C 3.31Å; L99-L124 HydrophobicContact CD2-CD1 4.45Å; L99-L124 HydrophobicContact CG-CD1 4.38Å; L99-L124 WeakPolarHBondContact O-CA 3.4Å; L99-L124 PolarHBondContact O-N 2.86Å
100	Q	96.6	Very high	97.3	Very high	86 Å²	86	37.2 Å²	37.2	40%	0.402	20%	0.199	S	C	.	.			trans	-110.2	-35.1	-178.7	-67.1	172.6	9	0	0	112.3	S78 N98 K123 E125 N126	S78-Q100 PolarHBondContact O-N 2.86Å; N98-Q100 PolarHBondContact O-N 3.41Å; Q100-K123 WeakPolarHBondContact CA-O 3.46Å; Q100-K123 HydrophobicContact CG-CB 4.31Å; Q100-E125 PolarHBondContact O-N 2.87Å; Q100-N126 PolarHBondContact O-N 2.72Å
101	T	97.3	Very high	97.1	Very high	47 Å²	47	38.7 Å²	38.7	29%	0.288	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	122.3	-177.9	-60.3	0	0	0	0	110.3	S78 V79 L80 N126	S78-T101 PolarHBondContact O-N 3.3Å; V79-T101 WeakPolarHBondContact CA-O 3.35Å; V79-T101 HydrophobicContact CG1-CG2 4.38Å; L80-T101 PolarHBondContact N-O 3.27Å; T101-N126 WeakPolarHBondContact CA-O 3.32Å; T101-N126 HydrophobicContact CG2-CB 4.03Å; T101-N126 PolarHBondContact OG1-ND2 3.18Å
102	L	98.4	Very high	96.9	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	122	-179.3	178.7	56.1	0	0	0	110.6	L80 L82 L93 L99 L104 L118 L124 N126 I127 R128	L80-L102 HydrophobicContact CB-CD1 4.09Å; L80-L102 HydrophobicContact CD2-CD1 3.96Å; L80-L102 HydrophobicContact CG-CD1 4.02Å; L80-L102 WeakPolarHBondContact O-CA 3.28Å; L82-L102 HydrophobicContact CD1-CD1 4.5Å; L93-L102 HydrophobicContact CD1-CD1 4.1Å; L93-L102 HydrophobicContact CD1-CD2 4.02Å; L99-L102 HydrophobicContact CD2-CB 4Å; L99-L102 HydrophobicContact CD2-CD1 4.21Å; L99-L102 HydrophobicContact CD2-CD2 4.03Å; L99-L102 HydrophobicContact CD2-CG 4.31Å; L102-L104 HydrophobicContact CD1-CD1 4.25Å; L102-L104 HydrophobicContact CD1-CD2 4.38Å; L102-L104 HydrophobicContact CD1-CG 3.92Å; L102-L104 HydrophobicContact CD2-CD1 3.68Å; L102-L104 HydrophobicContact CD2-CG 4.27Å; L102-L104 HydrophobicContact CG-CD1 3.9Å; L102-L104 HydrophobicContact CG-CG 3.95Å; L102-L118 HydrophobicContact CD2-CD1 3.85Å; L102-L118 HydrophobicContact CD2-CD2 4.3Å; L102-L124 HydrophobicContact CB-CD1 3.93Å; L102-N126 PolarHBondContact N-O 2.91Å; L102-I127 CarbonylContact O-C 3.21Å; L102-I127 WeakPolarHBondContact O-CA 3.48Å; L102-R128 PolarHBondContact O-N 3.18Å
103	N	98.2	Very high	96.7	Very high	18 Å²	18	41.4 Å²	41.4	10%	0.096	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.1	171.7	-173.8	2.7	0	0	0	110.5	L80 N81 L82 S83 A105 R128	L80-N103 PolarHBondContact O-N 2.94Å; N81-N103 WeakPolarHBondContact OD1-CB 3.27Å; N81-N103 PolarHBondContact OD1-ND2 3.44Å; L82-N103 CarbonylContact C-O 3.55Å; L82-N103 WeakPolarHBondContact CA-O 3.36Å; L82-N103 PolarHBondContact N-O 2.89Å; S83-N103 PolarHBondContact N-O 2.9Å; S83-N103 PolarHBondContact OG-ND2 2.82Å; N103-A105 WeakPolarHBondContact OD1-CB 3.44Å; N103-A105 PolarHBondContact OD1-N 3.48Å; N103-R128 HydrophobicContact CB-CB 4.39Å; N103-R128 WeakPolarHBondContact OD1-CB 3.37Å
104	L	98.3	Very high	96.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.236	C	C	.	.			trans	-118.7	11.9	178.1	-71.9	163.1	0	0	0	111.6	L82 I87 I90 L102 G106 N107 I109 R128 L129 N138	L82-L104 HydrophobicContact CB-CD2 3.94Å; L82-L104 HydrophobicContact CD1-CD2 3.86Å; I87-L104 HydrophobicContact CD1-CD2 4.36Å; I90-L104 HydrophobicContact CD1-CD1 4.44Å; I90-L104 HydrophobicContact CG2-CD1 4.15Å; I90-L104 HydrophobicContact CG2-CD2 4.05Å; L102-L104 HydrophobicContact CD1-CD1 4.25Å; L102-L104 HydrophobicContact CD1-CD2 4.38Å; L102-L104 HydrophobicContact CD1-CG 3.92Å; L102-L104 HydrophobicContact CD2-CD1 3.68Å; L102-L104 HydrophobicContact CD2-CG 4.27Å; L102-L104 HydrophobicContact CG-CD1 3.9Å; L102-L104 HydrophobicContact CG-CG 3.95Å; L104-G106 PolarHBondContact O-N 3.45Å; L104-N107 WeakPolarHBondContact O-CB 3.48Å; L104-N107 PolarHBondContact O-ND2 3.26Å; L104-I109 HydrophobicContact CB-CD1 4.11Å; L104-I109 HydrophobicContact CD1-CD1 3.89Å; L104-I109 HydrophobicContact CD2-CD1 4.45Å; L104-I109 HydrophobicContact CG-CD1 4.39Å; L104-R128 CarbonylContact C-O 3.5Å; L104-R128 WeakPolarHBondContact CA-O 3.47Å; L104-R128 PolarHBondContact N-O 2.92Å; L104-L129 HydrophobicContact CB-CD2 3.83Å; L104-L129 HydrophobicContact CD1-CD2 3.92Å; L104-N138 PolarHBondContact O-ND2 3.04Å
105	A	97.8	Very high	96.3	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.211	C	C	.	.			trans	-56.3	138.8	-178.4	0	0	0	0	0	112.1	S83 S84 N103 R128 D131	S83-A105 CarbonylContact C-O 3.47Å; S83-A105 WeakPolarHBondContact CA-O 3.48Å; S83-A105 WeakPolarHBondContact CB-O 3.16Å; S84-A105 PolarHBondContact N-O 3.22Å; N103-A105 WeakPolarHBondContact OD1-CB 3.44Å; N103-A105 PolarHBondContact OD1-N 3.48Å; A105-R128 PolarHBondContact N-O 3.19Å; A105-D131 HydrophobicContact CB-CB 3.85Å
106	G	96.7	Very high	96.2	Very high	16 Å²	16	41 Å²	41	17%	0.165	23%	0.225	C	C	.	.	S	Bend	trans	70.8	44.9	179.2	0	0	0	0	0	113	S84 N85 L104	S84-G106 VanDerWaalsContact CA-O 3.32Å; S84-G106 WeakPolarHBondContact CA-O 3.47Å; N85-G106 PolarHBondContact N-O 2.92Å; L104-G106 PolarHBondContact O-N 3.45Å
107	N	98.5	Very high	96.1	Very high	9 Å²	9	41.8 Å²	41.8	5%	0.048	23%	0.23	C	C	.	.	S	Bend	trans	-119.2	-166.6	169.9	-81.8	-77.1	0	0	0	109.4	L82 N85 R86 I87 L104 N138	L82-N107 PolarHBondContact O-ND2 2.79Å; N85-N107 WeakPolarHBondContact CA-OD1 3.37Å; N85-N107 WeakPolarHBondContact CB-OD1 3.45Å; N85-N107 PolarHBondContact O-OD1 3.03Å; R86-N107 PolarHBondContact N-OD1 2.94Å; I87-N107 HydrophobicContact CB-CB 4.31Å; I87-N107 VanDerWaalsContact CB-OD1 3.28Å; I87-N107 WeakPolarHBondContact CB-OD1 3.49Å; I87-N107 WeakPolarHBondContact CD1-OD1 3.2Å; I87-N107 WeakPolarHBondContact CG1-OD1 3.25Å; I87-N107 PolarHBondContact N-OD1 3.42Å; L104-N107 WeakPolarHBondContact O-CB 3.48Å; L104-N107 PolarHBondContact O-ND2 3.26Å; N107-N138 WeakPolarHBondContact CA-OD1 3.36Å; N107-N138 WeakPolarHBondContact CB-OD1 3.34Å; N107-N138 PolarHBondContact N-OD1 2.98Å; N107-N138 PolarHBondContact O-OD1 2.69Å; N107-N138 VanDerWaalsContact O-OD1 3.1Å
108	V	97.7	Very high	96.2	Very high	72 Å²	72	35.8 Å²	35.8	44%	0.436	20%	0.203	S	C	.	.			trans	-114.9	32.6	-173.4	-153	0	0	0	0	111.7	I87 S110 N138	I87-V108 CarbonylContact O-C 3.58Å; I87-V108 WeakPolarHBondContact O-CA 3.33Å; I87-V108 PolarHBondContact O-N 2.89Å; V108-S110 PolarHBondContact O-N 3.22Å; V108-N138 PolarHBondContact N-OD1 2.88Å
109	I	97.6	Very high	96.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.			trans	-74.8	111.1	178.1	-57.4	168.2	0	0	0	109	I90 L104 L115 L129 N138 P139 V140	I90-I109 HydrophobicContact CG2-CD1 4.15Å; L104-I109 HydrophobicContact CB-CD1 4.11Å; L104-I109 HydrophobicContact CD1-CD1 3.89Å; L104-I109 HydrophobicContact CD2-CD1 4.45Å; L104-I109 HydrophobicContact CG-CD1 4.39Å; I109-L115 HydrophobicContact CG2-CD2 4.08Å; I109-L129 HydrophobicContact CD1-CD2 4.22Å; I109-N138 HydrophobicContact CB-CB 4.2Å; I109-N138 VanDerWaalsContact CB-OD1 3.31Å; I109-N138 WeakPolarHBondContact CB-OD1 3.37Å; I109-N138 WeakPolarHBondContact CG1-OD1 3.26Å; I109-N138 PolarHBondContact N-OD1 3.28Å; I109-P139 VanDerWaalsContact O-CD 3.25Å; I109-P139 WeakPolarHBondContact O-CD 3.49Å; I109-V140 HydrophobicContact CG2-CG1 4.28Å; I109-V140 WeakPolarHBondContact O-CB 3.4Å; I109-V140 PolarHBondContact O-N 2.83Å
110	S	95.8	Very high	95.8	Very high	84 Å²	84	40.1 Å²	40.1	59%	0.587	23%	0.233	S	C	*	.			trans	-92.8	-20.4	-168.7	52.7	0	0	0	0	115.2	V108	V108-S110 PolarHBondContact O-N 3.22Å
111	S	94.4	Very high	95.8	Very high	32 Å²	32	36.3 Å²	36.3	22%	0.224	22%	0.215	C	C	.	.			trans	-146.2	156.6	-169.3	90.8	0	0	0	0	113.1	E113 S114	S111-E113 VanDerWaalsContact C-N 3.31Å; S111-E113 WeakPolarHBondContact CB-OE2 3.31Å; S111-E113 PolarHBondContact OG-OE2 3.38Å; S111-S114 WeakPolarHBondContact O-CB 3.25Å; S111-S114 PolarHBondContact O-N 3.48Å; S111-S114 PolarHBondContact OG-OG 2.87Å
112	T	92.6	Very high	95.5	Very high	29 Å²	29	42.3 Å²	42.3	18%	0.178	24%	0.238	C	C	.	.	S	Bend	trans	-70.4	-28.3	178.9	37.6	0	0	0	0	112.4	S114 L115 V140 V149	T112-S114 PolarHBondContact O-N 3.4Å; T112-L115 WeakPolarHBondContact O-CB 3.3Å; T112-L115 PolarHBondContact O-N 2.88Å; T112-V140 HydrophobicContact CG2-CG2 3.78Å; T112-V149 HydrophobicContact CG2-CB 4.25Å; T112-V149 HydrophobicContact CG2-CG1 3.76Å
113	E	92.4	Very high	95.4	Very high	131 Å²	131	47.2 Å²	47.2	61%	0.612	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-61	-34.4	176.4	-58.1	69.7	-146.8	0	0	111	S111 L115 H116	S111-E113 VanDerWaalsContact C-N 3.31Å; S111-E113 WeakPolarHBondContact CB-OE2 3.31Å; S111-E113 PolarHBondContact OG-OE2 3.38Å; E113-L115 PolarHBondContact O-N 2.7Å; E113-L115 VanDerWaalsContact O-N 3.17Å; E113-H116 VanDerWaalsContact O-CB 3.27Å; E113-H116 WeakPolarHBondContact O-CB 3.47Å; E113-H116 PolarHBondContact O-N 3.46Å; E113-H116 VanDerWaalsContact O-N 3.1Å
114	S	92.6	Very high	95.3	Very high	41 Å²	41	46.6 Å²	46.6	29%	0.287	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-62.9	-21.7	177.1	-54.6	0	0	0	0	112.8	I90 S111 T112	I90-S114 WeakPolarHBondContact CD1-O 3.38Å; I90-S114 WeakPolarHBondContact CG1-O 3.26Å; S111-S114 WeakPolarHBondContact O-CB 3.25Å; S111-S114 PolarHBondContact O-N 3.48Å; S111-S114 PolarHBondContact OG-OG 2.87Å; T112-S114 PolarHBondContact O-N 3.4Å
115	L	95.4	Very high	95.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-83.8	-14.9	179.5	-54	176.7	0	0	0	112.7	I90 I109 T112 E113 C117 L118 L129 V150 M153 F154	I90-L115 HydrophobicContact CD1-CD2 3.91Å; I109-L115 HydrophobicContact CG2-CD2 4.08Å; T112-L115 WeakPolarHBondContact O-CB 3.3Å; T112-L115 PolarHBondContact O-N 2.88Å; E113-L115 PolarHBondContact O-N 2.7Å; E113-L115 VanDerWaalsContact O-N 3.17Å; L115-C117 PolarHBondContact O-N 2.87Å; L115-C117 VanDerWaalsContact O-N 3.12Å; L115-L118 WeakPolarHBondContact O-CB 3.34Å; L115-L118 PolarHBondContact O-N 2.84Å; L115-L129 HydrophobicContact CD1-CD1 3.55Å; L115-L129 HydrophobicContact CD2-CD1 3.76Å; L115-L129 HydrophobicContact CD2-CD2 4.2Å; L115-L129 HydrophobicContact CG-CD1 4.32Å; L115-V150 HydrophobicContact CD1-CG2 3.74Å; L115-M153 HydrophobicContact CB-SD 3.84Å; L115-F154 HydrophobicContact CB-CE2 4.35Å; L115-F154 HydrophobicContact CB-CZ 4.27Å
116	H	94.6	Very high	95	Very high	129 Å²	129	51.9 Å²	51.9	60%	0.597	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-60.8	-27.5	-173.2	-167.1	-68.5	0	0	0	112.8	E113 L118 V119	E113-H116 VanDerWaalsContact O-CB 3.27Å; E113-H116 WeakPolarHBondContact O-CB 3.47Å; E113-H116 PolarHBondContact O-N 3.46Å; E113-H116 VanDerWaalsContact O-N 3.1Å; H116-L118 PolarHBondContact O-N 3.17Å; H116-V119 WeakPolarHBondContact O-CB 3.35Å; H116-V119 WeakPolarHBondContact O-CG2 3.5Å; H116-V119 PolarHBondContact O-N 3.26Å; H116-V119 VanDerWaalsContact O-N 3.15Å
117	C	94.2	Very high	95	Very high	16 Å²	16	51.1 Å²	51.1	11%	0.108	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-63	-22.5	175.8	68.2	0	0	0	0	113.4	E91 R94 L115 S120	E91-C117 WeakPolarHBondContact OE2-CB 3.47Å; R94-C117 WeakPolarHBondContact CB-O 3.36Å; L115-C117 PolarHBondContact O-N 2.87Å; L115-C117 VanDerWaalsContact O-N 3.12Å; C117-S120 PolarHBondContact O-OG 2.96Å
118	L	96.1	Very high	94.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-84.1	-12.4	178.9	-54.2	179.6	0	0	0	112.5	I90 L93 L102 L115 H116 S120 L121 I127 F154	I90-L118 HydrophobicContact CD1-CD1 3.69Å; I90-L118 HydrophobicContact CD1-CD2 4.28Å; I90-L118 HydrophobicContact CD1-CG 3.9Å; L93-L118 HydrophobicContact CB-CD2 3.82Å; L93-L118 HydrophobicContact CD1-CD2 4.37Å; L102-L118 HydrophobicContact CD2-CD1 3.85Å; L102-L118 HydrophobicContact CD2-CD2 4.3Å; L115-L118 WeakPolarHBondContact O-CB 3.34Å; L115-L118 PolarHBondContact O-N 2.84Å; H116-L118 PolarHBondContact O-N 3.17Å; L118-S120 PolarHBondContact O-N 2.74Å; L118-L121 HydrophobicContact CB-CD1 4.22Å; L118-L121 HydrophobicContact CD2-CD1 3.76Å; L118-L121 VanDerWaalsContact O-CB 3.22Å; L118-L121 WeakPolarHBondContact O-CB 3.45Å; L118-L121 WeakPolarHBondContact O-CG 3.15Å; L118-L121 PolarHBondContact O-N 3.06Å; L118-I127 HydrophobicContact CD1-CD1 4.05Å; L118-F154 HydrophobicContact CB-CE1 3.74Å; L118-F154 HydrophobicContact CB-CZ 3.87Å
119	V	94.4	Very high	94.8	Very high	62 Å²	62	52 Å²	52	38%	0.376	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28	-177	175	0	0	0	0	111.6	H116 L121 M153 F154	H116-V119 WeakPolarHBondContact O-CB 3.35Å; H116-V119 WeakPolarHBondContact O-CG2 3.5Å; H116-V119 PolarHBondContact O-N 3.26Å; H116-V119 VanDerWaalsContact O-N 3.15Å; V119-L121 PolarHBondContact O-N 3.18Å; V119-M153 HydrophobicContact CG2-CG 3.36Å; V119-M153 HydrophobicContact CG2-SD 3.89Å; V119-F154 HydrophobicContact CG2-CE1 3.99Å; V119-F154 HydrophobicContact CG2-CZ 4.29Å
120	S	92.5	Very high	94.7	Very high	69 Å²	69	56.3 Å²	56.3	48%	0.483	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-15.8	174.8	57	0	0	0	0	113.9	C117 L118 K122	C117-S120 PolarHBondContact O-OG 2.96Å; L118-S120 PolarHBondContact O-N 2.74Å; S120-K122 PolarHBondContact O-N 2.78Å
121	L	95.4	Very high	94.4	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	26%	0.262	C	S	.	.			trans	-80.8	78.3	-177.3	-55	-177.3	0	0	0	111	C96 L99 L118 V119 K123 L124	C96-L121 WeakPolarHBondContact O-CD2 3.47Å; L99-L121 HydrophobicContact CB-CD1 4.4Å; L99-L121 HydrophobicContact CD2-CD1 4.1Å; L118-L121 HydrophobicContact CB-CD1 4.22Å; L118-L121 HydrophobicContact CD2-CD1 3.76Å; L118-L121 VanDerWaalsContact O-CB 3.22Å; L118-L121 WeakPolarHBondContact O-CB 3.45Å; L118-L121 WeakPolarHBondContact O-CG 3.15Å; L118-L121 PolarHBondContact O-N 3.06Å; V119-L121 PolarHBondContact O-N 3.18Å; L121-K123 PolarHBondContact O-N 2.76Å; L121-K123 VanDerWaalsContact O-N 3.1Å; L121-L124 HydrophobicContact CB-CB 4.04Å; L121-L124 VanDerWaalsContact O-CB 3.28Å; L121-L124 WeakPolarHBondContact O-CB 3.41Å; L121-L124 PolarHBondContact O-N 3.29Å
122	K	93	Very high	93.9	Very high	174 Å²	174	56.7 Å²	56.7	76%	0.757	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.7	-175	-63.5	-179.9	-179.1	178.4	0	114.8	S120	S120-K122 PolarHBondContact O-N 2.78Å
123	K	95.1	Very high	93.5	Very high	104 Å²	104	60.8 Å²	60.8	45%	0.452	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.7	-179.6	-67.4	-178.6	178.2	-177.9	0	113.3	N98 L99 Q100 L121 E125	N98-K123 PolarHBondContact OD1-NZ 3.47Å; L99-K123 CarbonylContact O-C 3.31Å; L99-K123 VanDerWaalsContact O-C 3.31Å; Q100-K123 WeakPolarHBondContact CA-O 3.46Å; Q100-K123 HydrophobicContact CG-CB 4.31Å; L121-K123 PolarHBondContact O-N 2.76Å; L121-K123 VanDerWaalsContact O-N 3.1Å; K123-E125 PolarHBondContact O-N 2.79Å
124	L	96.4	Very high	92.9	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.026	30%	0.302	C	S	.	.			trans	-71.5	114.5	-177.9	-171.1	67	0	0	0	110	L99 L102 L121 I127 I157	L99-L124 HydrophobicContact CD2-CD1 4.45Å; L99-L124 HydrophobicContact CG-CD1 4.38Å; L99-L124 WeakPolarHBondContact O-CA 3.4Å; L99-L124 PolarHBondContact O-N 2.86Å; L102-L124 HydrophobicContact CB-CD1 3.93Å; L121-L124 HydrophobicContact CB-CB 4.04Å; L121-L124 VanDerWaalsContact O-CB 3.28Å; L121-L124 WeakPolarHBondContact O-CB 3.41Å; L121-L124 PolarHBondContact O-N 3.29Å; L124-I127 HydrophobicContact CD2-CD1 4.37Å; L124-I157 HydrophobicContact CG-CD1 4.29Å
125	E	94.4	Very high	92.7	Very high	67 Å²	67	66.7 Å²	66.7	31%	0.313	33%	0.325	S	S	.	.			trans	-113.2	-24.8	-177.3	-64.1	-172.8	166.9	0	0	112.5	Q100 K123 I157 K158 V159	Q100-E125 PolarHBondContact O-N 2.87Å; K123-E125 PolarHBondContact O-N 2.79Å; E125-I157 WeakPolarHBondContact O-CD1 3.47Å; E125-K158 HydrophobicContact CB-CD 4.22Å; E125-K158 HydrophobicContact CB-CG 4.22Å; E125-K158 HydrophobicContact CG-CD 4.31Å; E125-K158 WeakPolarHBondContact O-CA 3.42Å; E125-K158 PolarHBondContact O-N 2.93Å; E125-K158 WeakPolarHBondContact OE1-CE 3.47Å; E125-K158 IonicContact OE1-NZ 3.21Å; E125-K158 PolarHBondContact OE1-NZ 3.03Å; E125-K158 WeakPolarHBondContact OE2-CD 3.27Å; E125-K158 WeakPolarHBondContact OE2-CE 3.14Å; E125-K158 IonicContact OE2-NZ 3.25Å; E125-K158 PolarHBondContact OE2-NZ 3.11Å; E125-V159 PolarHBondContact O-N 3.02Å; E125-V159 VanDerWaalsContact O-N 3.13Å
126	N	95.5	Very high	92.5	Very high	43 Å²	43	70 Å²	70	23%	0.23	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	119.7	-176.7	-53.5	-79.1	0	0	0	109.9	Q100 T101 L102 V159	Q100-N126 PolarHBondContact O-N 2.72Å; T101-N126 WeakPolarHBondContact CA-O 3.32Å; T101-N126 HydrophobicContact CG2-CB 4.03Å; T101-N126 PolarHBondContact OG1-ND2 3.18Å; L102-N126 PolarHBondContact N-O 2.91Å; N126-V159 WeakPolarHBondContact CA-O 3.29Å; N126-V159 HydrophobicContact CB-CB 4.38Å; N126-V159 WeakPolarHBondContact OD1-CB 3.21Å; N126-V159 WeakPolarHBondContact OD1-CG2 3.47Å
127	I	96.5	Very high	92.5	Very high	1 Å²	1	66.3 Å²	66.3	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.7	176.7	-165.7	174	0	0	0	109.9	L102 L118 L124 L129 I157 V159 L160 D161	L102-I127 CarbonylContact O-C 3.21Å; L102-I127 WeakPolarHBondContact O-CA 3.48Å; L118-I127 HydrophobicContact CD1-CD1 4.05Å; L124-I127 HydrophobicContact CD2-CD1 4.37Å; I127-L129 HydrophobicContact CD1-CD2 4.33Å; I127-L129 HydrophobicContact CD1-CG 4.43Å; I127-L129 HydrophobicContact CG1-CD2 4.39Å; I127-L129 HydrophobicContact CG1-CG 4.42Å; I127-I157 HydrophobicContact CB-CD1 3.91Å; I127-I157 HydrophobicContact CG2-CD1 3.61Å; I127-I157 HydrophobicContact CG2-CG1 3.87Å; I127-V159 PolarHBondContact N-O 2.78Å; I127-L160 HydrophobicContact CG2-CD1 3.59Å; I127-L160 CarbonylContact O-C 3.5Å; I127-L160 WeakPolarHBondContact O-CA 3.19Å; I127-D161 PolarHBondContact O-N 2.91Å
128	R	96.4	Very high	92.7	Very high	100 Å²	100	65.6 Å²	65.6	38%	0.377	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.7	172.2	-63.6	-173	176.1	167.1	-1	109.8	L102 N103 L104 A105	L102-R128 PolarHBondContact O-N 3.18Å; N103-R128 HydrophobicContact CB-CB 4.39Å; N103-R128 WeakPolarHBondContact OD1-CB 3.37Å; L104-R128 CarbonylContact C-O 3.5Å; L104-R128 WeakPolarHBondContact CA-O 3.47Å; L104-R128 PolarHBondContact N-O 2.92Å; A105-R128 PolarHBondContact N-O 3.19Å
129	L	96.5	Very high	92.7	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	-111.2	-15.3	171	-55.2	177.3	0	0	0	111.4	L104 I109 L115 I127 N138 V140 C141 Y146 D161	L104-L129 HydrophobicContact CB-CD2 3.83Å; L104-L129 HydrophobicContact CD1-CD2 3.92Å; I109-L129 HydrophobicContact CD1-CD2 4.22Å; L115-L129 HydrophobicContact CD1-CD1 3.55Å; L115-L129 HydrophobicContact CD2-CD1 3.76Å; L115-L129 HydrophobicContact CD2-CD2 4.2Å; L115-L129 HydrophobicContact CG-CD1 4.32Å; I127-L129 HydrophobicContact CD1-CD2 4.33Å; I127-L129 HydrophobicContact CD1-CG 4.43Å; I127-L129 HydrophobicContact CG1-CD2 4.39Å; I127-L129 HydrophobicContact CG1-CG 4.42Å; L129-N138 PolarHBondContact O-N 3.24Å; L129-N138 PolarHBondContact O-ND2 3.18Å; L129-V140 HydrophobicContact CD1-CG1 4.34Å; L129-C141 PolarHBondContact O-SG 2.9Å; L129-Y146 HydrophobicContact CB-CE2 4.38Å; L129-Y146 WeakPolarHBondContact CB-OH 3.38Å; L129-Y146 HydrophobicContact CD1-CE2 3.61Å; L129-Y146 WeakPolarHBondContact CD1-OH 3.35Å; L129-D161 PolarHBondContact N-OD1 3.29Å
130	R	94.6	Very high	92.8	Very high	89 Å²	89	64.9 Å²	64.9	34%	0.336	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.1	165.4	55.6	179.3	-76.1	-178.3	-1.4	111.2	N132 Y136 C141 D161	R130-N132 PolarHBondContact NE-OD1 2.94Å; R130-N132 VanDerWaalsContact NE-OD1 3.09Å; R130-N132 PolarHBondContact NH2-ND2 2.8Å; R130-N132 PolarHBondContact NH2-OD1 3.33Å; R130-Y136 CarbonylContact C-O 3.54Å; R130-Y136 VanDerWaalsContact CA-O 3.27Å; R130-Y136 WeakPolarHBondContact CA-O 3.46Å; R130-C141 HydrophobicContact CB-CB 4.29Å; R130-C141 HydrophobicContact CG-CB 4.44Å; R130-D161 HydrophobicContact CG-CB 3.68Å; R130-D161 WeakPolarHBondContact CG-OD1 3.37Å; R130-D161 WeakPolarHBondContact CG-OD2 3.41Å; R130-D161 PolarHBondContact N-OD1 3.01Å
131	D	90.3	Very high	92.9	Very high	22 Å²	22	62.1 Å²	62.1	12%	0.118	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	112	171.9	-171.3	-28.2	0	0	0	108.1	A105 T133 N135 Y136	A105-D131 HydrophobicContact CB-CB 3.85Å; D131-T133 VanDerWaalsContact C-N 3.28Å; D131-T133 PolarHBondContact O-N 3.1Å; D131-T133 WeakPolarHBondContact OD1-CA 3.49Å; D131-T133 WeakPolarHBondContact OD1-CB 3.36Å; D131-T133 PolarHBondContact OD1-N 3.47Å; D131-T133 PolarHBondContact OD1-OG1 2.89Å; D131-N135 WeakPolarHBondContact O-CA 3.41Å; D131-N135 PolarHBondContact O-N 3.18Å; D131-N135 VanDerWaalsContact O-N 3.17Å; D131-Y136 PolarHBondContact N-O 3.27Å; D131-Y136 PolarHBondContact O-N 3.23Å
132	N	82.8	Confident	92.8	Very high	103 Å²	103	71.9 Å²	71.9	55%	0.551	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.4	-178.6	-63.2	-17.9	0	0	0	112.4	R130	R130-N132 PolarHBondContact NE-OD1 2.94Å; R130-N132 VanDerWaalsContact NE-OD1 3.09Å; R130-N132 PolarHBondContact NH2-ND2 2.8Å; R130-N132 PolarHBondContact NH2-OD1 3.33Å
133	T	84	Confident	92.8	Very high	115 Å²	115	66.4 Å²	66.4	71%	0.706	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-43.2	-176.4	-39.4	0	0	0	0	111.1	D131	D131-T133 VanDerWaalsContact C-N 3.28Å; D131-T133 PolarHBondContact O-N 3.1Å; D131-T133 WeakPolarHBondContact OD1-CA 3.49Å; D131-T133 WeakPolarHBondContact OD1-CB 3.36Å; D131-T133 PolarHBondContact OD1-N 3.47Å; D131-T133 PolarHBondContact OD1-OG1 2.89Å
134	Y	80.1	Confident	92.6	Very high	153 Å²	153	66.7 Å²	66.7	60%	0.6	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	8.1	-178.5	-60.8	-76.5	0	0	0	112.6	Y136	Y134-Y136 VanDerWaalsContact CB-CE2 3.43Å; Y134-Y136 HydrophobicContact CG-CD2 4.3Å; Y134-Y136 HydrophobicContact CG-CE2 4.1Å; Y134-Y136 PolarHBondContact O-N 3.46Å
135	N	88.2	Confident	92.4	Very high	143 Å²	143	69.5 Å²	69.5	77%	0.765	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	36.1	-175.9	-165.1	33.6	0	0	0	113.4	D131	D131-N135 WeakPolarHBondContact O-CA 3.41Å; D131-N135 PolarHBondContact O-N 3.18Å; D131-N135 VanDerWaalsContact O-N 3.17Å
136	Y	91.9	Very high	92.4	Very high	69 Å²	69	66.6 Å²	66.6	27%	0.271	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.2	176.2	-72.9	-40.9	0	0	0	109.2	F61 R130 D131 Y134	F61-Y136 AromaticContact CE2-CE2 3.82Å; F61-Y136 HydrophobicContact CE2-CE2 3.82Å; F61-Y136 HydrophobicContact CZ-CE2 4.24Å; R130-Y136 CarbonylContact C-O 3.54Å; R130-Y136 VanDerWaalsContact CA-O 3.27Å; R130-Y136 WeakPolarHBondContact CA-O 3.46Å; D131-Y136 PolarHBondContact N-O 3.27Å; D131-Y136 PolarHBondContact O-N 3.23Å; Y134-Y136 VanDerWaalsContact CB-CE2 3.43Å; Y134-Y136 HydrophobicContact CG-CD2 4.3Å; Y134-Y136 HydrophobicContact CG-CE2 4.1Å; Y134-Y136 PolarHBondContact O-N 3.46Å
137	S	94.6	Very high	92.2	Very high	51 Å²	51	66.8 Å²	66.8	36%	0.357	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	143.7	-179.5	-174.7	0	0	0	0	110.6	C141	S137-C141 WeakPolarHBondContact OG-CB 3.4Å
138	N	97.5	Very high	92	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.005	37%	0.365	C	S	.	.			trans	-82.8	154.1	165.2	-77.1	-89.3	0	0	0	110.5	L104 N107 V108 I109 L129 V140 C141	L104-N138 PolarHBondContact O-ND2 3.04Å; N107-N138 WeakPolarHBondContact CA-OD1 3.36Å; N107-N138 WeakPolarHBondContact CB-OD1 3.34Å; N107-N138 PolarHBondContact N-OD1 2.98Å; N107-N138 PolarHBondContact O-OD1 2.69Å; N107-N138 VanDerWaalsContact O-OD1 3.1Å; V108-N138 PolarHBondContact N-OD1 2.88Å; I109-N138 HydrophobicContact CB-CB 4.2Å; I109-N138 VanDerWaalsContact CB-OD1 3.31Å; I109-N138 WeakPolarHBondContact CB-OD1 3.37Å; I109-N138 WeakPolarHBondContact CG1-OD1 3.26Å; I109-N138 PolarHBondContact N-OD1 3.28Å; L129-N138 PolarHBondContact O-N 3.24Å; L129-N138 PolarHBondContact O-ND2 3.18Å; N138-V140 HydrophobicContact CB-CG1 3.86Å; N138-V140 PolarHBondContact O-N 3.1Å; N138-C141 WeakPolarHBondContact O-CB 3.18Å; N138-C141 PolarHBondContact O-N 3.41Å; N138-C141 VanDerWaalsContact O-N 3.14Å
139	P	97.4	Very high	91.9	Very high	40 Å²	40	66.5 Å²	66.5	26%	0.26	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-58.5	-32.6	174.5	-18.8	24.9	0	0	0	113.6	I109 C141 R142	I109-P139 VanDerWaalsContact O-CD 3.25Å; I109-P139 WeakPolarHBondContact O-CD 3.49Å; P139-C141 PolarHBondContact O-N 3.46Å; P139-R142 WeakPolarHBondContact O-CB 3.37Å; P139-R142 WeakPolarHBondContact O-CG 3.36Å; P139-R142 PolarHBondContact O-N 2.91Å; P139-R142 VanDerWaalsContact O-N 3.08Å
140	V	96.5	Very high	91.8	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.042	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-56.3	-31.7	176.1	70.3	0	0	0	0	112.8	I109 T112 L129 N138 R142 S143 Y146	I109-V140 HydrophobicContact CG2-CG1 4.28Å; I109-V140 WeakPolarHBondContact O-CB 3.4Å; I109-V140 PolarHBondContact O-N 2.83Å; T112-V140 HydrophobicContact CG2-CG2 3.78Å; L129-V140 HydrophobicContact CD1-CG1 4.34Å; N138-V140 HydrophobicContact CB-CG1 3.86Å; N138-V140 PolarHBondContact O-N 3.1Å; V140-R142 PolarHBondContact O-N 3.37Å; V140-S143 PolarHBondContact O-N 2.76Å; V140-Y146 HydrophobicContact CG1-CD2 4.25Å; V140-Y146 HydrophobicContact CG1-CE2 4.11Å; V140-Y146 HydrophobicContact CG2-CD2 4.03Å
141	C	94.6	Very high	91.6	Very high	11 Å²	11	64.8 Å²	64.8	7%	0.074	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-72.5	-8.1	-178.7	-57.1	0	0	0	0	113.9	L129 R130 S137 N138 P139 S143 Y146	L129-C141 PolarHBondContact O-SG 2.9Å; R130-C141 HydrophobicContact CB-CB 4.29Å; R130-C141 HydrophobicContact CG-CB 4.44Å; S137-C141 WeakPolarHBondContact OG-CB 3.4Å; N138-C141 WeakPolarHBondContact O-CB 3.18Å; N138-C141 PolarHBondContact O-N 3.41Å; N138-C141 VanDerWaalsContact O-N 3.14Å; P139-C141 PolarHBondContact O-N 3.46Å; C141-S143 VanDerWaalsContact C-N 3.33Å; C141-Y146 HydrophobicContact CB-CD1 4.34Å; C141-Y146 HydrophobicContact CB-CE1 4.37Å
142	R	93.6	Very high	91.7	Very high	211 Å²	211	71.4 Å²	71.4	80%	0.796	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-77.2	-20.1	176.6	-64	179	179.9	159.8	0.5	112.9	P139 V140	P139-R142 WeakPolarHBondContact O-CB 3.37Å; P139-R142 WeakPolarHBondContact O-CG 3.36Å; P139-R142 PolarHBondContact O-N 2.91Å; P139-R142 VanDerWaalsContact O-N 3.08Å; V140-R142 PolarHBondContact O-N 3.37Å
143	S	92.8	Very high	92.2	Very high	59 Å²	59	68.3 Å²	68.3	41%	0.413	37%	0.37	S	S	.	.	S	Bend	trans	-70.2	136.3	176.5	-178.8	0	0	0	0	110.6	V140 C141 S145 Y146	V140-S143 PolarHBondContact O-N 2.76Å; C141-S143 VanDerWaalsContact C-N 3.33Å; S143-S145 PolarHBondContact O-N 3.09Å; S143-S145 PolarHBondContact OG-N 3.09Å; S143-S145 PolarHBondContact OG-OG 2.95Å; S143-Y146 WeakPolarHBondContact O-CB 3.33Å; S143-Y146 PolarHBondContact O-N 3.31Å
144	A	90.4	Very high	92.7	Very high	110 Å²	110	63.5 Å²	63.5	91%	0.909	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-30.5	173.9	0	0	0	0	0	112.4	Y146	A144-Y146 VanDerWaalsContact C-N 3.33Å
145	S	91.9	Very high	92.9	Very high	64 Å²	64	61.1 Å²	61.1	45%	0.448	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.1	178.5	61.3	0	0	0	0	113.8	S143 R147 A148 V149	S143-S145 PolarHBondContact O-N 3.09Å; S143-S145 PolarHBondContact OG-N 3.09Å; S143-S145 PolarHBondContact OG-OG 2.95Å; S145-R147 VanDerWaalsContact C-N 3.29Å; S145-R147 PolarHBondContact O-N 3.44Å; S145-A148 PolarHBondContact O-N 2.93Å; S145-A148 VanDerWaalsContact O-N 3.13Å; S145-V149 WeakPolarHBondContact O-CG2 3.41Å; S145-V149 PolarHBondContact O-N 2.76Å
146	Y	93.6	Very high	92.8	Very high	6 Å²	6	59.1 Å²	59.1	2%	0.024	33%	0.332	C	S	.	.	H	α-helix	trans	-45.2	-53.3	-175.7	159.1	-107.7	0	0	0	112.5	L129 V140 C141 S143 A144 V149 V150 D161	L129-Y146 HydrophobicContact CB-CE2 4.38Å; L129-Y146 WeakPolarHBondContact CB-OH 3.38Å; L129-Y146 HydrophobicContact CD1-CE2 3.61Å; L129-Y146 WeakPolarHBondContact CD1-OH 3.35Å; V140-Y146 HydrophobicContact CG1-CD2 4.25Å; V140-Y146 HydrophobicContact CG1-CE2 4.11Å; V140-Y146 HydrophobicContact CG2-CD2 4.03Å; C141-Y146 HydrophobicContact CB-CD1 4.34Å; C141-Y146 HydrophobicContact CB-CE1 4.37Å; S143-Y146 WeakPolarHBondContact O-CB 3.33Å; S143-Y146 PolarHBondContact O-N 3.31Å; A144-Y146 VanDerWaalsContact C-N 3.33Å; Y146-V149 PolarHBondContact O-N 3.3Å; Y146-V150 HydrophobicContact CD2-CG2 3.85Å; Y146-V150 HydrophobicContact CE2-CG2 3.5Å; Y146-V150 VanDerWaalsContact CE2-CG2 3.5Å; Y146-V150 WeakPolarHBondContact O-CB 3.37Å; Y146-V150 VanDerWaalsContact O-CG2 3.28Å; Y146-V150 WeakPolarHBondContact O-CG2 3.22Å; Y146-V150 PolarHBondContact O-N 3Å; Y146-D161 VanDerWaalsContact CE1-OD2 3.29Å; Y146-D161 WeakPolarHBondContact CE1-OD2 3.14Å; Y146-D161 PolarHBondContact OH-OD1 3.06Å; Y146-D161 PolarHBondContact OH-OD2 2.96Å; Y146-D161 VanDerWaalsContact OH-OD2 3.1Å
147	R	93.1	Very high	92.8	Very high	47 Å²	47	56 Å²	56	18%	0.177	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-46.6	-174.7	-175.4	-177.3	172.3	92.9	-13.3	111.3	S145 V150 L151 L160 E163	S145-R147 VanDerWaalsContact C-N 3.29Å; S145-R147 PolarHBondContact O-N 3.44Å; R147-V150 PolarHBondContact O-N 3.14Å; R147-L151 HydrophobicContact CG-CD1 4.02Å; R147-L151 VanDerWaalsContact O-CG 3.27Å; R147-L151 WeakPolarHBondContact O-CG 3.15Å; R147-L151 PolarHBondContact O-N 2.9Å; R147-L160 HydrophobicContact CG-CD2 3.89Å; R147-E163 IonicContact CZ-OE2 3.67Å; R147-E163 VanDerWaalsContact CZ-OE2 3.25Å; R147-E163 IonicContact NH1-OE2 3.81Å; R147-E163 PolarHBondContact NH1-OE2 3.11Å; R147-E163 IonicContact NH2-OE2 2.78Å; R147-E163 PolarHBondContact NH2-OE2 2.84Å
148	A	91.2	Very high	92.6	Very high	53 Å²	53	57.3 Å²	57.3	44%	0.438	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-48.8	-179.9	0	0	0	0	0	110.9	S145 V150 L151 E152	S145-A148 PolarHBondContact O-N 2.93Å; S145-A148 VanDerWaalsContact O-N 3.13Å; A148-V150 PolarHBondContact O-N 3.18Å; A148-L151 PolarHBondContact O-N 3.49Å; A148-E152 WeakPolarHBondContact O-CG 3.33Å; A148-E152 PolarHBondContact O-N 2.88Å
149	V	94.1	Very high	92.3	Very high	42 Å²	42	58.3 Å²	58.3	26%	0.255	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-41.9	-179.9	175.3	0	0	0	0	111.9	T112 S145 Y146 E152 M153	T112-V149 HydrophobicContact CG2-CB 4.25Å; T112-V149 HydrophobicContact CG2-CG1 3.76Å; S145-V149 WeakPolarHBondContact O-CG2 3.41Å; S145-V149 PolarHBondContact O-N 2.76Å; Y146-V149 PolarHBondContact O-N 3.3Å; V149-E152 PolarHBondContact O-N 3.05Å; V149-M153 HydrophobicContact CG1-CE 4.41Å; V149-M153 WeakPolarHBondContact O-CB 3.43Å; V149-M153 PolarHBondContact O-N 2.92Å
150	V	94.3	Very high	92.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.9	-41	177.5	172	0	0	0	0	111.2	L115 Y146 R147 A148 M153 F154 L160	L115-V150 HydrophobicContact CD1-CG2 3.74Å; Y146-V150 HydrophobicContact CD2-CG2 3.85Å; Y146-V150 HydrophobicContact CE2-CG2 3.5Å; Y146-V150 VanDerWaalsContact CE2-CG2 3.5Å; Y146-V150 WeakPolarHBondContact O-CB 3.37Å; Y146-V150 VanDerWaalsContact O-CG2 3.28Å; Y146-V150 WeakPolarHBondContact O-CG2 3.22Å; Y146-V150 PolarHBondContact O-N 3Å; R147-V150 PolarHBondContact O-N 3.14Å; A148-V150 PolarHBondContact O-N 3.18Å; V150-M153 PolarHBondContact O-N 3.3Å; V150-F154 HydrophobicContact CG1-CD2 3.8Å; V150-F154 HydrophobicContact CG1-CE2 4.21Å; V150-F154 WeakPolarHBondContact O-CD2 3.44Å; V150-F154 PolarHBondContact O-N 2.83Å; V150-L160 HydrophobicContact CB-CD2 4.42Å; V150-L160 HydrophobicContact CG1-CD1 3.75Å; V150-L160 HydrophobicContact CG1-CD2 4.08Å
151	L	91.8	Very high	92	Very high	54 Å²	54	57.3 Å²	57.3	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-67.9	-36.4	177.8	-67.4	174.4	0	0	0	112.6	R147 A148 F154 I157 L160 V165	R147-L151 HydrophobicContact CG-CD1 4.02Å; R147-L151 VanDerWaalsContact O-CG 3.27Å; R147-L151 WeakPolarHBondContact O-CG 3.15Å; R147-L151 PolarHBondContact O-N 2.9Å; A148-L151 PolarHBondContact O-N 3.49Å; L151-F154 CarbonylContact O-C 3.56Å; L151-I157 HydrophobicContact CD2-CG2 3.67Å; L151-L160 HydrophobicContact CD2-CB 4.48Å; L151-L160 HydrophobicContact CD2-CD2 3.9Å; L151-L160 HydrophobicContact CG-CD2 3.99Å; L151-V165 HydrophobicContact CD2-CB 4.03Å; L151-V165 HydrophobicContact CD2-CG1 3.99Å; L151-V165 HydrophobicContact CD2-CG2 3.83Å
152	E	92.2	Very high	91.7	Very high	161 Å²	161	58.7 Å²	58.7	75%	0.752	33%	0.333	S	S	*	.	H	α-helix	trans	-66.1	-38.3	172.3	-73	178.6	-179.8	0	0	111.9	A148 V149	A148-E152 WeakPolarHBondContact O-CG 3.33Å; A148-E152 PolarHBondContact O-N 2.88Å; V149-E152 PolarHBondContact O-N 3.05Å
153	M	93.4	Very high	91.4	Very high	38 Å²	38	50.7 Å²	50.7	19%	0.187	31%	0.305	C	S	.	.	H	α-helix	trans	-71	-33	179.8	-175.6	177	-61	0	0	113	L115 V119 V149 V150 P155	L115-M153 HydrophobicContact CB-SD 3.84Å; V119-M153 HydrophobicContact CG2-CG 3.36Å; V119-M153 HydrophobicContact CG2-SD 3.89Å; V149-M153 HydrophobicContact CG1-CE 4.41Å; V149-M153 WeakPolarHBondContact O-CB 3.43Å; V149-M153 PolarHBondContact O-N 2.92Å; V150-M153 PolarHBondContact O-N 3.3Å; M153-P155 WeakPolarHBondContact O-CD 3.34Å
154	F	92.5	Very high	91	Very high	13 Å²	13	54.3 Å²	54.3	6%	0.057	31%	0.309	C	S	.	.			trans	-123.7	79.8	-175.4	-56.7	-74.9	0	0	0	111.9	L115 L118 V119 V150 L151 N156 I157	L115-F154 HydrophobicContact CB-CE2 4.35Å; L115-F154 HydrophobicContact CB-CZ 4.27Å; L118-F154 HydrophobicContact CB-CE1 3.74Å; L118-F154 HydrophobicContact CB-CZ 3.87Å; V119-F154 HydrophobicContact CG2-CE1 3.99Å; V119-F154 HydrophobicContact CG2-CZ 4.29Å; V150-F154 HydrophobicContact CG1-CD2 3.8Å; V150-F154 HydrophobicContact CG1-CE2 4.21Å; V150-F154 WeakPolarHBondContact O-CD2 3.44Å; V150-F154 PolarHBondContact O-N 2.83Å; L151-F154 CarbonylContact O-C 3.56Å; F154-N156 PolarHBondContact O-N 3.28Å; F154-I157 HydrophobicContact CB-CB 4.1Å; F154-I157 HydrophobicContact CB-CG2 4.4Å; F154-I157 WeakPolarHBondContact O-CB 3.43Å; F154-I157 VanDerWaalsContact O-CG2 3.22Å; F154-I157 WeakPolarHBondContact O-CG2 3.49Å; F154-I157 PolarHBondContact O-N 2.93Å
155	P	84.4	Confident	90.8	Very high	103 Å²	103	50.5 Å²	50.5	67%	0.669	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.3	-174	26	-35.5	0	0	0	114.2	M153	M153-P155 WeakPolarHBondContact O-CD 3.34Å
156	N	86.9	Confident	90.4	Very high	102 Å²	102	50.4 Å²	50.4	55%	0.545	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	0.9	-179	-63.3	-29.7	0	0	0	113.5	F154 K158	F154-N156 PolarHBondContact O-N 3.28Å; N156-K158 PolarHBondContact O-N 2.96Å
157	I	91.2	Very high	89.2	Confident	4 Å²	4	52 Å²	52	2%	0.021	29%	0.29	C	S	.	.			trans	-70.3	131.8	-176	-155.9	77.5	0	0	0	110.6	L124 E125 I127 L151 F154 V159 V165	L124-I157 HydrophobicContact CG-CD1 4.29Å; E125-I157 WeakPolarHBondContact O-CD1 3.47Å; I127-I157 HydrophobicContact CB-CD1 3.91Å; I127-I157 HydrophobicContact CG2-CD1 3.61Å; I127-I157 HydrophobicContact CG2-CG1 3.87Å; L151-I157 HydrophobicContact CD2-CG2 3.67Å; F154-I157 HydrophobicContact CB-CB 4.1Å; F154-I157 HydrophobicContact CB-CG2 4.4Å; F154-I157 WeakPolarHBondContact O-CB 3.43Å; F154-I157 VanDerWaalsContact O-CG2 3.22Å; F154-I157 WeakPolarHBondContact O-CG2 3.49Å; F154-I157 PolarHBondContact O-N 2.93Å; I157-V159 WeakPolarHBondContact CG1-O 3.47Å; I157-V165 HydrophobicContact CG2-CG2 3.85Å; I157-V165 WeakPolarHBondContact O-CG2 3.22Å
158	K	90.6	Very high	87.3	Confident	77 Å²	77	61.7 Å²	61.7	34%	0.335	33%	0.326	S	S	.	.	S	Bend	trans	-98.4	-33.6	178.8	-60	-176.8	-174.7	161.6	0	112.3	E125 N156 R164 V165 V166	E125-K158 HydrophobicContact CB-CD 4.22Å; E125-K158 HydrophobicContact CB-CG 4.22Å; E125-K158 HydrophobicContact CG-CD 4.31Å; E125-K158 WeakPolarHBondContact O-CA 3.42Å; E125-K158 PolarHBondContact O-N 2.93Å; E125-K158 WeakPolarHBondContact OE1-CE 3.47Å; E125-K158 IonicContact OE1-NZ 3.21Å; E125-K158 PolarHBondContact OE1-NZ 3.03Å; E125-K158 WeakPolarHBondContact OE2-CD 3.27Å; E125-K158 WeakPolarHBondContact OE2-CE 3.14Å; E125-K158 IonicContact OE2-NZ 3.25Å; E125-K158 PolarHBondContact OE2-NZ 3.11Å; N156-K158 PolarHBondContact O-N 2.96Å; K158-R164 WeakPolarHBondContact O-CA 3.32Å; K158-V165 PolarHBondContact O-N 3.37Å; K158-V166 HydrophobicContact CB-CG2 3.92Å; K158-V166 HydrophobicContact CG-CG2 3.84Å
159	V	91.3	Very high	85.8	Confident	23 Å²	23	61 Å²	61	14%	0.139	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127	-179.3	-177.3	0	0	0	0	109.8	E125 N126 I127 I157 E163	E125-V159 PolarHBondContact O-N 3.02Å; E125-V159 VanDerWaalsContact O-N 3.13Å; N126-V159 WeakPolarHBondContact CA-O 3.29Å; N126-V159 HydrophobicContact CB-CB 4.38Å; N126-V159 WeakPolarHBondContact OD1-CB 3.21Å; N126-V159 WeakPolarHBondContact OD1-CG2 3.47Å; I127-V159 PolarHBondContact N-O 2.78Å; I157-V159 WeakPolarHBondContact CG1-O 3.47Å; V159-E163 CarbonylContact C-O 3.22Å; V159-E163 VanDerWaalsContact CA-O 3.27Å; V159-E163 WeakPolarHBondContact CA-O 3.41Å; V159-E163 WeakPolarHBondContact CG1-O 3.28Å
160	L	94.1	Very high	84.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.4	173.8	176.1	59.6	0	0	0	108.8	I127 R147 V150 L151 G162 E163 V165	I127-L160 HydrophobicContact CG2-CD1 3.59Å; I127-L160 CarbonylContact O-C 3.5Å; I127-L160 WeakPolarHBondContact O-CA 3.19Å; R147-L160 HydrophobicContact CG-CD2 3.89Å; V150-L160 HydrophobicContact CB-CD2 4.42Å; V150-L160 HydrophobicContact CG1-CD1 3.75Å; V150-L160 HydrophobicContact CG1-CD2 4.08Å; L151-L160 HydrophobicContact CD2-CB 4.48Å; L151-L160 HydrophobicContact CD2-CD2 3.9Å; L151-L160 HydrophobicContact CG-CD2 3.99Å; L160-G162 PolarHBondContact O-N 2.98Å; L160-G162 VanDerWaalsContact O-N 3.09Å; L160-E163 PolarHBondContact N-O 3.32Å; L160-E163 WeakPolarHBondContact O-CB 3.28Å; L160-E163 PolarHBondContact O-N 3.07Å; L160-V165 HydrophobicContact CB-CG1 4Å
161	D	94.2	Very high	83.1	Confident	25 Å²	25	66.1 Å²	66.1	13%	0.134	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	27.6	176.9	-60.6	-36.2	0	0	0	114.6	I127 L129 R130 Y146 E163	I127-D161 PolarHBondContact O-N 2.91Å; L129-D161 PolarHBondContact N-OD1 3.29Å; R130-D161 HydrophobicContact CG-CB 3.68Å; R130-D161 WeakPolarHBondContact CG-OD1 3.37Å; R130-D161 WeakPolarHBondContact CG-OD2 3.41Å; R130-D161 PolarHBondContact N-OD1 3.01Å; Y146-D161 VanDerWaalsContact CE1-OD2 3.29Å; Y146-D161 WeakPolarHBondContact CE1-OD2 3.14Å; Y146-D161 PolarHBondContact OH-OD1 3.06Å; Y146-D161 PolarHBondContact OH-OD2 2.96Å; Y146-D161 VanDerWaalsContact OH-OD2 3.1Å; D161-E163 VanDerWaalsContact C-N 3.29Å
162	G	87.4	Confident	81.9	Confident	40 Å²	40	68.8 Å²	68.8	41%	0.412	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	-6	-176.2	0	0	0	0	0	114.5	L160	L160-G162 PolarHBondContact O-N 2.98Å; L160-G162 VanDerWaalsContact O-N 3.09Å
163	E	87	Confident	80.6	Confident	43 Å²	43	66 Å²	66	20%	0.201	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.2	172.9	-60.2	-176	160.6	0	0	110.8	R147 V159 L160 D161 Y173	R147-E163 IonicContact CZ-OE2 3.67Å; R147-E163 VanDerWaalsContact CZ-OE2 3.25Å; R147-E163 IonicContact NH1-OE2 3.81Å; R147-E163 PolarHBondContact NH1-OE2 3.11Å; R147-E163 IonicContact NH2-OE2 2.78Å; R147-E163 PolarHBondContact NH2-OE2 2.84Å; V159-E163 CarbonylContact C-O 3.22Å; V159-E163 VanDerWaalsContact CA-O 3.27Å; V159-E163 WeakPolarHBondContact CA-O 3.41Å; V159-E163 WeakPolarHBondContact CG1-O 3.28Å; L160-E163 PolarHBondContact N-O 3.32Å; L160-E163 WeakPolarHBondContact O-CB 3.28Å; L160-E163 PolarHBondContact O-N 3.07Å; D161-E163 VanDerWaalsContact C-N 3.29Å; E163-Y173 HydrophobicContact CB-CE1 4.47Å; E163-Y173 HydrophobicContact CG-CE1 4.24Å; E163-Y173 PolarHBondContact OE1-OH 2.88Å
164	R	85.4	Confident	79.4	Confident	135 Å²	135	67.4 Å²	67.4	51%	0.509	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.5	173.1	-177.2	179.5	-81.2	-81.3	-2.7	109.5	K158 V166 S170	K158-R164 WeakPolarHBondContact O-CA 3.32Å; R164-V166 WeakPolarHBondContact CD-O 3.4Å; R164-V166 VanDerWaalsContact CG-O 3.24Å; R164-V166 WeakPolarHBondContact CG-O 3.33Å; R164-V166 PolarHBondContact NH1-O 3.34Å; R164-S170 WeakPolarHBondContact O-CB 3.39Å
165	V	86.9	Confident	78.3	Confident	31 Å²	31	71.4 Å²	71.4	19%	0.188	37%	0.372	C	S	.	.			trans	-112.3	-11.7	-178.1	-61.8	0	0	0	0	114	L151 I157 K158 L160 S170	L151-V165 HydrophobicContact CD2-CB 4.03Å; L151-V165 HydrophobicContact CD2-CG1 3.99Å; L151-V165 HydrophobicContact CD2-CG2 3.83Å; I157-V165 HydrophobicContact CG2-CG2 3.85Å; I157-V165 WeakPolarHBondContact O-CG2 3.22Å; K158-V165 PolarHBondContact O-N 3.37Å; L160-V165 HydrophobicContact CB-CG1 4Å; V165-S170 VanDerWaalsContact C-CB 3.44Å; V165-S170 PolarHBondContact O-OG 3.36Å
166	V	82	Confident	77.5	Confident	61 Å²	61	69.3 Å²	69.3	37%	0.37	36%	0.359	S	S	.	.	S	Bend	trans	-130	150.5	174.6	-55.7	0	0	0	0	113.3	K158 R164 S170	K158-V166 HydrophobicContact CB-CG2 3.92Å; K158-V166 HydrophobicContact CG-CG2 3.84Å; R164-V166 WeakPolarHBondContact CD-O 3.4Å; R164-V166 VanDerWaalsContact CG-O 3.24Å; R164-V166 WeakPolarHBondContact CG-O 3.33Å; R164-V166 PolarHBondContact NH1-O 3.34Å; V166-S170 VanDerWaalsContact CA-OG 3.24Å; V166-S170 WeakPolarHBondContact CA-OG 3.44Å; V166-S170 PolarHBondContact N-OG 3.23Å
167	G	69.6	Low	76.6	Confident	40 Å²	40	67.4 Å²	67.4	41%	0.412	35%	0.346	S	S	.	.	S	Bend	trans	94.2	173.1	173.8	0	0	0	0	0	115.1	G169 S170	G167-G169 PolarHBondContact O-N 3.19Å; G167-G169 VanDerWaalsContact O-N 3.08Å; G167-S170 PolarHBondContact N-OG 3.08Å; G167-S170 PolarHBondContact O-N 2.95Å; G167-S170 PolarHBondContact O-OG 3.48Å
168	R	51.9	Low	75.9	Confident	250 Å²	250	71 Å²	71	94%	0.943	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	116	176	-65.2	-175.9	-168.7	177.7	3.6	109.2
169	G	60.3	Low	75	Confident	39 Å²	39	71.4 Å²	71.4	40%	0.402	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	118.1	-34	-173	0	0	0	0	0	113.8	G167 Y173	G167-G169 PolarHBondContact O-N 3.19Å; G167-G169 VanDerWaalsContact O-N 3.08Å; G169-Y173 WeakPolarHBondContact O-CB 3.27Å; G169-Y173 PolarHBondContact O-N 2.75Å
170	S	67.6	Low	73.8	Confident	10 Å²	10	74.2 Å²	74.2	7%	0.07	38%	0.384	C	S	.	.	H	α-helix	trans	-75.9	-38	169.4	64.3	0	0	0	0	111.4	R164 V165 V166 G167 L172 Y173 Q174	R164-S170 WeakPolarHBondContact O-CB 3.39Å; V165-S170 VanDerWaalsContact C-CB 3.44Å; V165-S170 PolarHBondContact O-OG 3.36Å; V166-S170 VanDerWaalsContact CA-OG 3.24Å; V166-S170 WeakPolarHBondContact CA-OG 3.44Å; V166-S170 PolarHBondContact N-OG 3.23Å; G167-S170 PolarHBondContact N-OG 3.08Å; G167-S170 PolarHBondContact O-N 2.95Å; G167-S170 PolarHBondContact O-OG 3.48Å; S170-L172 VanDerWaalsContact C-N 3.32Å; S170-L172 PolarHBondContact O-N 2.93Å; S170-Y173 PolarHBondContact O-N 2.88Å; S170-Q174 WeakPolarHBondContact O-CB 2.95Å; S170-Q174 PolarHBondContact O-N 3.1Å
171	E	64.4	Low	72.7	Confident	139 Å²	139	77.5 Å²	77.5	65%	0.65	40%	0.402	S	S	*	.	H	α-helix	trans	-62	-40.7	172.7	-69.2	169.8	-171.6	0	0	111.3	Q174 L175	E171-Q174 PolarHBondContact O-N 3.05Å; E171-L175 WeakPolarHBondContact O-CB 3.48Å; E171-L175 PolarHBondContact O-N 3.13Å
172	L	67	Low	71.4	Confident	111 Å²	111	80.9 Å²	80.9	58%	0.581	42%	0.423	S	S	*	.	H	α-helix	trans	-66.9	-45.2	174.8	-177.8	66.4	0	0	0	111.1	S170 Q174 L175 C176	S170-L172 VanDerWaalsContact C-N 3.32Å; S170-L172 PolarHBondContact O-N 2.93Å; L172-Q174 VanDerWaalsContact C-N 3.32Å; L172-Q174 PolarHBondContact O-N 3.45Å; L172-L175 PolarHBondContact O-N 2.7Å; L172-C176 WeakPolarHBondContact O-CB 3.05Å; L172-C176 PolarHBondContact O-N 3.21Å; L172-C176 PolarHBondContact O-SG 3.08Å
173	Y	63.5	Low	70.4	Confident	102 Å²	102	83.2 Å²	83.2	40%	0.4	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-41.3	176.2	-178.6	-102.8	0	0	0	111.8	E163 G169 S170 C176 K177	E163-Y173 HydrophobicContact CB-CE1 4.47Å; E163-Y173 HydrophobicContact CG-CE1 4.24Å; E163-Y173 PolarHBondContact OE1-OH 2.88Å; G169-Y173 WeakPolarHBondContact O-CB 3.27Å; G169-Y173 PolarHBondContact O-N 2.75Å; S170-Y173 PolarHBondContact O-N 2.88Å; Y173-C176 PolarHBondContact O-N 3.23Å; Y173-K177 VanDerWaalsContact O-CB 3.3Å; Y173-K177 WeakPolarHBondContact O-CB 3.19Å; Y173-K177 PolarHBondContact O-N 3.22Å
174	Q	68.9	Low	69.4	Low	67 Å²	67	88.3 Å²	88.3	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-67.7	-42.8	177.9	-166.5	57.8	40.2	0	0	110.8	S170 E171 L172 C176 K177 D178	S170-Q174 WeakPolarHBondContact O-CB 2.95Å; S170-Q174 PolarHBondContact O-N 3.1Å; E171-Q174 PolarHBondContact O-N 3.05Å; L172-Q174 VanDerWaalsContact C-N 3.32Å; L172-Q174 PolarHBondContact O-N 3.45Å; Q174-C176 PolarHBondContact O-N 3.37Å; Q174-K177 PolarHBondContact O-N 3.04Å; Q174-D178 PolarHBondContact NE2-OD1 3.17Å; Q174-D178 WeakPolarHBondContact O-CB 3.46Å; Q174-D178 PolarHBondContact O-N 2.7Å
175	L	70.4	Confident	68.3	Low	97 Å²	97	86.5 Å²	86.5	51%	0.508	46%	0.461	S	S	.	.	H	α-helix	trans	-59.3	-46.4	171.2	179.7	66.2	0	0	0	111.5	E171 L172 K177 D178 I179	E171-L175 WeakPolarHBondContact O-CB 3.48Å; E171-L175 PolarHBondContact O-N 3.13Å; L172-L175 PolarHBondContact O-N 2.7Å; L175-K177 VanDerWaalsContact C-N 3.3Å; L175-K177 PolarHBondContact O-N 2.73Å; L175-D178 PolarHBondContact O-N 3.23Å; L175-I179 HydrophobicContact CD1-CD1 4.17Å; L175-I179 HydrophobicContact CD1-CG1 4.48Å; L175-I179 HydrophobicContact CG-CD1 3.92Å; L175-I179 WeakPolarHBondContact O-CB 3.47Å; L175-I179 WeakPolarHBondContact O-CD1 3.34Å; L175-I179 WeakPolarHBondContact O-CG1 3.45Å; L175-I179 PolarHBondContact O-N 3.36Å
176	C	67.4	Low	66.8	Low	59 Å²	59	86.8 Å²	86.8	40%	0.399	47%	0.47	S	S	.	.	H	α-helix	trans	-60.1	-41	175.6	-72	0	0	0	0	111.6	L172 Y173 Q174 I179 D180	L172-C176 WeakPolarHBondContact O-CB 3.05Å; L172-C176 PolarHBondContact O-N 3.21Å; L172-C176 PolarHBondContact O-SG 3.08Å; Y173-C176 PolarHBondContact O-N 3.23Å; Q174-C176 PolarHBondContact O-N 3.37Å; C176-I179 PolarHBondContact O-N 3.2Å; C176-D180 WeakPolarHBondContact O-CB 3.41Å; C176-D180 PolarHBondContact O-N 3.3Å
177	K	68	Low	65.2	Low	63 Å²	63	88.7 Å²	88.7	27%	0.274	49%	0.486	S	S	.	.	H	α-helix	trans	-69.1	-42.6	178	-172.2	177.8	-179.7	177.4	0	112.2	Y173 Q174 L175 I179 D180 D181	Y173-K177 VanDerWaalsContact O-CB 3.3Å; Y173-K177 WeakPolarHBondContact O-CB 3.19Å; Y173-K177 PolarHBondContact O-N 3.22Å; Q174-K177 PolarHBondContact O-N 3.04Å; L175-K177 VanDerWaalsContact C-N 3.3Å; L175-K177 PolarHBondContact O-N 2.73Å; K177-I179 VanDerWaalsContact C-N 3.3Å; K177-I179 PolarHBondContact O-N 3.1Å; K177-D180 PolarHBondContact O-N 3.41Å; K177-D181 WeakPolarHBondContact O-CB 3.4Å; K177-D181 VanDerWaalsContact O-CG 3.31Å; K177-D181 PolarHBondContact O-N 2.64Å
178	D	76.8	Confident	64.1	Low	78 Å²	78	97.5 Å²	97.5	42%	0.417	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-38.1	176.5	-64.6	-13.7	0	0	0	110.2	Q174 L175 T182	Q174-D178 PolarHBondContact NE2-OD1 3.17Å; Q174-D178 WeakPolarHBondContact O-CB 3.46Å; Q174-D178 PolarHBondContact O-N 2.7Å; L175-D178 PolarHBondContact O-N 3.23Å; D178-T182 VanDerWaalsContact O-CB 3.24Å; D178-T182 WeakPolarHBondContact O-CB 3.17Å; D178-T182 PolarHBondContact O-N 3.02Å; D178-T182 PolarHBondContact O-OG1 3.1Å
179	I	70.4	Confident	63.8	Low	86 Å²	86	94.1 Å²	94.1	44%	0.441	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-50.8	170.9	-71.3	165.3	0	0	0	110.5	L175 C176 K177 D181 T182 I183	L175-I179 HydrophobicContact CD1-CD1 4.17Å; L175-I179 HydrophobicContact CD1-CG1 4.48Å; L175-I179 HydrophobicContact CG-CD1 3.92Å; L175-I179 WeakPolarHBondContact O-CB 3.47Å; L175-I179 WeakPolarHBondContact O-CD1 3.34Å; L175-I179 WeakPolarHBondContact O-CG1 3.45Å; L175-I179 PolarHBondContact O-N 3.36Å; C176-I179 PolarHBondContact O-N 3.2Å; K177-I179 VanDerWaalsContact C-N 3.3Å; K177-I179 PolarHBondContact O-N 3.1Å; I179-D181 VanDerWaalsContact C-N 3.33Å; I179-D181 PolarHBondContact O-N 2.91Å; I179-T182 WeakPolarHBondContact O-CB 3.3Å; I179-T182 PolarHBondContact O-N 3.31Å; I179-I183 HydrophobicContact CG2-CD1 3.63Å; I179-I183 HydrophobicContact CG2-CG1 4.35Å; I179-I183 WeakPolarHBondContact O-CB 3.4Å; I179-I183 WeakPolarHBondContact O-CG1 3.46Å; I179-I183 PolarHBondContact O-N 2.95Å
180	D	66.8	Low	63	Low	82 Å²	82	99.7 Å²	99.7	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-59.2	-42.9	178.3	-86.7	-10	0	0	0	112.3	C176 K177 I183 K184	C176-D180 WeakPolarHBondContact O-CB 3.41Å; C176-D180 PolarHBondContact O-N 3.3Å; K177-D180 PolarHBondContact O-N 3.41Å; D180-I183 PolarHBondContact O-N 3.12Å; D180-K184 WeakPolarHBondContact O-CB 3.33Å; D180-K184 WeakPolarHBondContact O-CD 3.32Å; D180-K184 WeakPolarHBondContact O-CG 3.3Å; D180-K184 PolarHBondContact O-N 3.17Å
181	D	70.1	Confident	62	Low	69 Å²	69	103.3 Å²	103.3	37%	0.369	56%	0.56	S	S	.	*	H	α-helix	trans	-72.4	-32.3	179.7	-70.7	-15.3	0	0	0	110.8	K177 I179 K184 A185	K177-D181 WeakPolarHBondContact O-CB 3.4Å; K177-D181 VanDerWaalsContact O-CG 3.31Å; K177-D181 PolarHBondContact O-N 2.64Å; I179-D181 VanDerWaalsContact C-N 3.33Å; I179-D181 PolarHBondContact O-N 2.91Å; D181-K184 PolarHBondContact O-N 3.22Å; D181-K184 IonicContact OD1-NZ 3.51Å; D181-K184 PolarHBondContact OD1-NZ 2.78Å; D181-A185 WeakPolarHBondContact O-CB 3.24Å; D181-A185 PolarHBondContact O-N 2.95Å
182	T	68.5	Low	61	Low	96 Å²	96	105.2 Å²	105.2	59%	0.589	57%	0.569	S	S	*	*	H	α-helix	trans	-66.9	-41.9	169.9	-58.1	0	0	0	0	111.6	D178 I179 K184 A185 G186	D178-T182 VanDerWaalsContact O-CB 3.24Å; D178-T182 WeakPolarHBondContact O-CB 3.17Å; D178-T182 PolarHBondContact O-N 3.02Å; D178-T182 PolarHBondContact O-OG1 3.1Å; I179-T182 WeakPolarHBondContact O-CB 3.3Å; I179-T182 PolarHBondContact O-N 3.31Å; T182-K184 VanDerWaalsContact C-N 3.32Å; T182-K184 PolarHBondContact O-N 3.28Å; T182-A185 PolarHBondContact O-N 3.37Å; T182-G186 WeakPolarHBondContact O-CA 3.18Å; T182-G186 PolarHBondContact O-N 3.17Å
183	I	65.1	Low	59.9	Low	90 Å²	90	108.1 Å²	108.1	46%	0.462	58%	0.584	S	S	.	*	H	α-helix	trans	-62.7	-40.3	174.2	-69.6	164.8	0	0	0	110.5	I179 D180	I179-I183 HydrophobicContact CG2-CD1 3.63Å; I179-I183 HydrophobicContact CG2-CG1 4.35Å; I179-I183 WeakPolarHBondContact O-CB 3.4Å; I179-I183 WeakPolarHBondContact O-CG1 3.46Å; I179-I183 PolarHBondContact O-N 2.95Å; D180-I183 PolarHBondContact O-N 3.12Å
184	K	66.8	Low	59.1	Low	150 Å²	150	110.4 Å²	110.4	65%	0.652	60%	0.601	S	S	*	*	H	α-helix	trans	-72.7	-37.8	177.1	-71.2	165.7	-163.1	157.3	0	112.5	D180 D181 T182	D180-K184 WeakPolarHBondContact O-CB 3.33Å; D180-K184 WeakPolarHBondContact O-CD 3.32Å; D180-K184 WeakPolarHBondContact O-CG 3.3Å; D180-K184 PolarHBondContact O-N 3.17Å; D181-K184 PolarHBondContact O-N 3.22Å; D181-K184 IonicContact OD1-NZ 3.51Å; D181-K184 PolarHBondContact OD1-NZ 2.78Å; T182-K184 VanDerWaalsContact C-N 3.32Å; T182-K184 PolarHBondContact O-N 3.28Å
185	A	62.2	Low	57.7	Low	96 Å²	96	116 Å²	116	79%	0.793	63%	0.628	S	S	*	*	H	α-helix	trans	-82.8	-21.6	-177.4	0	0	0	0	0	113.2	D181 T182	D181-A185 WeakPolarHBondContact O-CB 3.24Å; D181-A185 PolarHBondContact O-N 2.95Å; T182-A185 PolarHBondContact O-N 3.37Å
186	G	55.3	Low	56.7	Low	37 Å²	37	118.8 Å²	118.8	38%	0.381	64%	0.638	S	S	.	*	S	Bend	trans	-139.5	110.6	-177	0	0	0	0	0	113.3	T182	T182-G186 WeakPolarHBondContact O-CA 3.18Å; T182-G186 PolarHBondContact O-N 3.17Å
187	S	48.8	Very low	55.8	Low	102 Å²	102	121.1 Å²	121.1	71%	0.713	65%	0.652	S	S	*	*			trans	88.3	66.9	153.6	-54.7	0	0	0	0	119.6	K189	S187-K189 VanDerWaalsContact C-N 3.32Å
188	Y	45.2	Very low	55	Low	224 Å²	224	125.2 Å²	125.2	88%	0.878	68%	0.677	S	S	*	*			trans	-92.5	68.3	130.5	-83.4	-88.2	0	0	0	109.7
189	K	47.1	Very low	53.6	Low	179 Å²	179	127.2 Å²	127.2	78%	0.778	70%	0.696	S	S	*	*	S	Bend	trans	-132.1	107	159.4	-75.8	-168.7	177.8	179.8	0	108.2	S187	S187-K189 VanDerWaalsContact C-N 3.32Å
190	N	41.7	Very low	52.8	Low	157 Å²	157	131.9 Å²	131.9	84%	0.84	71%	0.713	S	S	*	*	S	Bend	trans	69.9	37	165.2	-58.3	-3.6	0	0	0	118.8	Q192	N190-Q192 VanDerWaalsContact C-N 3.32Å; N190-Q192 PolarHBondContact O-N 3.47Å
191	G	47.3	Very low	52.2	Low	85 Å²	85	132.9 Å²	132.9	88%	0.876	72%	0.724	S	S	*	*	S	Bend	trans	65.2	15.8	147.7	0	0	0	0	0	119.1
192	Q	43.4	Very low	51.4	Low	180 Å²	180	141.2 Å²	141.2	84%	0.841	75%	0.75	S	S	*	*			trans	-132.3	123.6	173.1	-103.1	171.7	-17.7	0	0	111.1	N190	N190-Q192 VanDerWaalsContact C-N 3.32Å; N190-Q192 PolarHBondContact O-N 3.47Å
193	L	44.1	Very low	50.7	Low	172 Å²	172	138.1 Å²	138.1	90%	0.901	73%	0.731	S	S	*	*			trans	-67.8	135.3	170.3	-73.7	160.5	0	0	0	108.8	E195	L193-E195 PolarHBondContact O-N 2.91Å
194	I	46	Very low	50.5	Low	149 Å²	149	142 Å²	142	76%	0.764	75%	0.747	S	S	*	*			trans	-72.7	114.5	173.9	-60.2	172	0	0	0	107.3	H196	I194-H196 PolarHBondContact O-N 3.42Å
195	E	41.3	Very low	49.7	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.864	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-67.5	116.4	170.4	-73.5	-176.4	171.1	0	0	109.3	L193	L193-E195 PolarHBondContact O-N 2.91Å
196	H	48.1	Very low	49.4	Very low	156 Å²	156	140.3 Å²	140.3	72%	0.722	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-76.5	136.1	167.9	-111.5	-77	0	0	0	109.1	I194 D198	I194-H196 PolarHBondContact O-N 3.42Å; H196-D198 PolarHBondContact O-N 3.33Å
197	P	47.9	Very low	50	Low	107 Å²	107	146.3 Å²	146.3	70%	0.695	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	126.8	178	-13.4	28	0	0	0	110.6
198	D	51.4	Low	50.2	Low	149 Å²	149	150.4 Å²	150.4	80%	0.797	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	64	59.8	163.9	-55.9	-22.8	0	0	0	118.4	H196 K200	H196-D198 PolarHBondContact O-N 3.33Å; D198-K200 PolarHBondContact O-N 2.97Å; D198-K200 VanDerWaalsContact O-N 3.17Å
199	C	48.7	Very low	50.6	Low	120 Å²	120	147 Å²	147	81%	0.811	75%	0.745	S	S	*	*			trans	-71.3	101.4	151.5	-69.7	0	0	0	0	109.4
200	K	53.3	Low	50.7	Low	185 Å²	185	145.8 Å²	145.8	80%	0.804	75%	0.746	S	S	*	*			trans	-66.7	147.2	167.2	-68.1	-173.9	-179.5	-178.5	0	110	D198 W202	D198-K200 PolarHBondContact O-N 2.97Å; D198-K200 VanDerWaalsContact O-N 3.17Å; K200-W202 PolarHBondContact O-N 3.44Å
201	P	53.9	Low	51.2	Low	103 Å²	103	147.6 Å²	147.6	67%	0.669	75%	0.746	S	S	*	*			trans	-53.3	139.1	176.2	-23	32.5	0	0	0	110.8	V203	P201-V203 WeakPolarHBondContact CB-O 3.19Å; P201-V203 PolarHBondContact O-N 3.04Å
202	W	52.3	Low	51	Low	244 Å²	244	153.5 Å²	153.5	92%	0.924	74%	0.742	S	S	*	*	S	Bend	trans	-53	-19	175.6	172.5	43.9	0	0	0	113	K200	K200-W202 PolarHBondContact O-N 3.44Å
203	V	55.3	Low	51.4	Low	31 Å²	31	149.4 Å²	149.4	19%	0.188	73%	0.733	C	S	.	*	S	Bend	trans	-141.5	127.5	-175.2	-178.2	0	0	0	0	109	P201 Y207 W208	P201-V203 WeakPolarHBondContact CB-O 3.19Å; P201-V203 PolarHBondContact O-N 3.04Å; V203-Y207 HydrophobicContact CG1-CD1 3.52Å; V203-Y207 HydrophobicContact CG1-CD2 4.35Å; V203-Y207 HydrophobicContact CG1-CG 3.42Å; V203-Y207 VanDerWaalsContact CG1-CG 3.42Å; V203-W208 HydrophobicContact CG2-CZ2 4.46Å
204	E	60.4	Low	51.8	Low	172 Å²	172	148.2 Å²	148.2	80%	0.804	73%	0.728	S	S	*	*			trans	-64.6	144.8	173.5	-64.6	-178.9	174.5	0	0	110.8	G206 Y207	E204-G206 PolarHBondContact O-N 2.87Å; E204-G206 VanDerWaalsContact O-N 3.09Å; E204-Y207 PolarHBondContact O-N 3.24Å; E204-Y207 VanDerWaalsContact O-N 3.09Å
205	D	50.8	Low	52.3	Low	172 Å²	172	145.3 Å²	145.3	92%	0.92	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	117.9	173.9	-75.4	-29	0	0	0	109.5
206	G	56	Low	53.5	Low	38 Å²	38	140 Å²	140	39%	0.392	70%	0.702	S	S	.	*	T	Hydrogen-bonded Turn	trans	106.9	-5.3	-178.2	0	0	0	0	0	116.1	E204 W208 E209	E204-G206 PolarHBondContact O-N 2.87Å; E204-G206 VanDerWaalsContact O-N 3.09Å; G206-W208 VanDerWaalsContact C-N 3.28Å; G206-W208 PolarHBondContact O-N 3.47Å; G206-E209 WeakPolarHBondContact O-CB 3.36Å; G206-E209 PolarHBondContact O-N 3.15Å
207	Y	67.3	Low	54.3	Low	162 Å²	162	139.3 Å²	139.3	64%	0.635	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-36.5	176.1	178.2	-95	0	0	0	113.5	V203 E204 E209	V203-Y207 HydrophobicContact CG1-CD1 3.52Å; V203-Y207 HydrophobicContact CG1-CD2 4.35Å; V203-Y207 HydrophobicContact CG1-CG 3.42Å; V203-Y207 VanDerWaalsContact CG1-CG 3.42Å; E204-Y207 PolarHBondContact O-N 3.24Å; E204-Y207 VanDerWaalsContact O-N 3.09Å; Y207-E209 VanDerWaalsContact C-N 3.28Å
208	W	52	Low	55.1	Low	189 Å²	189	138.1 Å²	138.1	72%	0.716	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-1.5	177.5	-57.5	112.6	0	0	0	113	V203 G206	V203-W208 HydrophobicContact CG2-CZ2 4.46Å; G206-W208 VanDerWaalsContact C-N 3.28Å; G206-W208 PolarHBondContact O-N 3.47Å
209	E	53.7	Low	55.9	Low	151 Å²	151	136.4 Å²	136.4	71%	0.706	68%	0.676	S	S	*	*	S	Bend	trans	-81.9	122.1	175.9	-65.4	-167.6	176.3	0	0	110.1	G206 Y207 K211	G206-E209 WeakPolarHBondContact O-CB 3.36Å; G206-E209 PolarHBondContact O-N 3.15Å; Y207-E209 VanDerWaalsContact C-N 3.28Å; E209-K211 PolarHBondContact O-N 3.39Å
210	I	49.4	Very low	57.2	Low	155 Å²	155	135.1 Å²	135.1	80%	0.795	66%	0.658	S	S	*	*			trans	-62.2	111.5	174.1	-60.8	168.3	0	0	0	107.4	R212	I210-R212 PolarHBondContact O-N 2.79Å
211	K	51.6	Low	58.2	Low	194 Å²	194	128.9 Å²	128.9	84%	0.843	64%	0.641	S	S	*	*			trans	-59.6	102.5	171.1	-71	-172.3	179	-177.9	0	108.3	E209 S213	E209-K211 PolarHBondContact O-N 3.39Å; K211-S213 PolarHBondContact O-N 3.48Å
212	R	45.1	Very low	59	Low	209 Å²	209	131.3 Å²	131.3	79%	0.789	64%	0.638	S	S	*	*			trans	-62.2	106.4	175.4	-64.9	-173.9	-176	-174.7	2.7	107.7	I210 N214	I210-R212 PolarHBondContact O-N 2.79Å; R212-N214 PolarHBondContact O-N 3.08Å
213	S	50.3	Low	60.3	Low	94 Å²	94	125.5 Å²	125.5	66%	0.657	62%	0.619	S	S	*	*			trans	-67.4	118.9	162.9	31.1	0	0	0	0	107.1	K211 N215	K211-S213 PolarHBondContact O-N 3.48Å; S213-N215 PolarHBondContact O-N 3.48Å
214	N	52.9	Low	61.6	Low	147 Å²	147	129.2 Å²	129.2	79%	0.786	64%	0.635	S	S	*	*			trans	-63.9	72.2	176.8	-77.5	-8.4	0	0	0	110.8	R212	R212-N214 PolarHBondContact O-N 3.08Å
215	N	57.5	Low	62.7	Low	88 Å²	88	127 Å²	127	47%	0.471	62%	0.623	S	S	.	*			trans	-97.5	101.5	165.9	-104.1	-15.5	0	0	0	106.7	S213 I217 I218 E219	S213-N215 PolarHBondContact O-N 3.48Å; N215-I217 PolarHBondContact O-N 3.4Å; N215-I218 HydrophobicContact CB-CB 4.16Å; N215-I218 HydrophobicContact CB-CD1 3.82Å; N215-I218 HydrophobicContact CB-CG1 3.89Å; N215-I218 WeakPolarHBondContact O-CA 3.24Å; N215-I218 PolarHBondContact O-N 2.87Å; N215-E219 PolarHBondContact O-N 3.43Å
216	A	65.4	Low	64.3	Low	75 Å²	75	123 Å²	123	62%	0.62	60%	0.601	S	S	*	*	H	α-helix	trans	-52.1	-28.8	177.8	0	0	0	0	0	112.7	E220	A216-E220 WeakPolarHBondContact O-CB 3.33Å; A216-E220 PolarHBondContact O-N 2.8Å
217	I	65.3	Low	65.8	Low	141 Å²	141	125.4 Å²	125.4	72%	0.723	61%	0.605	S	S	*	*	H	α-helix	trans	-66.4	-38.4	175.3	-58.3	171.7	0	0	0	111.6	N215 A221	N215-I217 PolarHBondContact O-N 3.4Å; I217-A221 WeakPolarHBondContact O-CB 3.44Å; I217-A221 PolarHBondContact O-N 2.82Å
218	I	64.4	Low	66.8	Low	82 Å²	82	121.7 Å²	121.7	42%	0.421	60%	0.599	S	S	.	*	H	α-helix	trans	-74.8	-40	179.3	-63.8	177.2	0	0	0	110	N215 A221 Y222	N215-I218 HydrophobicContact CB-CB 4.16Å; N215-I218 HydrophobicContact CB-CD1 3.82Å; N215-I218 HydrophobicContact CB-CG1 3.89Å; N215-I218 WeakPolarHBondContact O-CA 3.24Å; N215-I218 PolarHBondContact O-N 2.87Å; I218-A221 PolarHBondContact O-N 3.49Å; I218-Y222 HydrophobicContact CG2-CD2 3.74Å; I218-Y222 HydrophobicContact CG2-CE2 3.9Å; I218-Y222 WeakPolarHBondContact O-CB 3.35Å; I218-Y222 WeakPolarHBondContact O-CD2 3.49Å; I218-Y222 PolarHBondContact O-N 2.75Å
219	E	68.4	Low	68.3	Low	113 Å²	113	115.6 Å²	115.6	53%	0.528	58%	0.58	S	S	.	*	H	α-helix	trans	-62.7	-43.1	174.9	-76.5	-168	145.4	0	0	112.4	N215 Y222 K223	N215-E219 PolarHBondContact O-N 3.43Å; E219-Y222 PolarHBondContact O-N 3.32Å; E219-K223 WeakPolarHBondContact O-CB 3.27Å; E219-K223 PolarHBondContact O-N 2.96Å
220	E	76.3	Confident	69.9	Low	92 Å²	92	113.8 Å²	113.8	43%	0.43	57%	0.571	S	S	.	*	H	α-helix	trans	-66.3	-38.9	177.4	-169.7	58.8	-151.7	0	0	111.4	A216 K223 Q224	A216-E220 WeakPolarHBondContact O-CB 3.33Å; A216-E220 PolarHBondContact O-N 2.8Å; E220-K223 PolarHBondContact O-N 3.48Å; E220-Q224 WeakPolarHBondContact O-CB 3.22Å; E220-Q224 VanDerWaalsContact O-CG 3.31Å; E220-Q224 WeakPolarHBondContact O-CG 3.38Å; E220-Q224 PolarHBondContact O-N 3.3Å; E220-Q224 PolarHBondContact OE1-NE2 3.2Å
221	A	73.7	Confident	71.8	Confident	54 Å²	54	112.4 Å²	112.4	45%	0.446	56%	0.562	S	S	.	*	H	α-helix	trans	-64	-40.9	173.6	0	0	0	0	0	112.5	I217 I218 F225	I217-A221 WeakPolarHBondContact O-CB 3.44Å; I217-A221 PolarHBondContact O-N 2.82Å; I218-A221 PolarHBondContact O-N 3.49Å; A221-F225 WeakPolarHBondContact O-CB 3.43Å; A221-F225 PolarHBondContact O-N 2.93Å
222	Y	70.3	Confident	73.2	Confident	155 Å²	155	106.6 Å²	106.6	61%	0.608	54%	0.544	S	S	*	.	H	α-helix	trans	-65.8	-38.1	175.1	-98.8	-84.9	0	0	0	112.2	I218 E219 N226	I218-Y222 HydrophobicContact CG2-CD2 3.74Å; I218-Y222 HydrophobicContact CG2-CE2 3.9Å; I218-Y222 WeakPolarHBondContact O-CB 3.35Å; I218-Y222 WeakPolarHBondContact O-CD2 3.49Å; I218-Y222 PolarHBondContact O-N 2.75Å; E219-Y222 PolarHBondContact O-N 3.32Å; Y222-N226 WeakPolarHBondContact O-CB 3.38Å; Y222-N226 PolarHBondContact O-N 3.3Å; Y222-N226 PolarHBondContact O-ND2 3.48Å
223	K	80.7	Confident	75.2	Confident	121 Å²	121	104.4 Å²	104.4	53%	0.526	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-50.8	176.4	-172.6	-178.1	174.1	-169	0	110.9	E219 E220 F225 N226 D227	E219-K223 WeakPolarHBondContact O-CB 3.27Å; E219-K223 PolarHBondContact O-N 2.96Å; E220-K223 PolarHBondContact O-N 3.48Å; K223-F225 VanDerWaalsContact C-N 3.29Å; K223-F225 PolarHBondContact O-N 3.28Å; K223-N226 PolarHBondContact O-N 3Å; K223-N226 VanDerWaalsContact O-N 3.12Å; K223-D227 VanDerWaalsContact O-CG 3.3Å; K223-D227 PolarHBondContact O-N 2.91Å
224	Q	82.3	Confident	77	Confident	110 Å²	110	103.4 Å²	103.4	51%	0.514	52%	0.523	S	S	.	.	H	α-helix	trans	-59	-40.7	177.3	-71	175.1	15	0	0	112.1	E220 D227 V228	E220-Q224 WeakPolarHBondContact O-CB 3.22Å; E220-Q224 VanDerWaalsContact O-CG 3.31Å; E220-Q224 WeakPolarHBondContact O-CG 3.38Å; E220-Q224 PolarHBondContact O-N 3.3Å; E220-Q224 PolarHBondContact OE1-NE2 3.2Å; Q224-D227 PolarHBondContact O-N 2.73Å; Q224-V228 VanDerWaalsContact O-CG2 3.3Å; Q224-V228 WeakPolarHBondContact O-CG2 3.47Å; Q224-V228 PolarHBondContact O-N 3.19Å
225	F	82.8	Confident	78.6	Confident	125 Å²	125	101.4 Å²	101.4	55%	0.548	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-42.2	176.3	-179.3	-104.4	0	0	0	112.7	A221 K223 V228 L229	A221-F225 WeakPolarHBondContact O-CB 3.43Å; A221-F225 PolarHBondContact O-N 2.93Å; K223-F225 VanDerWaalsContact C-N 3.29Å; K223-F225 PolarHBondContact O-N 3.28Å; F225-V228 PolarHBondContact O-N 2.98Å; F225-L229 HydrophobicContact CD1-CD1 3.8Å; F225-L229 HydrophobicContact CE1-CD1 3.25Å; F225-L229 HydrophobicContact CE1-CG 4.17Å; F225-L229 HydrophobicContact CZ-CD1 3.68Å; F225-L229 HydrophobicContact CZ-CG 4.21Å; F225-L229 PolarHBondContact O-N 3.13Å
226	N	85.2	Confident	80	Confident	87 Å²	87	102.1 Å²	102.1	47%	0.465	52%	0.516	S	S	.	.	H	α-helix	trans	-68.7	-36.4	177.7	-78.7	-54.4	0	0	0	112.5	Y222 K223 L229 H230	Y222-N226 WeakPolarHBondContact O-CB 3.38Å; Y222-N226 PolarHBondContact O-N 3.3Å; Y222-N226 PolarHBondContact O-ND2 3.48Å; K223-N226 PolarHBondContact O-N 3Å; K223-N226 VanDerWaalsContact O-N 3.12Å; N226-L229 PolarHBondContact O-N 3.18Å; N226-H230 WeakPolarHBondContact O-CB 3.21Å; N226-H230 PolarHBondContact O-N 3.31Å
227	D	88.1	Confident	81.1	Confident	90 Å²	90	103.5 Å²	103.5	48%	0.481	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-44.6	174.8	-69.1	-19.3	0	0	0	110.7	K223 Q224 L229 H230 E231	K223-D227 VanDerWaalsContact O-CG 3.3Å; K223-D227 PolarHBondContact O-N 2.91Å; Q224-D227 PolarHBondContact O-N 2.73Å; D227-L229 PolarHBondContact O-N 2.72Å; D227-H230 WeakPolarHBondContact O-CB 3.22Å; D227-H230 PolarHBondContact O-N 3.46Å; D227-E231 PolarHBondContact O-N 2.99Å
228	V	88.6	Confident	82.2	Confident	84 Å²	84	104.9 Å²	104.9	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-41.9	174.8	172.4	0	0	0	0	111.7	Q224 F225 H230 E231 C232	Q224-V228 VanDerWaalsContact O-CG2 3.3Å; Q224-V228 WeakPolarHBondContact O-CG2 3.47Å; Q224-V228 PolarHBondContact O-N 3.19Å; F225-V228 PolarHBondContact O-N 2.98Å; V228-H230 VanDerWaalsContact C-N 3.29Å; V228-H230 PolarHBondContact O-N 3.45Å; V228-E231 PolarHBondContact O-N 3.39Å; V228-C232 WeakPolarHBondContact O-CB 3.37Å; V228-C232 PolarHBondContact O-N 3.47Å; V228-C232 PolarHBondContact O-SG 2.97Å
229	L	82.7	Confident	83.2	Confident	60 Å²	60	103.2 Å²	103.2	31%	0.314	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-37.8	174.9	-90.2	170.3	0	0	0	112.2	F225 N226 D227 R233	F225-L229 HydrophobicContact CD1-CD1 3.8Å; F225-L229 HydrophobicContact CE1-CD1 3.25Å; F225-L229 HydrophobicContact CE1-CG 4.17Å; F225-L229 HydrophobicContact CZ-CD1 3.68Å; F225-L229 HydrophobicContact CZ-CG 4.21Å; F225-L229 PolarHBondContact O-N 3.13Å; N226-L229 PolarHBondContact O-N 3.18Å; D227-L229 PolarHBondContact O-N 2.72Å; L229-R233 WeakPolarHBondContact O-CG 3.36Å; L229-R233 PolarHBondContact O-N 3.19Å; L229-R233 VanDerWaalsContact O-N 3.08Å
230	H	88	Confident	84	Confident	113 Å²	113	101.5 Å²	101.5	52%	0.523	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-45.2	177	-171.9	70.4	0	0	0	111.5	N226 D227 V228 C232 R233 L234	N226-H230 WeakPolarHBondContact O-CB 3.21Å; N226-H230 PolarHBondContact O-N 3.31Å; D227-H230 WeakPolarHBondContact O-CB 3.22Å; D227-H230 PolarHBondContact O-N 3.46Å; V228-H230 VanDerWaalsContact C-N 3.29Å; V228-H230 PolarHBondContact O-N 3.45Å; H230-C232 PolarHBondContact O-N 3.05Å; H230-R233 PolarHBondContact O-N 3.29Å; H230-L234 WeakPolarHBondContact NE2-CD1 3.46Å; H230-L234 PolarHBondContact O-N 2.92Å
231	E	88.5	Confident	84.4	Confident	127 Å²	127	102.2 Å²	102.2	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-60.7	-44	174.5	-75.7	-158.5	151.2	0	0	112.2	D227 V228 R233 L234 L235	D227-E231 PolarHBondContact O-N 2.99Å; V228-E231 PolarHBondContact O-N 3.39Å; E231-R233 VanDerWaalsContact C-N 3.3Å; E231-R233 PolarHBondContact O-N 3.17Å; E231-L234 PolarHBondContact O-N 2.92Å; E231-L235 WeakPolarHBondContact O-CB 3.49Å; E231-L235 WeakPolarHBondContact O-CG 3.33Å; E231-L235 PolarHBondContact O-N 2.99Å
232	C	81.6	Confident	85	Confident	71 Å²	71	103.7 Å²	103.7	48%	0.48	51%	0.511	S	S	.	.	H	α-helix	trans	-58.3	-41.6	175.7	-81	0	0	0	0	112	V228 H230 N236	V228-C232 WeakPolarHBondContact O-CB 3.37Å; V228-C232 PolarHBondContact O-N 3.47Å; V228-C232 PolarHBondContact O-SG 2.97Å; H230-C232 PolarHBondContact O-N 3.05Å; C232-N236 WeakPolarHBondContact O-CB 3.21Å; C232-N236 PolarHBondContact O-N 2.91Å
233	R	85.7	Confident	85.6	Confident	164 Å²	164	100.6 Å²	100.6	62%	0.619	50%	0.504	S	S	*	.	H	α-helix	trans	-66.8	-41.8	176.3	-73.7	173.9	-177.1	166.9	3.2	112	L229 H230 E231 N236 N237	L229-R233 WeakPolarHBondContact O-CG 3.36Å; L229-R233 PolarHBondContact O-N 3.19Å; L229-R233 VanDerWaalsContact O-N 3.08Å; H230-R233 PolarHBondContact O-N 3.29Å; E231-R233 VanDerWaalsContact C-N 3.3Å; E231-R233 PolarHBondContact O-N 3.17Å; R233-N236 PolarHBondContact O-N 3.04Å; R233-N237 WeakPolarHBondContact O-CB 3.47Å; R233-N237 PolarHBondContact O-N 3.12Å; R233-N237 PolarHBondContact O-ND2 3.33Å
234	L	89.3	Confident	85.6	Confident	72 Å²	72	96.6 Å²	96.6	38%	0.377	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-45.4	175.7	-85.9	164.8	0	0	0	111.8	H230 E231 N237 R238	H230-L234 WeakPolarHBondContact NE2-CD1 3.46Å; H230-L234 PolarHBondContact O-N 2.92Å; E231-L234 PolarHBondContact O-N 2.92Å; L234-N237 PolarHBondContact O-N 3.15Å; L234-R238 WeakPolarHBondContact O-CB 3.49Å; L234-R238 WeakPolarHBondContact O-CG 3.43Å; L234-R238 PolarHBondContact O-N 2.98Å
235	L	86.8	Confident	85.6	Confident	106 Å²	106	96.5 Å²	96.5	56%	0.555	49%	0.491	S	S	*	.	H	α-helix	trans	-61.4	-44.7	175.7	-77	167.7	0	0	0	111.2	E231 N237 R238 A239	E231-L235 WeakPolarHBondContact O-CB 3.49Å; E231-L235 WeakPolarHBondContact O-CG 3.33Å; E231-L235 PolarHBondContact O-N 2.99Å; L235-N237 VanDerWaalsContact C-N 3.35Å; L235-N237 PolarHBondContact O-N 3.42Å; L235-R238 PolarHBondContact O-N 2.94Å; L235-A239 WeakPolarHBondContact O-CB 3.16Å; L235-A239 PolarHBondContact O-N 2.85Å
236	N	86.1	Confident	85.2	Confident	102 Å²	102	94.1 Å²	94.1	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-41.9	177.1	-169.4	54.4	0	0	0	112	C232 R233 A239 T240	C232-N236 WeakPolarHBondContact O-CB 3.21Å; C232-N236 PolarHBondContact O-N 2.91Å; R233-N236 PolarHBondContact O-N 3.04Å; N236-A239 PolarHBondContact O-N 3Å; N236-T240 WeakPolarHBondContact O-CB 3.36Å; N236-T240 PolarHBondContact O-N 2.81Å; N236-T240 PolarHBondContact O-OG1 3.41Å
237	N	88.1	Confident	84.8	Confident	105 Å²	105	95.9 Å²	95.9	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-65.2	-41.9	176	-72.3	-18.4	0	0	0	111.8	R233 L234 L235 T240 H241	R233-N237 WeakPolarHBondContact O-CB 3.47Å; R233-N237 PolarHBondContact O-N 3.12Å; R233-N237 PolarHBondContact O-ND2 3.33Å; L234-N237 PolarHBondContact O-N 3.15Å; L235-N237 VanDerWaalsContact C-N 3.35Å; L235-N237 PolarHBondContact O-N 3.42Å; N237-T240 PolarHBondContact O-N 3.37Å; N237-H241 WeakPolarHBondContact O-CB 3.16Å; N237-H241 PolarHBondContact O-N 2.87Å
238	R	89.3	Confident	84.1	Confident	170 Å²	170	100.3 Å²	100.3	64%	0.642	50%	0.502	S	S	*	.	H	α-helix	trans	-62.6	-46.1	174.8	-74.7	177	-177.7	179.4	3	111.4	L234 L235 T240 H241 V242	L234-R238 WeakPolarHBondContact O-CB 3.49Å; L234-R238 WeakPolarHBondContact O-CG 3.43Å; L234-R238 PolarHBondContact O-N 2.98Å; L235-R238 PolarHBondContact O-N 2.94Å; R238-T240 VanDerWaalsContact C-N 3.34Å; R238-T240 PolarHBondContact O-N 3.21Å; R238-H241 WeakPolarHBondContact O-CB 3.46Å; R238-H241 PolarHBondContact O-N 3.37Å; R238-V242 WeakPolarHBondContact O-CG2 3.05Å; R238-V242 PolarHBondContact O-N 3.5Å
239	A	85.1	Confident	83.4	Confident	46 Å²	46	99 Å²	99	38%	0.38	50%	0.496	S	S	.	.	H	α-helix	trans	-59.6	-46.8	176.5	0	0	0	0	0	110.8	L235 N236 H241 V242 I243	L235-A239 WeakPolarHBondContact O-CB 3.16Å; L235-A239 PolarHBondContact O-N 2.85Å; N236-A239 PolarHBondContact O-N 3Å; A239-H241 VanDerWaalsContact C-N 3.31Å; A239-H241 PolarHBondContact O-N 3.42Å; A239-V242 PolarHBondContact O-N 2.82Å; A239-I243 WeakPolarHBondContact O-CB 3.24Å; A239-I243 WeakPolarHBondContact O-CG1 3.38Å; A239-I243 PolarHBondContact O-N 2.76Å
240	T	85.3	Confident	82.6	Confident	77 Å²	77	101.8 Å²	101.8	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-59.4	-42.5	176.4	-53.6	0	0	0	0	111.3	N236 N237 R238 I243 S244	N236-T240 WeakPolarHBondContact O-CB 3.36Å; N236-T240 PolarHBondContact O-N 2.81Å; N236-T240 PolarHBondContact O-OG1 3.41Å; N237-T240 PolarHBondContact O-N 3.37Å; R238-T240 VanDerWaalsContact C-N 3.34Å; R238-T240 PolarHBondContact O-N 3.21Å; T240-I243 PolarHBondContact O-N 2.65Å; T240-S244 WeakPolarHBondContact O-CB 3.43Å; T240-S244 PolarHBondContact O-N 2.86Å
241	H	85.3	Confident	81.3	Confident	107 Å²	107	100 Å²	100	50%	0.495	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-47.4	177.2	-166.2	74.9	0	0	0	111.9	N237 R238 A239 I243 S244 Q245	N237-H241 WeakPolarHBondContact O-CB 3.16Å; N237-H241 PolarHBondContact O-N 2.87Å; R238-H241 WeakPolarHBondContact O-CB 3.46Å; R238-H241 PolarHBondContact O-N 3.37Å; A239-H241 VanDerWaalsContact C-N 3.31Å; A239-H241 PolarHBondContact O-N 3.42Å; H241-I243 VanDerWaalsContact C-N 3.35Å; H241-I243 PolarHBondContact O-N 3.49Å; H241-S244 PolarHBondContact O-N 3.36Å; H241-S244 PolarHBondContact O-OG 2.9Å; H241-Q245 PolarHBondContact CD2-NE2 3.44Å; H241-Q245 PolarHBondContact NE2-NE2 3.31Å; H241-Q245 WeakPolarHBondContact O-CG 3.46Å; H241-Q245 PolarHBondContact O-N 2.78Å
242	V	85.9	Confident	79.9	Confident	85 Å²	85	99.9 Å²	99.9	52%	0.515	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-43	177.2	172.7	0	0	0	0	111.2	R238 A239 S244 Q245 T246	R238-V242 WeakPolarHBondContact O-CG2 3.05Å; R238-V242 PolarHBondContact O-N 3.5Å; A239-V242 PolarHBondContact O-N 2.82Å; V242-S244 VanDerWaalsContact C-N 3.34Å; V242-S244 PolarHBondContact O-N 3.38Å; V242-Q245 PolarHBondContact O-N 2.81Å; V242-T246 PolarHBondContact O-N 3.32Å; V242-T246 PolarHBondContact O-OG1 2.9Å
243	I	82.5	Confident	78.8	Confident	91 Å²	91	105.4 Å²	105.4	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-59.8	-45.7	175.5	-68.3	166.3	0	0	0	110.3	A239 T240 H241 Q245 T246 Q247	A239-I243 WeakPolarHBondContact O-CB 3.24Å; A239-I243 WeakPolarHBondContact O-CG1 3.38Å; A239-I243 PolarHBondContact O-N 2.76Å; T240-I243 PolarHBondContact O-N 2.65Å; H241-I243 VanDerWaalsContact C-N 3.35Å; H241-I243 PolarHBondContact O-N 3.49Å; I243-Q245 PolarHBondContact O-N 2.92Å; I243-T246 WeakPolarHBondContact CA-OG1 3.43Å; I243-T246 PolarHBondContact O-N 2.89Å; I243-T246 PolarHBondContact O-OG1 3.36Å; I243-T246 VanDerWaalsContact O-OG1 3.08Å; I243-Q247 HydrophobicContact CG2-CG 4.44Å; I243-Q247 WeakPolarHBondContact O-CB 3.31Å; I243-Q247 VanDerWaalsContact O-CG 3.32Å; I243-Q247 WeakPolarHBondContact O-CG 3.37Å; I243-Q247 PolarHBondContact O-N 3.06Å
244	S	81.4	Confident	77.4	Confident	36 Å²	36	105.7 Å²	105.7	25%	0.252	53%	0.534	S	S	.	.	H	α-helix	trans	-64.3	-38.5	178.8	78.3	0	0	0	0	112.7	T240 H241 V242 R248	T240-S244 WeakPolarHBondContact O-CB 3.43Å; T240-S244 PolarHBondContact O-N 2.86Å; H241-S244 PolarHBondContact O-N 3.36Å; H241-S244 PolarHBondContact O-OG 2.9Å; V242-S244 VanDerWaalsContact C-N 3.34Å; V242-S244 PolarHBondContact O-N 3.38Å; S244-R248 WeakPolarHBondContact O-CG 3.49Å; S244-R248 PolarHBondContact O-N 3.02Å
245	Q	80.9	Confident	75.7	Confident	109 Å²	109	109.4 Å²	109.4	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-68.3	-42.6	177.2	-73.6	-168	-6	0	0	111.8	H241 V242 I243 R248 S249	H241-Q245 PolarHBondContact CD2-NE2 3.44Å; H241-Q245 PolarHBondContact NE2-NE2 3.31Å; H241-Q245 WeakPolarHBondContact O-CG 3.46Å; H241-Q245 PolarHBondContact O-N 2.78Å; V242-Q245 PolarHBondContact O-N 2.81Å; I243-Q245 PolarHBondContact O-N 2.92Å; Q245-R248 PolarHBondContact O-N 3.05Å; Q245-S249 PolarHBondContact O-N 3.3Å; Q245-S249 PolarHBondContact O-OG 3.03Å
246	T	75.2	Confident	74	Confident	74 Å²	74	109.6 Å²	109.6	45%	0.454	56%	0.557	S	S	.	*	H	α-helix	trans	-66.8	-38	175.7	31.3	0	0	0	0	112.1	V242 I243 R248 S249 M250	V242-T246 PolarHBondContact O-N 3.32Å; V242-T246 PolarHBondContact O-OG1 2.9Å; I243-T246 WeakPolarHBondContact CA-OG1 3.43Å; I243-T246 PolarHBondContact O-N 2.89Å; I243-T246 PolarHBondContact O-OG1 3.36Å; I243-T246 VanDerWaalsContact O-OG1 3.08Å; T246-R248 VanDerWaalsContact C-N 3.35Å; T246-R248 PolarHBondContact O-N 3.3Å; T246-S249 PolarHBondContact O-N 3.18Å; T246-S249 PolarHBondContact O-OG 2.83Å; T246-S249 VanDerWaalsContact O-OG 3.05Å; T246-M250 VanDerWaalsContact O-CB 3.27Å; T246-M250 WeakPolarHBondContact O-CB 3.36Å; T246-M250 WeakPolarHBondContact O-CG 3.33Å; T246-M250 PolarHBondContact O-N 2.71Å
247	Q	75.5	Confident	72.5	Confident	125 Å²	125	113.2 Å²	113.2	58%	0.584	57%	0.568	S	S	*	*	H	α-helix	trans	-62.2	-40.9	172.7	-77.2	177	-13.5	0	0	112.2	I243 S251	I243-Q247 HydrophobicContact CG2-CG 4.44Å; I243-Q247 WeakPolarHBondContact O-CB 3.31Å; I243-Q247 VanDerWaalsContact O-CG 3.32Å; I243-Q247 WeakPolarHBondContact O-CG 3.37Å; I243-Q247 PolarHBondContact O-N 3.06Å; Q247-S251 WeakPolarHBondContact O-CB 3.49Å; Q247-S251 PolarHBondContact O-N 3.03Å; Q247-S251 PolarHBondContact O-OG 2.87Å
248	R	74.3	Confident	70.5	Confident	182 Å²	182	117.1 Å²	117.1	69%	0.687	58%	0.583	S	S	*	*	H	α-helix	trans	-65.5	-44.5	175.8	-75.1	176.8	-177.3	-179.3	1.6	112.3	S244 Q245 T246 S251 L252	S244-R248 WeakPolarHBondContact O-CG 3.49Å; S244-R248 PolarHBondContact O-N 3.02Å; Q245-R248 PolarHBondContact O-N 3.05Å; T246-R248 VanDerWaalsContact C-N 3.35Å; T246-R248 PolarHBondContact O-N 3.3Å; R248-S251 PolarHBondContact O-N 3.33Å; R248-L252 WeakPolarHBondContact O-CG 3.41Å; R248-L252 PolarHBondContact O-N 3Å
249	S	73.8	Confident	68.6	Low	57 Å²	57	118.9 Å²	118.9	40%	0.399	59%	0.591	S	S	.	*	H	α-helix	trans	-68	-36	178.5	68.2	0	0	0	0	112.7	Q245 T246 L252 K253	Q245-S249 PolarHBondContact O-N 3.3Å; Q245-S249 PolarHBondContact O-OG 3.03Å; T246-S249 PolarHBondContact O-N 3.18Å; T246-S249 PolarHBondContact O-OG 2.83Å; T246-S249 VanDerWaalsContact O-OG 3.05Å; S249-L252 PolarHBondContact O-N 3.09Å; S249-K253 PolarHBondContact O-N 3.09Å; S249-K253 VanDerWaalsContact O-N 3.15Å
250	M	64.9	Low	66.6	Low	119 Å²	119	121.3 Å²	121.3	59%	0.586	61%	0.611	S	S	*	*	H	α-helix	trans	-65.5	-36.7	171.5	-74.7	-91.2	-85.1	0	0	112.3	T246 K253 K254	T246-M250 VanDerWaalsContact O-CB 3.27Å; T246-M250 WeakPolarHBondContact O-CB 3.36Å; T246-M250 WeakPolarHBondContact O-CG 3.33Å; T246-M250 PolarHBondContact O-N 2.71Å; M250-K253 PolarHBondContact O-N 2.92Å; M250-K254 PolarHBondContact O-N 3.32Å
251	S	62	Low	64.8	Low	75 Å²	75	129.4 Å²	129.4	52%	0.524	65%	0.649	S	S	.	*	H	α-helix	trans	-70.2	-37.6	177.3	-59.1	0	0	0	0	112.1	Q247 R248 K253 K254	Q247-S251 WeakPolarHBondContact O-CB 3.49Å; Q247-S251 PolarHBondContact O-N 3.03Å; Q247-S251 PolarHBondContact O-OG 2.87Å; R248-S251 PolarHBondContact O-N 3.33Å; S251-K253 VanDerWaalsContact C-N 3.34Å; S251-K254 PolarHBondContact O-N 3.44Å
252	L	59.3	Low	63.8	Low	125 Å²	125	130.6 Å²	130.6	65%	0.654	66%	0.656	S	S	*	*	H	α-helix	trans	-66.4	-33.5	174.1	-74.2	161.1	0	0	0	112.5	R248 S249 K254	R248-L252 WeakPolarHBondContact O-CG 3.41Å; R248-L252 PolarHBondContact O-N 3Å; S249-L252 PolarHBondContact O-N 3.09Å; L252-K254 VanDerWaalsContact C-N 3.27Å; L252-K254 PolarHBondContact O-N 3.17Å
253	K	58.6	Low	62.6	Low	187 Å²	187	132.9 Å²	132.9	81%	0.813	66%	0.664	S	S	*	*	H	α-helix	trans	-72.4	-15.8	173	-75.6	-175.7	178	-177.7	0	114.1	S249 M250 S251	S249-K253 PolarHBondContact O-N 3.09Å; S249-K253 VanDerWaalsContact O-N 3.15Å; M250-K253 PolarHBondContact O-N 2.92Å; S251-K253 VanDerWaalsContact C-N 3.34Å
254	K	56.4	Low	61.5	Low	169 Å²	169	135.3 Å²	135.3	74%	0.735	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	1.9	-179.4	-77.9	-174.9	177.7	-174.9	0	114.2	M250 S251 L252 P256	M250-K254 PolarHBondContact O-N 3.32Å; S251-K254 PolarHBondContact O-N 3.44Å; L252-K254 VanDerWaalsContact C-N 3.27Å; L252-K254 PolarHBondContact O-N 3.17Å; K254-P256 WeakPolarHBondContact O-CD 3.44Å
255	Q	52.1	Low	60.3	Low	151 Å²	151	141.1 Å²	141.1	71%	0.706	70%	0.7	S	S	*	*			trans	-78.3	120.7	173.7	-74	-166.6	-9	0	0	111.1
256	P	52.5	Low	59	Low	110 Å²	110	143.1 Å²	143.1	71%	0.714	71%	0.712	S	S	*	*			trans	-67.9	138.8	174.9	26.8	-31	0	0	0	110.3	K254 Q258	K254-P256 WeakPolarHBondContact O-CD 3.44Å; P256-Q258 PolarHBondContact O-N 3.29Å
257	K	53.8	Low	57.9	Low	178 Å²	178	147.7 Å²	147.7	77%	0.774	73%	0.729	S	S	*	*			trans	-56.2	103.6	170.3	-69.8	-177.7	178.1	-177.9	0	108.6	Y259	K257-Y259 HydrophobicContact CB-CD2 4.44Å; K257-Y259 HydrophobicContact CB-CE2 4.35Å; K257-Y259 HydrophobicContact CD-CE2 4.42Å; K257-Y259 PolarHBondContact O-N 3.34Å; K257-Y259 VanDerWaalsContact O-N 3.13Å
258	Q	45.8	Very low	56.7	Low	187 Å²	187	149.4 Å²	149.4	87%	0.874	74%	0.739	S	S	*	*			trans	-71.6	101.5	167.3	-80.1	180	-25.5	0	0	107.8	P256	P256-Q258 PolarHBondContact O-N 3.29Å
259	Y	49.3	Very low	55.3	Low	207 Å²	207	146.8 Å²	146.8	81%	0.812	74%	0.743	S	S	*	*			trans	-84.8	119.7	153.2	-76	-84.6	0	0	0	106.6	K257	K257-Y259 HydrophobicContact CB-CD2 4.44Å; K257-Y259 HydrophobicContact CB-CE2 4.35Å; K257-Y259 HydrophobicContact CD-CE2 4.42Å; K257-Y259 PolarHBondContact O-N 3.34Å; K257-Y259 VanDerWaalsContact O-N 3.13Å
260	A	44.1	Very low	53.8	Low	97 Å²	97	154.3 Å²	154.3	80%	0.802	77%	0.772	S	S	*	*			trans	-115.6	132	166.9	0	0	0	0	0	108.6
261	I	46.7	Very low	52.8	Low	247 Å²	247	157.5 Å²	157.5	100%	1.267	79%	0.789	S	S	*	*			trans	-45.8	0	-177.8	-62	158.4	0	0	0	113.6

Retrieved 261 of 261 residues in 68.2 ms (Link to these results)

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