A0A2K5ZZA4_MANLE Loading...

Glycerol-3-phosphate dehydrogenase [NAD(+)]

Has glycerol-3-phosphate dehydrogenase activity.

AlphaFold DB , UniProt , Accession A0A2K5ZZA4, Species MANLE (Mandrillus leucophaeus, Drill), Gene GPD1, Length 349 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	62.7	Low	94	Very high	240 Å²	240	48.7 Å²	48.7	100%	1.182	27%	0.272	S	S	*	.				0	155	0	-73.5	-175.4	-139.4	0	0	108.2
2	A	87	Confident	94	Very high	91 Å²	91	46.8 Å²	46.8	75%	0.752	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-62.2	146.6	170.7	0	0	0	0	0	110.2
3	S	96.2	Very high	93.8	Very high	47 Å²	47	47.4 Å²	47.4	33%	0.329	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-64.4	151.6	175.4	54.4	0	0	0	0	111.2	Q31	S3-Q31 CarbonylContact C-O 3.58Å; S3-Q31 WeakPolarHBondContact CA-O 3.18Å
4	K	98.4	Very high	93.8	Very high	76 Å²	76	47.1 Å²	47.1	33%	0.33	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.2	-178	-63.8	-65.6	-176.1	174.3	0	110.8	Q31 F32 D33 D87 I88	K4-Q31 PolarHBondContact N-O 3.13Å; K4-F32 HydrophobicContact CB-CD1 4.01Å; K4-F32 HydrophobicContact CB-CE1 4.41Å; K4-F32 WeakPolarHBondContact O-CA 3.49Å; K4-D33 PolarHBondContact O-N 2.69Å; K4-D87 HydrophobicContact CB-CB 4.18Å; K4-D87 HydrophobicContact CD-CB 3.7Å; K4-D87 IonicContact NZ-OD1 3.97Å; K4-I88 HydrophobicContact CB-CD1 4.21Å
5	K	98.8	Very high	94.1	Very high	67 Å²	67	44 Å²	44	29%	0.291	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.1	174.3	-71.4	179.5	173.6	-176.7	0	110.7	D33 D85 D87 I88	K5-D33 HydrophobicContact CB-CB 4.49Å; K5-D33 HydrophobicContact CG-CB 3.81Å; K5-D85 HydrophobicContact CD-CB 3.68Å; K5-D85 WeakPolarHBondContact CD-O 3.39Å; K5-D85 IonicContact NZ-OD2 2.98Å; K5-D85 PolarHBondContact NZ-OD2 3.4Å; K5-D87 PolarHBondContact N-OD2 3.25Å; K5-D87 PolarHBondContact O-N 3.31Å; K5-I88 PolarHBondContact O-N 2.91Å
6	V	98.9	Very high	94.4	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.3	-176.6	-174.2	0	0	0	0	110.3	V22 F32 T37 I88 I90 L180	V6-V22 HydrophobicContact CB-CG1 4.5Å; V6-V22 HydrophobicContact CG1-CG1 3.81Å; V6-F32 HydrophobicContact CG2-CD1 4.21Å; V6-T37 PolarHBondContact O-N 3.34Å; V6-T37 VanDerWaalsContact O-N 3.14Å; V6-T37 PolarHBondContact O-OG1 3.48Å; V6-I88 WeakPolarHBondContact CA-O 3.48Å; V6-I88 HydrophobicContact CG2-CB 4.33Å; V6-I88 HydrophobicContact CG2-CD1 4.4Å; V6-I90 HydrophobicContact CG1-CD1 3.94Å; V6-I90 HydrophobicContact CG1-CG1 4.36Å; V6-L180 HydrophobicContact CG1-CD2 4.08Å; V6-L180 HydrophobicContact CG2-CD1 4.06Å; V6-L180 HydrophobicContact CG2-CD2 3.96Å
7	C	98.9	Very high	94.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.6	169.6	173.3	0	0	0	0	110.4	T37 A82 A86 I88 L89 I90	C7-T37 CarbonylContact C-O 3.5Å; C7-T37 WeakPolarHBondContact CA-O 3.45Å; C7-T37 WeakPolarHBondContact CA-OG1 3.25Å; C7-T37 WeakPolarHBondContact CB-OG1 3.43Å; C7-A82 WeakPolarHBondContact CB-O 3.41Å; C7-A82 VanDerWaalsContact SG-C 3.57Å; C7-A82 PolarHBondContact SG-O 3.3Å; C7-A82 VanDerWaalsContact SG-O 3.37Å; C7-A86 HydrophobicContact CB-CB 3.64Å; C7-I88 PolarHBondContact N-O 3.25Å; C7-L89 HydrophobicContact CB-CD2 3.71Å; C7-L89 WeakPolarHBondContact O-CA 3.37Å; C7-I90 PolarHBondContact O-N 3.34Å
8	I	98.9	Very high	94.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	107.4	171.1	-54.6	173.9	0	0	0	107.8	G10 A19 V22 V36 T37 M38 W39 I90 V92	I8-G10 WeakPolarHBondContact CG2-O 3.29Å; I8-G10 PolarHBondContact O-N 3.21Å; I8-A19 VanDerWaalsContact CD1-CA 3.45Å; I8-A19 HydrophobicContact CD1-CB 3.67Å; I8-V22 HydrophobicContact CD1-CB 4.1Å; I8-V22 HydrophobicContact CD1-CG1 4.15Å; I8-V22 HydrophobicContact CG1-CG1 4.44Å; I8-V36 HydrophobicContact CD1-CG1 3.89Å; I8-V36 HydrophobicContact CG1-CG1 4.03Å; I8-T37 PolarHBondContact N-O 3.44Å; I8-M38 HydrophobicContact CB-CB 4.3Å; I8-M38 HydrophobicContact CB-CG 4.15Å; I8-M38 HydrophobicContact CG2-CG 4.3Å; I8-M38 CarbonylContact O-C 3.34Å; I8-M38 VanDerWaalsContact O-CA 3.32Å; I8-M38 WeakPolarHBondContact O-CA 3.42Å; I8-W39 PolarHBondContact O-N 2.81Å; I8-I90 HydrophobicContact CG1-CD1 4.41Å; I8-V92 HydrophobicContact CG2-CG1 3.54Å
9	V	98.9	Very high	95	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	85.4	176.3	-173.6	0	0	0	0	108.2	W39 V79 L89 I90 F91 V92 V93 I101	V9-W39 HydrophobicContact CG1-CE3 3.8Å; V9-W39 HydrophobicContact CG1-CZ3 4.42Å; V9-V79 HydrophobicContact CG1-CG2 3.95Å; V9-L89 HydrophobicContact CG2-CD2 4.38Å; V9-I90 PolarHBondContact N-O 2.9Å; V9-F91 HydrophobicContact CB-CD1 3.98Å; V9-F91 HydrophobicContact CB-CE1 4.37Å; V9-F91 HydrophobicContact CG1-CD1 4.07Å; V9-F91 HydrophobicContact CG1-CE1 4.37Å; V9-F91 HydrophobicContact CG2-CD1 4.28Å; V9-F91 HydrophobicContact CG2-CE1 4.21Å; V9-V92 PolarHBondContact O-N 3.09Å; V9-V93 WeakPolarHBondContact O-CG1 3.44Å; V9-I101 HydrophobicContact CG1-CG2 3.72Å
10	G	98.1	Very high	95.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.01	20%	0.195	C	C	.	.			trans	136.6	139.7	176.9	0	0	0	0	0	113.9	I8 W39	I8-G10 WeakPolarHBondContact CG2-O 3.29Å; I8-G10 PolarHBondContact O-N 3.21Å; G10-W39 CarbonylContact C-O 3.47Å; G10-W39 PolarHBondContact N-O 3.19Å
11	S	97.4	Very high	95.4	Very high	12 Å²	12	34.2 Å²	34.2	8%	0.084	19%	0.19	C	C	.	.			trans	-131.5	27.1	-171.8	66.5	0	0	0	0	113.7	S16 V40 N60	S11-S16 PolarHBondContact O-OG 2.91Å; S11-V40 WeakPolarHBondContact OG-CA 3.42Å; S11-N60 PolarHBondContact O-ND2 3.5Å
12	G	93.6	Very high	97.1	Very high	26 Å²	26	22.8 Å²	22.8	27%	0.268	13%	0.133	S	C	.	.	S	Bend	trans	-71.3	-164.9	175.2	0	0	0	0	0	112.4	W14 G15 S16	G12-W14 PolarHBondContact O-N 3.22Å; G12-G15 PolarHBondContact O-N 2.81Å; G12-S16 VanDerWaalsContact O-CB 3.31Å; G12-S16 WeakPolarHBondContact O-CB 3.36Å; G12-S16 PolarHBondContact O-N 3.21Å; G12-S16 PolarHBondContact O-OG 3.15Å
13	N	91	Very high	97.7	Very high	54 Å²	54	18.4 Å²	18.4	29%	0.289	10%	0.098	S	C	.	.	H	α-helix	trans	-58.6	-47.2	177.6	179.9	-110.9	0	0	0	111.4	A17 Y63 A153	N13-A17 PolarHBondContact O-N 2.81Å; N13-Y63 WeakPolarHBondContact CA-O 3.09Å; N13-Y63 WeakPolarHBondContact CB-O 3.46Å; N13-Y63 PolarHBondContact ND2-O 3.34Å; N13-A153 WeakPolarHBondContact OD1-CB 3.42Å
14	W	94.8	Very high	97.8	Very high	43 Å²	43	17.2 Å²	17.2	16%	0.163	9%	0.092	C	C	.	.	H	α-helix	trans	-71.3	-42.8	175	-170.8	-136	0	0	0	113.2	G12 S16 A17 I18 V92 L147 N151 A153 V156 F186	G12-W14 PolarHBondContact O-N 3.22Å; W14-S16 VanDerWaalsContact C-N 3.27Å; W14-S16 PolarHBondContact O-N 3.27Å; W14-A17 HydrophobicContact CE3-CB 3.97Å; W14-A17 HydrophobicContact CZ3-CB 4.22Å; W14-A17 PolarHBondContact O-N 2.85Å; W14-A17 VanDerWaalsContact O-N 3.16Å; W14-I18 HydrophobicContact CD2-CD1 4.37Å; W14-I18 HydrophobicContact CD2-CG1 3.96Å; W14-I18 HydrophobicContact CE3-CG1 4.35Å; W14-I18 HydrophobicContact CG-CG1 4.37Å; W14-I18 HydrophobicContact CH2-CD1 3.87Å; W14-I18 HydrophobicContact CH2-CG1 4.44Å; W14-I18 HydrophobicContact CZ2-CD1 3.57Å; W14-I18 HydrophobicContact CZ2-CG1 4.1Å; W14-I18 HydrophobicContact CZ3-CD1 4.4Å; W14-I18 VanDerWaalsContact O-CG1 3.25Å; W14-I18 WeakPolarHBondContact O-CG1 3.36Å; W14-I18 PolarHBondContact O-N 3.33Å; W14-V92 HydrophobicContact CB-CG2 4.19Å; W14-V92 VanDerWaalsContact CD1-CG2 3.41Å; W14-V92 HydrophobicContact CG-CG2 4Å; W14-L147 HydrophobicContact CZ2-CD2 4.4Å; W14-N151 HydrophobicContact CH2-CB 3.41Å; W14-N151 VanDerWaalsContact CH2-CB 3.41Å; W14-N151 HydrophobicContact CZ2-CB 3.76Å; W14-N151 HydrophobicContact CZ3-CB 4.11Å; W14-A153 HydrophobicContact CB-CB 4.35Å; W14-A153 HydrophobicContact CD2-CB 4.45Å; W14-A153 HydrophobicContact CE3-CB 3.56Å; W14-A153 HydrophobicContact CZ3-CB 4.29Å; W14-V156 HydrophobicContact CH2-CB 4.36Å; W14-V156 HydrophobicContact CH2-CG1 4.19Å; W14-V156 HydrophobicContact CH2-CG2 3.92Å; W14-V156 HydrophobicContact CZ3-CB 3.8Å; W14-V156 HydrophobicContact CZ3-CG1 3.89Å; W14-V156 HydrophobicContact CZ3-CG2 3.69Å; W14-F186 HydrophobicContact CH2-CE2 4.1Å; W14-F186 HydrophobicContact CH2-CZ 4.21Å; W14-F186 HydrophobicContact CZ2-CZ 4.5Å
15	G	97.8	Very high	97.8	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.01	8%	0.081	C	C	.	.	H	α-helix	trans	-58.7	-38.3	177.7	0	0	0	0	0	113.2	G12 I18 A19	G12-G15 PolarHBondContact O-N 2.81Å; G15-I18 PolarHBondContact O-N 3.09Å; G15-A19 WeakPolarHBondContact O-CB 3.12Å; G15-A19 PolarHBondContact O-N 2.69Å
16	S	98.5	Very high	97.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-70.7	-39	176.2	-56.5	0	0	0	0	112.6	S11 G12 W14 I18 A19 K20 N60 L69	S11-S16 PolarHBondContact O-OG 2.91Å; G12-S16 VanDerWaalsContact O-CB 3.31Å; G12-S16 WeakPolarHBondContact O-CB 3.36Å; G12-S16 PolarHBondContact O-N 3.21Å; G12-S16 PolarHBondContact O-OG 3.15Å; W14-S16 VanDerWaalsContact C-N 3.27Å; W14-S16 PolarHBondContact O-N 3.27Å; S16-I18 VanDerWaalsContact C-N 3.32Å; S16-A19 WeakPolarHBondContact O-CB 3.43Å; S16-A19 PolarHBondContact O-N 2.94Å; S16-K20 PolarHBondContact O-N 3.37Å; S16-N60 PolarHBondContact OG-ND2 3.19Å; S16-L69 VanDerWaalsContact O-CD2 3.3Å; S16-L69 WeakPolarHBondContact O-CD2 3.27Å
17	A	98.4	Very high	97.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.8	-40.6	174	0	0	0	0	0	111.2	N13 W14 A19 K20 I21 L64 A153 A157	N13-A17 PolarHBondContact O-N 2.81Å; W14-A17 HydrophobicContact CE3-CB 3.97Å; W14-A17 HydrophobicContact CZ3-CB 4.22Å; W14-A17 PolarHBondContact O-N 2.85Å; W14-A17 VanDerWaalsContact O-N 3.16Å; A17-A19 VanDerWaalsContact C-N 3.35Å; A17-K20 WeakPolarHBondContact O-CB 3.47Å; A17-K20 PolarHBondContact O-N 2.69Å; A17-I21 PolarHBondContact O-N 3.41Å; A17-L64 HydrophobicContact CB-CD2 4.44Å; A17-A153 HydrophobicContact CB-CB 4.35Å; A17-A157 HydrophobicContact CB-CB 4.26Å
18	I	98.7	Very high	97.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.4	-38.5	174.8	-66.2	-70.1	0	0	0	111.4	W14 G15 S16 K20 I21 V22 I90 L118 M181	W14-I18 HydrophobicContact CD2-CD1 4.37Å; W14-I18 HydrophobicContact CD2-CG1 3.96Å; W14-I18 HydrophobicContact CE3-CG1 4.35Å; W14-I18 HydrophobicContact CG-CG1 4.37Å; W14-I18 HydrophobicContact CH2-CD1 3.87Å; W14-I18 HydrophobicContact CH2-CG1 4.44Å; W14-I18 HydrophobicContact CZ2-CD1 3.57Å; W14-I18 HydrophobicContact CZ2-CG1 4.1Å; W14-I18 HydrophobicContact CZ3-CD1 4.4Å; W14-I18 VanDerWaalsContact O-CG1 3.25Å; W14-I18 WeakPolarHBondContact O-CG1 3.36Å; W14-I18 PolarHBondContact O-N 3.33Å; G15-I18 PolarHBondContact O-N 3.09Å; S16-I18 VanDerWaalsContact C-N 3.32Å; I18-K20 PolarHBondContact O-N 2.95Å; I18-I21 PolarHBondContact O-N 2.92Å; I18-I21 VanDerWaalsContact O-N 3.14Å; I18-V22 HydrophobicContact CG2-CG2 3.78Å; I18-V22 WeakPolarHBondContact O-CB 3.4Å; I18-V22 WeakPolarHBondContact O-CG2 3.49Å; I18-V22 PolarHBondContact O-N 3.44Å; I18-I90 HydrophobicContact CG2-CG2 4.26Å; I18-L118 HydrophobicContact CD1-CD2 3.57Å; I18-L118 HydrophobicContact CG1-CD2 3.65Å; I18-L118 HydrophobicContact CG2-CD2 4.27Å; I18-M181 HydrophobicContact CD1-CE 3.56Å; I18-M181 HydrophobicContact CG2-CE 4.01Å
19	A	98.9	Very high	97.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-32.6	174.2	0	0	0	0	0	113.1	I8 G15 S16 A17 G23 M38 L69 V73	I8-A19 VanDerWaalsContact CD1-CA 3.45Å; I8-A19 HydrophobicContact CD1-CB 3.67Å; G15-A19 WeakPolarHBondContact O-CB 3.12Å; G15-A19 PolarHBondContact O-N 2.69Å; S16-A19 WeakPolarHBondContact O-CB 3.43Å; S16-A19 PolarHBondContact O-N 2.94Å; A17-A19 VanDerWaalsContact C-N 3.35Å; A19-G23 WeakPolarHBondContact O-CA 3.23Å; A19-G23 PolarHBondContact O-N 2.9Å; A19-M38 HydrophobicContact CB-SD 3.78Å; A19-L69 HydrophobicContact CB-CD2 4.27Å; A19-V73 HydrophobicContact CB-CG1 4.14Å; A19-V73 HydrophobicContact CB-CG2 4.43Å
20	K	98.8	Very high	97.7	Very high	42 Å²	42	28.6 Å²	28.6	18%	0.183	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-48.2	172.2	-65.8	174.1	61.4	77.4	0	112	S16 A17 I18 G24 L64 H67 K68 L69 P70 A157	S16-K20 PolarHBondContact O-N 3.37Å; A17-K20 WeakPolarHBondContact O-CB 3.47Å; A17-K20 PolarHBondContact O-N 2.69Å; I18-K20 PolarHBondContact O-N 2.95Å; K20-G24 PolarHBondContact O-N 3.41Å; K20-G24 VanDerWaalsContact O-N 3.09Å; K20-L64 HydrophobicContact CD-CD2 3.99Å; K20-H67 HydrophobicContact CD-CB 4.13Å; K20-K68 PolarHBondContact NZ-O 3.08Å; K20-L69 HydrophobicContact CG-CD2 3.8Å; K20-P70 WeakPolarHBondContact O-CG 3.32Å; K20-A157 HydrophobicContact CD-CB 4.16Å; K20-A157 WeakPolarHBondContact CE-O 3.42Å
21	I	98.9	Very high	97.7	Very high	16 Å²	16	31.8 Å²	31.8	8%	0.082	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-56.2	-179.7	-68.8	169.8	0	0	0	110.7	A17 I18 G23 G24 N25 V156 M181 T183 F186	A17-I21 PolarHBondContact O-N 3.41Å; I18-I21 PolarHBondContact O-N 2.92Å; I18-I21 VanDerWaalsContact O-N 3.14Å; I21-G23 PolarHBondContact O-N 3.15Å; I21-G24 PolarHBondContact O-N 3.34Å; I21-N25 WeakPolarHBondContact O-CB 3.34Å; I21-N25 PolarHBondContact O-N 3.27Å; I21-V156 HydrophobicContact CD1-CG1 3.55Å; I21-M181 WeakPolarHBondContact CG2-O 3.23Å; I21-T183 HydrophobicContact CB-CG2 4.38Å; I21-T183 HydrophobicContact CG1-CG2 4.07Å; I21-T183 HydrophobicContact CG2-CG2 3.72Å; I21-F186 HydrophobicContact CD1-CB 4.2Å; I21-F186 HydrophobicContact CD1-CD1 3.99Å; I21-F186 HydrophobicContact CD1-CD2 4.34Å; I21-F186 HydrophobicContact CD1-CE1 4.41Å; I21-F186 HydrophobicContact CD1-CG 3.92Å
22	V	98.9	Very high	97.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-43.6	-175.3	172.2	0	0	0	0	110.7	V6 I8 I18 N25 A26 V36 I90 L180 M181	V6-V22 HydrophobicContact CB-CG1 4.5Å; V6-V22 HydrophobicContact CG1-CG1 3.81Å; I8-V22 HydrophobicContact CD1-CB 4.1Å; I8-V22 HydrophobicContact CD1-CG1 4.15Å; I8-V22 HydrophobicContact CG1-CG1 4.44Å; I18-V22 HydrophobicContact CG2-CG2 3.78Å; I18-V22 WeakPolarHBondContact O-CB 3.4Å; I18-V22 WeakPolarHBondContact O-CG2 3.49Å; I18-V22 PolarHBondContact O-N 3.44Å; V22-N25 PolarHBondContact O-N 3.18Å; V22-A26 WeakPolarHBondContact O-CB 3.27Å; V22-A26 PolarHBondContact O-N 3.48Å; V22-V36 HydrophobicContact CG1-CG1 3.93Å; V22-V36 HydrophobicContact CG1-CG2 4.21Å; V22-I90 HydrophobicContact CG1-CD1 4.26Å; V22-I90 HydrophobicContact CG2-CD1 3.65Å; V22-L180 HydrophobicContact CG1-CD1 4.05Å; V22-L180 HydrophobicContact CG1-CG 4.45Å; V22-M181 HydrophobicContact CG2-CE 4.34Å; V22-M181 HydrophobicContact CG2-SD 3.49Å; V22-M181 WeakPolarHBondContact CG2-SD 3.33Å
23	G	98.9	Very high	98	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-42.5	176.3	0	0	0	0	0	112.3	A19 I21 A27 N72	A19-G23 WeakPolarHBondContact O-CA 3.23Å; A19-G23 PolarHBondContact O-N 2.9Å; I21-G23 PolarHBondContact O-N 3.15Å; G23-A27 WeakPolarHBondContact O-CB 3.2Å; G23-A27 PolarHBondContact O-N 3.33Å; G23-A27 VanDerWaalsContact O-N 3.13Å; G23-N72 PolarHBondContact O-ND2 2.96Å
24	G	98.8	Very high	98.4	Very high	21 Å²	21	32.6 Å²	32.6	22%	0.216	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-49.1	176.5	0	0	0	0	0	112.5	K20 I21 A27 Q28	K20-G24 PolarHBondContact O-N 3.41Å; K20-G24 VanDerWaalsContact O-N 3.09Å; I21-G24 PolarHBondContact O-N 3.34Å; G24-A27 PolarHBondContact O-N 2.86Å; G24-Q28 VanDerWaalsContact O-CG 3.32Å; G24-Q28 WeakPolarHBondContact O-CG 3.41Å; G24-Q28 PolarHBondContact O-N 3.18Å
25	N	98.9	Very high	98.6	Very high	19 Å²	19	36.7 Å²	36.7	10%	0.102	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-44.5	179.7	-76.5	-11.5	0	0	0	112	I21 V22 A27 Q28 L29 L180 Q182	I21-N25 WeakPolarHBondContact O-CB 3.34Å; I21-N25 PolarHBondContact O-N 3.27Å; V22-N25 PolarHBondContact O-N 3.18Å; N25-A27 VanDerWaalsContact C-N 3.26Å; N25-A27 PolarHBondContact O-N 3.38Å; N25-Q28 PolarHBondContact O-N 3.38Å; N25-L29 HydrophobicContact CB-CD1 4.18Å; N25-L29 VanDerWaalsContact O-CB 3.27Å; N25-L29 WeakPolarHBondContact O-CB 3.47Å; N25-L29 WeakPolarHBondContact O-CG 3.36Å; N25-L29 PolarHBondContact O-N 3.05Å; N25-L180 WeakPolarHBondContact CB-O 3.39Å; N25-L180 PolarHBondContact ND2-O 3.49Å; N25-Q182 PolarHBondContact ND2-O 3.46Å
26	A	98.8	Very high	98.7	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.017	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-30.3	179	0	0	0	0	0	113.1	V22 Q28 F32 V36	V22-A26 WeakPolarHBondContact O-CB 3.27Å; V22-A26 PolarHBondContact O-N 3.48Å; A26-Q28 VanDerWaalsContact C-N 3.32Å; A26-F32 HydrophobicContact CB-CB 4.02Å; A26-V36 HydrophobicContact CB-CG2 3.56Å
27	A	98.6	Very high	98.7	Very high	59 Å²	59	37.1 Å²	37.1	49%	0.488	21%	0.21	S	C	.	.	H	α-helix	trans	-71.2	-26.6	173.6	0	0	0	0	0	113.2	G23 G24 N25	G23-A27 WeakPolarHBondContact O-CB 3.2Å; G23-A27 PolarHBondContact O-N 3.33Å; G23-A27 VanDerWaalsContact O-N 3.13Å; G24-A27 PolarHBondContact O-N 2.86Å; N25-A27 VanDerWaalsContact C-N 3.26Å; N25-A27 PolarHBondContact O-N 3.38Å
28	Q	98.4	Very high	98.7	Very high	157 Å²	157	37.1 Å²	37.1	73%	0.734	21%	0.21	S	C	*	.	H	α-helix	trans	-99	-30.5	-173.7	-68	175.9	12.6	0	0	113.4	G24 N25 A26	G24-Q28 VanDerWaalsContact O-CG 3.32Å; G24-Q28 WeakPolarHBondContact O-CG 3.41Å; G24-Q28 PolarHBondContact O-N 3.18Å; N25-Q28 PolarHBondContact O-N 3.38Å; A26-Q28 VanDerWaalsContact C-N 3.32Å
29	L	98.5	Very high	98.7	Very high	53 Å²	53	38.3 Å²	38.3	28%	0.277	21%	0.214	S	C	.	.			trans	-101.8	116.8	-169.7	-67.3	179.7	0	0	0	111.2	N25 Q31 F32 E179	N25-L29 HydrophobicContact CB-CD1 4.18Å; N25-L29 VanDerWaalsContact O-CB 3.27Å; N25-L29 WeakPolarHBondContact O-CB 3.47Å; N25-L29 WeakPolarHBondContact O-CG 3.36Å; N25-L29 PolarHBondContact O-N 3.05Å; L29-Q31 PolarHBondContact O-N 2.99Å; L29-Q31 VanDerWaalsContact O-N 3.08Å; L29-F32 HydrophobicContact CB-CD2 3.84Å; L29-F32 HydrophobicContact CB-CE2 4.41Å; L29-F32 HydrophobicContact CD1-CD2 4.11Å; L29-F32 HydrophobicContact CD1-CE2 4Å; L29-F32 PolarHBondContact O-N 3.39Å; L29-E179 WeakPolarHBondContact CD1-O 3.38Å
30	A	97.9	Very high	98.7	Very high	95 Å²	95	38.3 Å²	38.3	79%	0.785	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.6	-173.2	0	0	0	0	0	115	F32	A30-F32 VanDerWaalsContact C-N 3.26Å; A30-F32 PolarHBondContact O-N 3.01Å
31	Q	98.1	Very high	98.6	Very high	68 Å²	68	42.8 Å²	42.8	32%	0.318	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10	176.7	66.4	-88.8	44.1	0	0	113.6	S3 K4 L29 E179	S3-Q31 CarbonylContact C-O 3.58Å; S3-Q31 WeakPolarHBondContact CA-O 3.18Å; K4-Q31 PolarHBondContact N-O 3.13Å; L29-Q31 PolarHBondContact O-N 2.99Å; L29-Q31 VanDerWaalsContact O-N 3.08Å; Q31-E179 PolarHBondContact NE2-OE2 3.45Å
32	F	98.8	Very high	98.5	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.4	176.3	-59.8	-66.1	0	0	0	110.9	K4 V6 A26 L29 A30 I88 L176 E179 L180	K4-F32 HydrophobicContact CB-CD1 4.01Å; K4-F32 HydrophobicContact CB-CE1 4.41Å; K4-F32 WeakPolarHBondContact O-CA 3.49Å; V6-F32 HydrophobicContact CG2-CD1 4.21Å; A26-F32 HydrophobicContact CB-CB 4.02Å; L29-F32 HydrophobicContact CB-CD2 3.84Å; L29-F32 HydrophobicContact CB-CE2 4.41Å; L29-F32 HydrophobicContact CD1-CD2 4.11Å; L29-F32 HydrophobicContact CD1-CE2 4Å; L29-F32 PolarHBondContact O-N 3.39Å; A30-F32 VanDerWaalsContact C-N 3.26Å; A30-F32 PolarHBondContact O-N 3.01Å; F32-I88 HydrophobicContact CD1-CD1 4.39Å; F32-I88 HydrophobicContact CE1-CD1 3.86Å; F32-L176 HydrophobicContact CE1-CD1 3.71Å; F32-L176 HydrophobicContact CE1-CG 4.17Å; F32-L176 HydrophobicContact CZ-CD1 3.67Å; F32-L176 HydrophobicContact CZ-CG 4.23Å; F32-L176 WeakPolarHBondContact CZ-O 3.45Å; F32-E179 HydrophobicContact CE2-CB 4.24Å; F32-E179 HydrophobicContact CZ-CB 4.46Å; F32-L180 HydrophobicContact CD1-CD1 3.88Å; F32-L180 HydrophobicContact CD2-CD1 3.99Å; F32-L180 HydrophobicContact CE1-CB 4Å; F32-L180 HydrophobicContact CE1-CD1 3.97Å; F32-L180 HydrophobicContact CE1-CD2 4.35Å; F32-L180 HydrophobicContact CE1-CG 4.33Å; F32-L180 HydrophobicContact CE2-CB 3.98Å; F32-L180 HydrophobicContact CE2-CD1 4.06Å; F32-L180 HydrophobicContact CG-CD1 3.92Å; F32-L180 HydrophobicContact CZ-CB 3.58Å; F32-L180 HydrophobicContact CZ-CD1 4.08Å; F32-L180 HydrophobicContact CZ-CG 4.33Å
33	D	98.8	Very high	98.4	Very high	35 Å²	35	46.9 Å²	46.9	19%	0.187	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.1	172.7	-170.1	-51.3	0	0	0	108.1	K4 K5 R35	K4-D33 PolarHBondContact O-N 2.69Å; K5-D33 HydrophobicContact CB-CB 4.49Å; K5-D33 HydrophobicContact CG-CB 3.81Å; D33-R35 PolarHBondContact O-N 3.08Å; D33-R35 WeakPolarHBondContact OD1-CB 3.39Å; D33-R35 PolarHBondContact OD1-N 3.45Å
34	P	98.6	Very high	98.2	Very high	70 Å²	70	52.3 Å²	52.3	46%	0.455	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	-26.9	-179.8	24.9	-34.9	0	0	0	112.1	V36 N72	P34-V36 PolarHBondContact O-N 2.99Å; P34-N72 VanDerWaalsContact O-CB 3.27Å; P34-N72 WeakPolarHBondContact O-CB 3.43Å; P34-N72 PolarHBondContact O-ND2 2.9Å
35	R	98.8	Very high	98.1	Very high	129 Å²	129	54 Å²	54	49%	0.487	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	108.3	177.2	-176.9	175.8	178.4	-98.3	1	110.4	D33 V74	D33-R35 PolarHBondContact O-N 3.08Å; D33-R35 WeakPolarHBondContact OD1-CB 3.39Å; D33-R35 PolarHBondContact OD1-N 3.45Å; R35-V74 HydrophobicContact CG-CG2 4.42Å
36	V	98.9	Very high	97.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.4	173.8	-179.9	0	0	0	0	108.9	I8 V22 A26 P34 N72 V73 V74	I8-V36 HydrophobicContact CD1-CG1 3.89Å; I8-V36 HydrophobicContact CG1-CG1 4.03Å; V22-V36 HydrophobicContact CG1-CG1 3.93Å; V22-V36 HydrophobicContact CG1-CG2 4.21Å; A26-V36 HydrophobicContact CB-CG2 3.56Å; P34-V36 PolarHBondContact O-N 2.99Å; V36-N72 PolarHBondContact N-O 3.3Å; V36-N72 VanDerWaalsContact N-O 3.08Å; V36-V73 HydrophobicContact CB-CG2 4.31Å; V36-V73 CarbonylContact O-C 3.55Å; V36-V73 WeakPolarHBondContact O-CA 3.17Å; V36-V74 PolarHBondContact O-N 3.28Å
37	T	98.9	Very high	97.6	Very high	9 Å²	9	59.8 Å²	59.8	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	144.1	171.6	49.6	0	0	0	0	110	V6 C7 I8 V76 A82	V6-T37 PolarHBondContact O-N 3.34Å; V6-T37 VanDerWaalsContact O-N 3.14Å; V6-T37 PolarHBondContact O-OG1 3.48Å; C7-T37 CarbonylContact C-O 3.5Å; C7-T37 WeakPolarHBondContact CA-O 3.45Å; C7-T37 WeakPolarHBondContact CA-OG1 3.25Å; C7-T37 WeakPolarHBondContact CB-OG1 3.43Å; I8-T37 PolarHBondContact N-O 3.44Å; T37-V76 HydrophobicContact CG2-CG2 4.25Å; T37-A82 WeakPolarHBondContact CB-O 3.46Å; T37-A82 PolarHBondContact OG1-O 3.42Å
38	M	98.9	Very high	97.6	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	116	172.1	-178.1	174.7	64.8	0	0	108.4	I8 A19 V40 I54 L69 V73 V74 A75 V76	I8-M38 HydrophobicContact CB-CB 4.3Å; I8-M38 HydrophobicContact CB-CG 4.15Å; I8-M38 HydrophobicContact CG2-CG 4.3Å; I8-M38 CarbonylContact O-C 3.34Å; I8-M38 VanDerWaalsContact O-CA 3.32Å; I8-M38 WeakPolarHBondContact O-CA 3.42Å; A19-M38 HydrophobicContact CB-SD 3.78Å; M38-V40 HydrophobicContact CE-CG2 3.98Å; M38-V40 HydrophobicContact CG-CG2 4.41Å; M38-V40 PolarHBondContact O-N 3.01Å; M38-I54 HydrophobicContact CE-CD1 4.4Å; M38-I54 HydrophobicContact CE-CG2 4.21Å; M38-L69 HydrophobicContact CE-CD1 3.81Å; M38-V73 HydrophobicContact CB-CG1 3.88Å; M38-V73 HydrophobicContact CE-CG1 4.3Å; M38-V73 HydrophobicContact SD-CG1 4.47Å; M38-V74 PolarHBondContact N-O 2.76Å; M38-A75 WeakPolarHBondContact O-CA 3.29Å; M38-V76 PolarHBondContact O-N 3.14Å
39	W	98.9	Very high	97.6	Very high	25 Å²	25	60.3 Å²	60.3	10%	0.095	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	124.9	172.7	174.4	58.4	0	0	0	109.9	I8 V9 G10 F41 V76 P77 V79 A82 V93 I101	I8-W39 PolarHBondContact O-N 2.81Å; V9-W39 HydrophobicContact CG1-CE3 3.8Å; V9-W39 HydrophobicContact CG1-CZ3 4.42Å; G10-W39 CarbonylContact C-O 3.47Å; G10-W39 PolarHBondContact N-O 3.19Å; W39-F41 HydrophobicContact CZ2-CB 4.38Å; W39-F41 HydrophobicContact CZ2-CD2 4.48Å; W39-V76 WeakPolarHBondContact CA-O 3.45Å; W39-P77 PolarHBondContact NE1-O 3.06Å; W39-V79 HydrophobicContact CB-CG2 4.14Å; W39-V79 VanDerWaalsContact CD1-CA 3.43Å; W39-V79 HydrophobicContact CD2-CB 3.89Å; W39-V79 HydrophobicContact CD2-CG2 3.66Å; W39-V79 HydrophobicContact CE3-CG2 4.11Å; W39-V79 HydrophobicContact CG-CB 3.79Å; W39-V79 HydrophobicContact CG-CG2 3.65Å; W39-V79 HydrophobicContact CZ2-CB 4.49Å; W39-A82 HydrophobicContact CB-CB 3.95Å; W39-V93 HydrophobicContact CE3-CG1 4.33Å; W39-V93 HydrophobicContact CZ3-CG1 3.8Å; W39-I101 HydrophobicContact CE3-CD1 4.38Å; W39-I101 HydrophobicContact CH2-CD1 3.55Å; W39-I101 HydrophobicContact CH2-CG1 3.62Å; W39-I101 HydrophobicContact CZ2-CG1 4.49Å; W39-I101 HydrophobicContact CZ3-CD1 3.32Å; W39-I101 HydrophobicContact CZ3-CG1 3.77Å
40	V	98.6	Very high	97.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.325	C	S	.	.			trans	-120.5	121	179.6	178.7	0	0	0	0	108.1	S11 M38 E42 L50 T51 I54 A75 V76 P77	S11-V40 WeakPolarHBondContact OG-CA 3.42Å; M38-V40 HydrophobicContact CE-CG2 3.98Å; M38-V40 HydrophobicContact CG-CG2 4.41Å; M38-V40 PolarHBondContact O-N 3.01Å; V40-E42 PolarHBondContact O-N 2.96Å; V40-L50 HydrophobicContact CG1-CD2 3.97Å; V40-L50 HydrophobicContact CG1-CG 4.13Å; V40-T51 HydrophobicContact CB-CG2 3.69Å; V40-T51 HydrophobicContact CG1-CG2 3.88Å; V40-T51 HydrophobicContact CG2-CG2 4.36Å; V40-I54 HydrophobicContact CG1-CD1 4.11Å; V40-I54 HydrophobicContact CG2-CD1 3.97Å; V40-A75 HydrophobicContact CG2-CB 3.63Å; V40-V76 PolarHBondContact N-O 2.78Å; V40-P77 WeakPolarHBondContact O-CA 3.44Å
41	F	96.6	Very high	97.6	Very high	137 Å²	137	53.7 Å²	53.7	60%	0.601	29%	0.291	S	S	*	.			trans	-63.7	123.7	168.9	-179.1	-96.8	0	0	0	108.8	W39 E43	W39-F41 HydrophobicContact CZ2-CB 4.38Å; W39-F41 HydrophobicContact CZ2-CD2 4.48Å; F41-E43 HydrophobicContact CD1-CG 4.01Å; F41-E43 HydrophobicContact CE1-CG 4.43Å; F41-E43 PolarHBondContact O-N 3.27Å
42	E	97.4	Very high	97.6	Very high	57 Å²	57	55.1 Å²	55.1	27%	0.266	30%	0.297	S	S	.	.			trans	-69.3	131.2	-171.3	-163.8	71.3	-85.3	0	0	111.4	V40 K49 L50 T51 P77	V40-E42 PolarHBondContact O-N 2.96Å; E42-K49 HydrophobicContact CG-CD 4.46Å; E42-K49 HydrophobicContact CG-CG 4.37Å; E42-L50 PolarHBondContact OE1-N 3.09Å; E42-T51 VanDerWaalsContact CD-OG1 3.32Å; E42-T51 WeakPolarHBondContact OE1-CG2 3.18Å; E42-T51 PolarHBondContact OE1-N 3.12Å; E42-T51 VanDerWaalsContact OE1-N 3.09Å; E42-T51 PolarHBondContact OE1-OG1 3.34Å; E42-T51 VanDerWaalsContact OE1-OG1 3.09Å; E42-T51 PolarHBondContact OE2-OG1 3.09Å; E42-P77 HydrophobicContact CB-CB 4.33Å; E42-P77 WeakPolarHBondContact OE2-CB 3.44Å
43	E	95.4	Very high	97.6	Very high	45 Å²	45	55.3 Å²	55.3	21%	0.21	30%	0.298	C	S	.	.			trans	-135.3	146.9	178.7	-62	-169.3	-95.7	0	0	110.1	F41 I45 L50 K62 Y63	F41-E43 HydrophobicContact CD1-CG 4.01Å; F41-E43 HydrophobicContact CE1-CG 4.43Å; F41-E43 PolarHBondContact O-N 3.27Å; E43-I45 HydrophobicContact CB-CD1 4.48Å; E43-L50 HydrophobicContact CB-CB 4.27Å; E43-L50 HydrophobicContact CB-CD2 4.38Å; E43-L50 PolarHBondContact O-N 3.38Å; E43-K62 IonicContact OE1-NZ 3.15Å; E43-K62 PolarHBondContact OE1-NZ 2.8Å; E43-K62 IonicContact OE2-NZ 3.53Å; E43-K62 PolarHBondContact OE2-NZ 3.48Å; E43-Y63 WeakPolarHBondContact OE1-CE2 3.3Å; E43-Y63 VanDerWaalsContact OE1-CZ 3.27Å; E43-Y63 PolarHBondContact OE1-OH 2.92Å
44	D	96.3	Very high	97.6	Very high	113 Å²	113	53.8 Å²	53.8	60%	0.604	29%	0.29	S	S	*	.	B	Isolated β-bridge	trans	-85.9	121.6	170.8	-173.6	-83.5	0	0	0	109.9	G46 G47	D44-G46 PolarHBondContact OD1-N 3.36Å; D44-G47 PolarHBondContact OD1-N 3.37Å; D44-G47 VanDerWaalsContact OD2-CA 3.23Å; D44-G47 WeakPolarHBondContact OD2-CA 3.39Å; D44-G47 PolarHBondContact OD2-N 3.1Å
45	I	94.9	Very high	97.6	Very high	56 Å²	56	53.1 Å²	53.1	29%	0.287	28%	0.283	S	S	.	.	S	Bend	trans	-117.7	82.8	175.4	-51.1	-64.3	0	0	0	107.9	E43 K48 L50 I53 V61 K62	E43-I45 HydrophobicContact CB-CD1 4.48Å; I45-K48 PolarHBondContact N-O 2.62Å; I45-L50 HydrophobicContact CG1-CB 4.2Å; I45-L50 HydrophobicContact CG1-CD1 4.15Å; I45-I53 HydrophobicContact CB-CD1 3.66Å; I45-I53 HydrophobicContact CG1-CD1 4.22Å; I45-I53 HydrophobicContact CG2-CD1 4.04Å; I45-V61 HydrophobicContact CG2-CG2 4.48Å; I45-K62 HydrophobicContact CD1-CB 4.49Å; I45-K62 HydrophobicContact CD1-CD 3.95Å
46	G	93.4	Very high	97.6	Very high	80 Å²	80	51.9 Å²	51.9	83%	0.825	29%	0.29	S	S	*	.	S	Bend	trans	68.1	43.7	177.7	0	0	0	0	0	113	D44	D44-G46 PolarHBondContact OD1-N 3.36Å
47	G	95.6	Very high	97.6	Very high	63 Å²	63	55.9 Å²	55.9	65%	0.649	31%	0.308	S	S	*	.	S	Bend	trans	83	7.2	179.1	0	0	0	0	0	114.9	D44	D44-G47 PolarHBondContact OD1-N 3.37Å; D44-G47 VanDerWaalsContact OD2-CA 3.23Å; D44-G47 WeakPolarHBondContact OD2-CA 3.39Å; D44-G47 PolarHBondContact OD2-N 3.1Å
48	K	97.1	Very high	97.5	Very high	122 Å²	122	58.2 Å²	58.2	53%	0.53	32%	0.318	S	S	.	.	S	Bend	trans	-121	142.1	175.9	-67.3	-176.1	-177.2	-178.4	0	110.2	I45 I53	I45-K48 PolarHBondContact N-O 2.62Å; K48-I53 HydrophobicContact CB-CD1 3.94Å; K48-I53 HydrophobicContact CB-CG1 4.05Å; K48-I53 HydrophobicContact CD-CG1 4.47Å
49	K	98.4	Very high	97.5	Very high	106 Å²	106	59.6 Å²	59.6	46%	0.461	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-68.6	134.6	174.1	-68.2	-177.2	-174.1	172.7	0	110.4	E42 T51 E52 I53	E42-K49 HydrophobicContact CG-CD 4.46Å; E42-K49 HydrophobicContact CG-CG 4.37Å; K49-T51 PolarHBondContact O-N 3.27Å; K49-E52 HydrophobicContact CB-CB 4.23Å; K49-E52 HydrophobicContact CB-CG 3.95Å; K49-E52 WeakPolarHBondContact O-CB 3.23Å; K49-E52 PolarHBondContact O-N 2.99Å; K49-E52 VanDerWaalsContact O-N 3.1Å; K49-I53 PolarHBondContact O-N 3.22Å
50	L	98.3	Very high	97.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.1	-36.7	177.6	179.9	59.3	0	0	0	111.7	V40 E42 E43 I45 E52 I53 I54 Y63	V40-L50 HydrophobicContact CG1-CD2 3.97Å; V40-L50 HydrophobicContact CG1-CG 4.13Å; E42-L50 PolarHBondContact OE1-N 3.09Å; E43-L50 HydrophobicContact CB-CB 4.27Å; E43-L50 HydrophobicContact CB-CD2 4.38Å; E43-L50 PolarHBondContact O-N 3.38Å; I45-L50 HydrophobicContact CG1-CB 4.2Å; I45-L50 HydrophobicContact CG1-CD1 4.15Å; L50-E52 PolarHBondContact O-N 3.45Å; L50-I53 PolarHBondContact O-N 3.45Å; L50-I54 HydrophobicContact CD1-CD1 4.05Å; L50-I54 HydrophobicContact CD1-CG1 4.18Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 HydrophobicContact CG-CG1 4.43Å; L50-I54 WeakPolarHBondContact O-CG1 3.4Å; L50-I54 PolarHBondContact O-N 3.36Å; L50-Y63 HydrophobicContact CD2-CD2 4.46Å; L50-Y63 HydrophobicContact CD2-CE2 4.14Å
51	T	98.6	Very high	97.4	Very high	9 Å²	9	60.6 Å²	60.6	6%	0.055	33%	0.334	C	S	.	.	H	α-helix	trans	-62.3	-41.1	175.1	56.1	0	0	0	0	113.4	V40 E42 K49 I54 N55 A75 P77	V40-T51 HydrophobicContact CB-CG2 3.69Å; V40-T51 HydrophobicContact CG1-CG2 3.88Å; V40-T51 HydrophobicContact CG2-CG2 4.36Å; E42-T51 VanDerWaalsContact CD-OG1 3.32Å; E42-T51 WeakPolarHBondContact OE1-CG2 3.18Å; E42-T51 PolarHBondContact OE1-N 3.12Å; E42-T51 VanDerWaalsContact OE1-N 3.09Å; E42-T51 PolarHBondContact OE1-OG1 3.34Å; E42-T51 VanDerWaalsContact OE1-OG1 3.09Å; E42-T51 PolarHBondContact OE2-OG1 3.09Å; K49-T51 PolarHBondContact O-N 3.27Å; T51-I54 PolarHBondContact O-N 3.29Å; T51-N55 WeakPolarHBondContact O-CB 3.1Å; T51-N55 PolarHBondContact O-N 3.01Å; T51-N55 PolarHBondContact O-ND2 3.07Å; T51-N55 VanDerWaalsContact O-ND2 3.17Å; T51-A75 HydrophobicContact CG2-CB 4.22Å; T51-P77 HydrophobicContact CG2-CB 3.94Å; T51-P77 HydrophobicContact CG2-CG 4.4Å
52	E	98.4	Very high	97.2	Very high	98 Å²	98	58.7 Å²	58.7	46%	0.458	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-42.3	175.4	-68.6	172.2	-172.8	0	0	111	K49 L50 N55 T56	K49-E52 HydrophobicContact CB-CB 4.23Å; K49-E52 HydrophobicContact CB-CG 3.95Å; K49-E52 WeakPolarHBondContact O-CB 3.23Å; K49-E52 PolarHBondContact O-N 2.99Å; K49-E52 VanDerWaalsContact O-N 3.1Å; L50-E52 PolarHBondContact O-N 3.45Å; E52-N55 PolarHBondContact O-N 3.01Å; E52-T56 WeakPolarHBondContact O-CB 3.45Å; E52-T56 VanDerWaalsContact O-CG2 3.26Å; E52-T56 WeakPolarHBondContact O-CG2 3.39Å; E52-T56 PolarHBondContact O-N 3.36Å; E52-T56 PolarHBondContact O-OG1 3.31Å
53	I	98.6	Very high	97	Very high	8 Å²	8	59.5 Å²	59.5	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-49.5	175.1	-66.9	169.7	0	0	0	110.5	I45 K48 K49 L50 N55 T56 Q57 V61	I45-I53 HydrophobicContact CB-CD1 3.66Å; I45-I53 HydrophobicContact CG1-CD1 4.22Å; I45-I53 HydrophobicContact CG2-CD1 4.04Å; K48-I53 HydrophobicContact CB-CD1 3.94Å; K48-I53 HydrophobicContact CB-CG1 4.05Å; K48-I53 HydrophobicContact CD-CG1 4.47Å; K49-I53 PolarHBondContact O-N 3.22Å; L50-I53 PolarHBondContact O-N 3.45Å; I53-N55 PolarHBondContact O-N 3.37Å; I53-T56 PolarHBondContact O-N 3.23Å; I53-T56 PolarHBondContact O-OG1 3.14Å; I53-Q57 HydrophobicContact CG2-CG 4.39Å; I53-Q57 VanDerWaalsContact O-CB 3.29Å; I53-Q57 WeakPolarHBondContact O-CB 3.17Å; I53-Q57 PolarHBondContact O-N 3.08Å; I53-V61 HydrophobicContact CG2-CG1 4.06Å; I53-V61 HydrophobicContact CG2-CG2 3.94Å
54	I	98.8	Very high	97	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-45.1	-179.2	-69.3	166.3	0	0	0	110.7	M38 V40 L50 T51 T56 H58 E59 N60 L69 A75	M38-I54 HydrophobicContact CE-CD1 4.4Å; M38-I54 HydrophobicContact CE-CG2 4.21Å; V40-I54 HydrophobicContact CG1-CD1 4.11Å; V40-I54 HydrophobicContact CG2-CD1 3.97Å; L50-I54 HydrophobicContact CD1-CD1 4.05Å; L50-I54 HydrophobicContact CD1-CG1 4.18Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 HydrophobicContact CG-CG1 4.43Å; L50-I54 WeakPolarHBondContact O-CG1 3.4Å; L50-I54 PolarHBondContact O-N 3.36Å; T51-I54 PolarHBondContact O-N 3.29Å; I54-T56 VanDerWaalsContact C-N 3.3Å; I54-T56 PolarHBondContact O-N 3.18Å; I54-H58 WeakPolarHBondContact O-CA 3.41Å; I54-H58 PolarHBondContact O-N 2.83Å; I54-E59 WeakPolarHBondContact CG1-O 3.31Å; I54-N60 HydrophobicContact CD1-CB 4.17Å; I54-N60 HydrophobicContact CG1-CB 4.24Å; I54-L69 HydrophobicContact CG2-CD1 3.96Å; I54-A75 HydrophobicContact CB-CB 3.89Å; I54-A75 HydrophobicContact CD1-CB 4.44Å; I54-A75 HydrophobicContact CG2-CB 3.7Å
55	N	98.8	Very high	97	Very high	57 Å²	57	56.2 Å²	56.2	31%	0.305	32%	0.315	S	S	.	.	H	α-helix	trans	-70.5	-23.7	-178.5	-73.5	-34.2	0	0	0	113.7	T51 E52 I53 H58 A75	T51-N55 WeakPolarHBondContact O-CB 3.1Å; T51-N55 PolarHBondContact O-N 3.01Å; T51-N55 PolarHBondContact O-ND2 3.07Å; T51-N55 VanDerWaalsContact O-ND2 3.17Å; E52-N55 PolarHBondContact O-N 3.01Å; I53-N55 PolarHBondContact O-N 3.37Å; N55-H58 PolarHBondContact O-CE1 2.86Å; N55-A75 PolarHBondContact ND2-O 3.39Å; N55-A75 PolarHBondContact OD1-N 3.07Å
56	T	98.4	Very high	97.1	Very high	103 Å²	103	56.8 Å²	56.8	63%	0.632	33%	0.334	S	S	*	.	H	α-helix	trans	-95.9	-38.1	-179.9	54.1	0	0	0	0	113.3	E52 I53 I54	E52-T56 WeakPolarHBondContact O-CB 3.45Å; E52-T56 VanDerWaalsContact O-CG2 3.26Å; E52-T56 WeakPolarHBondContact O-CG2 3.39Å; E52-T56 PolarHBondContact O-N 3.36Å; E52-T56 PolarHBondContact O-OG1 3.31Å; I53-T56 PolarHBondContact O-N 3.23Å; I53-T56 PolarHBondContact O-OG1 3.14Å; I54-T56 VanDerWaalsContact C-N 3.3Å; I54-T56 PolarHBondContact O-N 3.18Å
57	Q	98.4	Very high	97.3	Very high	83 Å²	83	54.7 Å²	54.7	39%	0.388	30%	0.303	S	S	.	.	H	α-helix	trans	-100.9	-8.9	-175.8	-56.5	-179	21	0	0	112.8	I53 E59 K68	I53-Q57 HydrophobicContact CG2-CG 4.39Å; I53-Q57 VanDerWaalsContact O-CB 3.29Å; I53-Q57 WeakPolarHBondContact O-CB 3.17Å; I53-Q57 PolarHBondContact O-N 3.08Å; Q57-E59 PolarHBondContact O-N 3.34Å; Q57-K68 PolarHBondContact O-NZ 3.06Å
58	H	98.6	Very high	97.5	Very high	58 Å²	58	57.1 Å²	57.1	27%	0.269	30%	0.296	S	S	.	.	S	Bend	trans	49.6	45	-174.6	-60.8	-63	0	0	0	111.9	I54 N55 K68 L69	I54-H58 WeakPolarHBondContact O-CA 3.41Å; I54-H58 PolarHBondContact O-N 2.83Å; N55-H58 PolarHBondContact O-CE1 2.86Å; H58-K68 CarbonylContact O-C 3.56Å; H58-K68 VanDerWaalsContact O-CA 3.31Å; H58-K68 WeakPolarHBondContact O-CA 3.42Å; H58-K68 WeakPolarHBondContact O-CD 3.23Å; H58-L69 PolarHBondContact O-N 3.35Å
59	E	98.5	Very high	97.5	Very high	30 Å²	30	51.6 Å²	51.6	14%	0.14	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-152.6	133.3	-176.6	-178.3	172.2	169.2	0	0	110.1	I54 Q57 V61 G66 K68	I54-E59 WeakPolarHBondContact CG1-O 3.31Å; Q57-E59 PolarHBondContact O-N 3.34Å; E59-V61 HydrophobicContact CB-CG1 4.35Å; E59-V61 HydrophobicContact CG-CG1 3.97Å; E59-V61 PolarHBondContact O-N 3.21Å; E59-G66 PolarHBondContact OE1-N 3.3Å; E59-K68 HydrophobicContact CB-CD 4.16Å; E59-K68 IonicContact OE2-NZ 3.2Å; E59-K68 PolarHBondContact OE2-NZ 3.39Å
60	N	97.8	Very high	97.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.			trans	-89.1	81.5	169.6	-169.4	-22.3	0	0	0	109.5	S11 S16 I54 K62 Y63 L64	S11-N60 PolarHBondContact O-ND2 3.5Å; S16-N60 PolarHBondContact OG-ND2 3.19Å; I54-N60 HydrophobicContact CD1-CB 4.17Å; I54-N60 HydrophobicContact CG1-CB 4.24Å; N60-K62 PolarHBondContact O-N 3.3Å; N60-Y63 PolarHBondContact O-N 3.3Å; N60-Y63 WeakPolarHBondContact OD1-CD2 3Å; N60-Y63 PolarHBondContact OD1-N 3.02Å; N60-L64 CarbonylContact O-C 3.59Å; N60-L64 PolarHBondContact O-N 2.99Å
61	V	96.2	Very high	97.6	Very high	46 Å²	46	52.1 Å²	52.1	28%	0.279	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-22.4	-172.6	-61.6	0	0	0	0	114.1	I45 I53 E59	I45-V61 HydrophobicContact CG2-CG2 4.48Å; I53-V61 HydrophobicContact CG2-CG1 4.06Å; I53-V61 HydrophobicContact CG2-CG2 3.94Å; E59-V61 HydrophobicContact CB-CG1 4.35Å; E59-V61 HydrophobicContact CG-CG1 3.97Å; E59-V61 PolarHBondContact O-N 3.21Å
62	K	93.7	Very high	97.6	Very high	96 Å²	96	53.4 Å²	53.4	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-47.1	178.8	-179.7	171.1	177.5	175.3	0	112.3	E43 I45 N60	E43-K62 IonicContact OE1-NZ 3.15Å; E43-K62 PolarHBondContact OE1-NZ 2.8Å; E43-K62 IonicContact OE2-NZ 3.53Å; E43-K62 PolarHBondContact OE2-NZ 3.48Å; I45-K62 HydrophobicContact CD1-CB 4.49Å; I45-K62 HydrophobicContact CD1-CD 3.95Å; N60-K62 PolarHBondContact O-N 3.3Å
63	Y	92.8	Very high	97.6	Very high	75 Å²	75	48.8 Å²	48.8	29%	0.294	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-20.4	-167.6	-63.9	-70.1	0	0	0	114.6	N13 E43 L50 N60	N13-Y63 WeakPolarHBondContact CA-O 3.09Å; N13-Y63 WeakPolarHBondContact CB-O 3.46Å; N13-Y63 PolarHBondContact ND2-O 3.34Å; E43-Y63 WeakPolarHBondContact OE1-CE2 3.3Å; E43-Y63 VanDerWaalsContact OE1-CZ 3.27Å; E43-Y63 PolarHBondContact OE1-OH 2.92Å; L50-Y63 HydrophobicContact CD2-CD2 4.46Å; L50-Y63 HydrophobicContact CD2-CE2 4.14Å; N60-Y63 PolarHBondContact O-N 3.3Å; N60-Y63 WeakPolarHBondContact OD1-CD2 3Å; N60-Y63 PolarHBondContact OD1-N 3.02Å
64	L	95.5	Very high	97.6	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	28%	0.282	C	S	.	.	S	Bend	trans	-144.1	61.7	175.3	-166.6	69.6	0	0	0	110.4	A17 K20 N60 H67 A157	A17-L64 HydrophobicContact CB-CD2 4.44Å; K20-L64 HydrophobicContact CD-CD2 3.99Å; N60-L64 CarbonylContact O-C 3.59Å; N60-L64 PolarHBondContact O-N 2.99Å; L64-H67 HydrophobicContact CD2-CB 3.89Å; L64-H67 HydrophobicContact CG-CB 3.93Å; L64-H67 PolarHBondContact O-N 3.48Å; L64-A157 HydrophobicContact CD1-CB 3.86Å; L64-A157 HydrophobicContact CD2-CB 3.94Å; L64-A157 HydrophobicContact CG-CB 4.36Å
65	P	95.7	Very high	97.6	Very high	84 Å²	84	50.5 Å²	50.5	55%	0.545	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	141.6	-176.6	27.1	-35.2	0	0	0	111.6	H67	P65-H67 VanDerWaalsContact C-N 3.32Å; P65-H67 PolarHBondContact O-CD2 2.9Å
66	G	97.3	Very high	97.6	Very high	68 Å²	68	48.6 Å²	48.6	70%	0.701	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-4	178.1	0	0	0	0	0	114.8	E59	E59-G66 PolarHBondContact OE1-N 3.3Å
67	H	98.3	Very high	97.6	Very high	37 Å²	37	46.6 Å²	46.6	17%	0.171	26%	0.262	C	S	.	.			trans	-115.1	124.2	178.3	-59.4	-93.8	0	0	0	111.9	K20 L64 P65 A157 D158	K20-H67 HydrophobicContact CD-CB 4.13Å; L64-H67 HydrophobicContact CD2-CB 3.89Å; L64-H67 HydrophobicContact CG-CB 3.93Å; L64-H67 PolarHBondContact O-N 3.48Å; P65-H67 VanDerWaalsContact C-N 3.32Å; P65-H67 PolarHBondContact O-CD2 2.9Å; H67-A157 PolarHBondContact ND1-O 3.22Å; H67-D158 IonicContact CE1-OD1 3.1Å; H67-D158 PolarHBondContact CE1-OD1 2.91Å; H67-D158 VanDerWaalsContact CE1-OD1 3.22Å; H67-D158 IonicContact NE2-OD1 2.57Å
68	K	98.4	Very high	97.6	Very high	113 Å²	113	45.8 Å²	45.8	49%	0.491	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-73.6	134	171.2	-62.7	-53.8	-173.2	-171.1	0	111.9	K20 Q57 H58 E59	K20-K68 PolarHBondContact NZ-O 3.08Å; Q57-K68 PolarHBondContact O-NZ 3.06Å; H58-K68 CarbonylContact O-C 3.56Å; H58-K68 VanDerWaalsContact O-CA 3.31Å; H58-K68 WeakPolarHBondContact O-CA 3.42Å; H58-K68 WeakPolarHBondContact O-CD 3.23Å; E59-K68 HydrophobicContact CB-CD 4.16Å; E59-K68 IonicContact OE2-NZ 3.2Å; E59-K68 PolarHBondContact OE2-NZ 3.39Å
69	L	98.8	Very high	97.7	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.031	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-82.4	147.3	165.2	-58	-175.1	0	0	0	109.1	S16 A19 K20 M38 I54 H58	S16-L69 VanDerWaalsContact O-CD2 3.3Å; S16-L69 WeakPolarHBondContact O-CD2 3.27Å; A19-L69 HydrophobicContact CB-CD2 4.27Å; K20-L69 HydrophobicContact CG-CD2 3.8Å; M38-L69 HydrophobicContact CE-CD1 3.81Å; I54-L69 HydrophobicContact CG2-CD1 3.96Å; H58-L69 PolarHBondContact O-N 3.35Å
70	P	98.8	Very high	97.7	Very high	21 Å²	21	43.4 Å²	43.4	14%	0.136	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-57.8	137.1	172.9	-26.3	35.3	0	0	0	111.3	K20 N72 V73	K20-P70 WeakPolarHBondContact O-CG 3.32Å; P70-N72 WeakPolarHBondContact CB-OD1 3.47Å; P70-N72 PolarHBondContact O-N 2.87Å; P70-N72 VanDerWaalsContact O-N 3.1Å; P70-V73 HydrophobicContact CB-CG2 4.19Å; P70-V73 HydrophobicContact CG-CG2 4.44Å; P70-V73 WeakPolarHBondContact O-CB 3.17Å; P70-V73 PolarHBondContact O-N 3.36Å
71	P	98.6	Very high	97.7	Very high	96 Å²	96	50 Å²	50	62%	0.623	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.5	-174.9	12.9	-18.7	0	0	0	114.5	V73	P71-V73 VanDerWaalsContact C-N 3.28Å
72	N	98.9	Very high	97.8	Very high	36 Å²	36	48 Å²	48	19%	0.193	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-4.6	174	65.4	-58.1	0	0	0	113.8	G23 P34 V36 P70	G23-N72 PolarHBondContact O-ND2 2.96Å; P34-N72 VanDerWaalsContact O-CB 3.27Å; P34-N72 WeakPolarHBondContact O-CB 3.43Å; P34-N72 PolarHBondContact O-ND2 2.9Å; V36-N72 PolarHBondContact N-O 3.3Å; V36-N72 VanDerWaalsContact N-O 3.08Å; P70-N72 WeakPolarHBondContact CB-OD1 3.47Å; P70-N72 PolarHBondContact O-N 2.87Å; P70-N72 VanDerWaalsContact O-N 3.1Å
73	V	98.9	Very high	98.1	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.012	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	119.7	169.1	-179.6	0	0	0	0	109.2	A19 V36 M38 P70 P71	A19-V73 HydrophobicContact CB-CG1 4.14Å; A19-V73 HydrophobicContact CB-CG2 4.43Å; V36-V73 HydrophobicContact CB-CG2 4.31Å; V36-V73 CarbonylContact O-C 3.55Å; V36-V73 WeakPolarHBondContact O-CA 3.17Å; M38-V73 HydrophobicContact CB-CG1 3.88Å; M38-V73 HydrophobicContact CE-CG1 4.3Å; M38-V73 HydrophobicContact SD-CG1 4.47Å; P70-V73 HydrophobicContact CB-CG2 4.19Å; P70-V73 HydrophobicContact CG-CG2 4.44Å; P70-V73 WeakPolarHBondContact O-CB 3.17Å; P70-V73 PolarHBondContact O-N 3.36Å; P71-V73 VanDerWaalsContact C-N 3.28Å
74	V	98.9	Very high	98.2	Very high	42 Å²	42	41.7 Å²	41.7	26%	0.255	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.6	-176.3	-176.2	0	0	0	0	110	R35 V36 M38 V76	R35-V74 HydrophobicContact CG-CG2 4.42Å; V36-V74 PolarHBondContact O-N 3.28Å; M38-V74 PolarHBondContact N-O 2.76Å; V74-V76 HydrophobicContact CG1-CG2 4.25Å
75	A	98.9	Very high	98.3	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.033	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.5	172.9	0	0	0	0	0	110.8	M38 V40 T51 I54 N55	M38-A75 WeakPolarHBondContact O-CA 3.29Å; V40-A75 HydrophobicContact CG2-CB 3.63Å; T51-A75 HydrophobicContact CG2-CB 4.22Å; I54-A75 HydrophobicContact CB-CB 3.89Å; I54-A75 HydrophobicContact CD1-CB 4.44Å; I54-A75 HydrophobicContact CG2-CB 3.7Å; N55-A75 PolarHBondContact ND2-O 3.39Å; N55-A75 PolarHBondContact OD1-N 3.07Å
76	V	98.9	Very high	98.4	Very high	16 Å²	16	41.9 Å²	41.9	10%	0.097	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.7	-179.2	-176.1	0	0	0	0	109	T37 M38 W39 V40 V74 D78 Q81 A82	T37-V76 HydrophobicContact CG2-CG2 4.25Å; M38-V76 PolarHBondContact O-N 3.14Å; W39-V76 WeakPolarHBondContact CA-O 3.45Å; V40-V76 PolarHBondContact N-O 2.78Å; V74-V76 HydrophobicContact CG1-CG2 4.25Å; V76-D78 WeakPolarHBondContact CG1-O 3.47Å; V76-Q81 HydrophobicContact CG1-CB 4.08Å; V76-A82 HydrophobicContact CB-CB 3.93Å; V76-A82 HydrophobicContact CG1-CB 4.06Å
77	P	98.5	Very high	98.5	Very high	61 Å²	61	39.4 Å²	39.4	40%	0.396	22%	0.219	S	C	.	.	S	Bend	trans	-78.5	-26.5	-175.3	29	-33.8	0	0	0	113.8	W39 V40 E42 T51	W39-P77 PolarHBondContact NE1-O 3.06Å; V40-P77 WeakPolarHBondContact O-CA 3.44Å; E42-P77 HydrophobicContact CB-CB 4.33Å; E42-P77 WeakPolarHBondContact OE2-CB 3.44Å; T51-P77 HydrophobicContact CG2-CB 3.94Å; T51-P77 HydrophobicContact CG2-CG 4.4Å
78	D	98.7	Very high	98.5	Very high	67 Å²	67	37.7 Å²	37.7	36%	0.358	21%	0.211	S	C	.	.			trans	-93.5	122.2	178.5	-177.4	-88.5	0	0	0	110.8	V76 V80 Q81 A82	V76-D78 WeakPolarHBondContact CG1-O 3.47Å; D78-V80 VanDerWaalsContact C-N 3.33Å; D78-V80 PolarHBondContact O-N 3.49Å; D78-V80 WeakPolarHBondContact OD1-CA 3.45Å; D78-V80 WeakPolarHBondContact OD1-CB 3.46Å; D78-V80 PolarHBondContact OD1-N 3.41Å; D78-Q81 HydrophobicContact CB-CB 4.08Å; D78-Q81 HydrophobicContact CB-CG 4.06Å; D78-Q81 PolarHBondContact O-N 3.18Å; D78-Q81 WeakPolarHBondContact OD1-CG 3.48Å; D78-Q81 PolarHBondContact OD1-N 3.04Å; D78-A82 WeakPolarHBondContact O-CB 3.49Å; D78-A82 PolarHBondContact O-N 3.38Å
79	V	98.8	Very high	98.6	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-70.2	-31.2	-173.6	75	0	0	0	0	112.6	V9 W39 A82 A83 I101 Q104 L105	V9-V79 HydrophobicContact CG1-CG2 3.95Å; W39-V79 HydrophobicContact CB-CG2 4.14Å; W39-V79 VanDerWaalsContact CD1-CA 3.43Å; W39-V79 HydrophobicContact CD2-CB 3.89Å; W39-V79 HydrophobicContact CD2-CG2 3.66Å; W39-V79 HydrophobicContact CE3-CG2 4.11Å; W39-V79 HydrophobicContact CG-CB 3.79Å; W39-V79 HydrophobicContact CG-CG2 3.65Å; W39-V79 HydrophobicContact CZ2-CB 4.49Å; V79-A82 PolarHBondContact O-N 3.14Å; V79-A83 WeakPolarHBondContact O-CB 3.42Å; V79-A83 PolarHBondContact O-N 3.36Å; V79-A83 VanDerWaalsContact O-N 3.09Å; V79-I101 HydrophobicContact CG2-CG2 3.99Å; V79-Q104 HydrophobicContact CG1-CB 3.75Å; V79-L105 HydrophobicContact CG1-CD2 4.2Å; V79-L105 HydrophobicContact CG1-CG 4.32Å; V79-L105 HydrophobicContact CG2-CD1 4.28Å; V79-L105 HydrophobicContact CG2-CD2 4.04Å; V79-L105 HydrophobicContact CG2-CG 4.21Å; V79-L105 WeakPolarHBondContact O-CD2 3.16Å
80	V	98.8	Very high	98.6	Very high	36 Å²	36	32 Å²	32	22%	0.218	19%	0.186	C	C	.	.	H	α-helix	trans	-69.7	-47	178.8	175.2	0	0	0	0	109.4	D78 A82 A83 A84 Q104 H108	D78-V80 VanDerWaalsContact C-N 3.33Å; D78-V80 PolarHBondContact O-N 3.49Å; D78-V80 WeakPolarHBondContact OD1-CA 3.45Å; D78-V80 WeakPolarHBondContact OD1-CB 3.46Å; D78-V80 PolarHBondContact OD1-N 3.41Å; V80-A82 VanDerWaalsContact C-N 3.32Å; V80-A82 PolarHBondContact O-N 3.48Å; V80-A83 PolarHBondContact O-N 3.1Å; V80-A84 WeakPolarHBondContact O-CA 3.48Å; V80-A84 WeakPolarHBondContact O-CB 3.31Å; V80-A84 PolarHBondContact O-N 3.19Å; V80-Q104 HydrophobicContact CG2-CB 4.42Å; V80-Q104 VanDerWaalsContact CG2-O 3.31Å; V80-Q104 WeakPolarHBondContact CG2-O 3.48Å; V80-H108 HydrophobicContact CG1-CB 3.68Å
81	Q	98.6	Very high	98.6	Very high	139 Å²	139	31 Å²	31	65%	0.65	18%	0.18	S	C	*	.	H	α-helix	trans	-62.2	-38.5	174.7	-68.9	177.1	19.8	0	0	112.3	V76 D78 A83	V76-Q81 HydrophobicContact CG1-CB 4.08Å; D78-Q81 HydrophobicContact CB-CB 4.08Å; D78-Q81 HydrophobicContact CB-CG 4.06Å; D78-Q81 PolarHBondContact O-N 3.18Å; D78-Q81 WeakPolarHBondContact OD1-CG 3.48Å; D78-Q81 PolarHBondContact OD1-N 3.04Å; Q81-A83 VanDerWaalsContact C-N 3.3Å; Q81-A83 PolarHBondContact O-N 3.43Å
82	A	98.8	Very high	98.5	Very high	3 Å²	3	26.9 Å²	26.9	3%	0.025	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-40.5	176.8	0	0	0	0	0	111.7	C7 T37 W39 V76 D78 V79 V80	C7-A82 WeakPolarHBondContact CB-O 3.41Å; C7-A82 VanDerWaalsContact SG-C 3.57Å; C7-A82 PolarHBondContact SG-O 3.3Å; C7-A82 VanDerWaalsContact SG-O 3.37Å; T37-A82 WeakPolarHBondContact CB-O 3.46Å; T37-A82 PolarHBondContact OG1-O 3.42Å; W39-A82 HydrophobicContact CB-CB 3.95Å; V76-A82 HydrophobicContact CB-CB 3.93Å; V76-A82 HydrophobicContact CG1-CB 4.06Å; D78-A82 WeakPolarHBondContact O-CB 3.49Å; D78-A82 PolarHBondContact O-N 3.38Å; V79-A82 PolarHBondContact O-N 3.14Å; V80-A82 VanDerWaalsContact C-N 3.32Å; V80-A82 PolarHBondContact O-N 3.48Å
83	A	98.6	Very high	98.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-94.8	-17.1	-172.2	0	0	0	0	0	115.2	V79 V80 Q81 D85 A86 L89 L105 L109	V79-A83 WeakPolarHBondContact O-CB 3.42Å; V79-A83 PolarHBondContact O-N 3.36Å; V79-A83 VanDerWaalsContact O-N 3.09Å; V80-A83 PolarHBondContact O-N 3.1Å; Q81-A83 VanDerWaalsContact C-N 3.3Å; Q81-A83 PolarHBondContact O-N 3.43Å; A83-D85 VanDerWaalsContact C-N 3.28Å; A83-D85 PolarHBondContact O-N 3.06Å; A83-A86 WeakPolarHBondContact O-CB 3.05Å; A83-A86 PolarHBondContact O-N 2.98Å; A83-L89 HydrophobicContact CB-CD2 3.84Å; A83-L105 HydrophobicContact CB-CD2 3.51Å; A83-L109 HydrophobicContact CB-CD2 4.21Å
84	A	96.1	Very high	97.7	Very high	40 Å²	40	28.9 Å²	28.9	33%	0.331	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-42.6	-166	0	0	0	0	0	114.7	V80	V80-A84 WeakPolarHBondContact O-CA 3.48Å; V80-A84 WeakPolarHBondContact O-CB 3.31Å; V80-A84 PolarHBondContact O-N 3.19Å
85	D	97.3	Very high	97	Very high	90 Å²	90	28.2 Å²	28.2	48%	0.481	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-1.8	-176.4	-74.7	-18.2	0	0	0	114.2	K5 A83	K5-D85 HydrophobicContact CD-CB 3.68Å; K5-D85 WeakPolarHBondContact CD-O 3.39Å; K5-D85 IonicContact NZ-OD2 2.98Å; K5-D85 PolarHBondContact NZ-OD2 3.4Å; A83-D85 VanDerWaalsContact C-N 3.28Å; A83-D85 PolarHBondContact O-N 3.06Å
86	A	98.7	Very high	96.3	Very high	2 Å²	2	32 Å²	32	2%	0.017	18%	0.179	C	C	.	.			trans	-73.3	132.1	-168.1	0	0	0	0	0	112.1	C7 A83 L89 T113	C7-A86 HydrophobicContact CB-CB 3.64Å; A83-A86 WeakPolarHBondContact O-CB 3.05Å; A83-A86 PolarHBondContact O-N 2.98Å; A86-L89 HydrophobicContact CB-CD2 3.61Å; A86-T113 PolarHBondContact O-OG1 3.31Å
87	D	98.8	Very high	95.9	Very high	15 Å²	15	36.3 Å²	36.3	8%	0.08	20%	0.196	C	C	.	.	S	Bend	trans	-80.7	-30.3	167.6	-62.7	-84	0	0	0	111.2	K4 K5 K110 T113 I114	K4-D87 HydrophobicContact CB-CB 4.18Å; K4-D87 HydrophobicContact CD-CB 3.7Å; K4-D87 IonicContact NZ-OD1 3.97Å; K5-D87 PolarHBondContact N-OD2 3.25Å; K5-D87 PolarHBondContact O-N 3.31Å; D87-K110 IonicContact OD1-NZ 3.44Å; D87-K110 PolarHBondContact OD1-NZ 2.9Å; D87-K110 IonicContact OD2-NZ 3.75Å; D87-K110 PolarHBondContact OD2-NZ 3.1Å; D87-T113 WeakPolarHBondContact O-CA 3.06Å; D87-I114 WeakPolarHBondContact O-CG1 3.29Å; D87-I114 PolarHBondContact O-N 2.99Å
88	I	98.9	Very high	95.7	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.9	-177.3	-52.8	177.8	0	0	0	109.3	K4 K5 V6 C7 F32 I90 I114 L176 L177 L180	K4-I88 HydrophobicContact CB-CD1 4.21Å; K5-I88 PolarHBondContact O-N 2.91Å; V6-I88 WeakPolarHBondContact CA-O 3.48Å; V6-I88 HydrophobicContact CG2-CB 4.33Å; V6-I88 HydrophobicContact CG2-CD1 4.4Å; C7-I88 PolarHBondContact N-O 3.25Å; F32-I88 HydrophobicContact CD1-CD1 4.39Å; F32-I88 HydrophobicContact CE1-CD1 3.86Å; I88-I90 HydrophobicContact CG2-CG1 4.47Å; I88-I114 WeakPolarHBondContact CA-O 3.23Å; I88-I114 HydrophobicContact CB-CG1 4.47Å; I88-I114 HydrophobicContact CG1-CD1 4.09Å; I88-I114 HydrophobicContact CG1-CG1 3.99Å; I88-L176 HydrophobicContact CD1-CD2 4.01Å; I88-L176 HydrophobicContact CD1-CG 4.36Å; I88-L177 HydrophobicContact CG2-CD2 3.96Å; I88-L180 HydrophobicContact CD1-CD2 4.11Å; I88-L180 HydrophobicContact CG2-CD2 4.18Å
89	L	98.9	Very high	95.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.6	172.8	-61.2	-179.5	0	0	0	110.7	C7 V9 A83 A86 F91 L109 T113 I114 G115 M116 I142	C7-L89 HydrophobicContact CB-CD2 3.71Å; C7-L89 WeakPolarHBondContact O-CA 3.37Å; V9-L89 HydrophobicContact CG2-CD2 4.38Å; A83-L89 HydrophobicContact CB-CD2 3.84Å; A86-L89 HydrophobicContact CB-CD2 3.61Å; L89-F91 HydrophobicContact CB-CD2 4.3Å; L89-F91 HydrophobicContact CB-CE2 3.59Å; L89-F91 HydrophobicContact CB-CZ 3.83Å; L89-F91 HydrophobicContact CD1-CE2 4.22Å; L89-F91 HydrophobicContact CD1-CZ 3.71Å; L89-F91 HydrophobicContact CG-CZ 4.42Å; L89-L109 HydrophobicContact CD1-CD1 3.89Å; L89-L109 HydrophobicContact CD1-CD2 3.79Å; L89-L109 HydrophobicContact CD1-CG 4.49Å; L89-T113 HydrophobicContact CD1-CG2 3.77Å; L89-T113 HydrophobicContact CG-CG2 3.67Å; L89-I114 PolarHBondContact N-O 3.39Å; L89-G115 CarbonylContact O-C 3.49Å; L89-G115 VanDerWaalsContact O-CA 3.32Å; L89-G115 WeakPolarHBondContact O-CA 3.17Å; L89-M116 PolarHBondContact O-N 3.47Å; L89-I142 HydrophobicContact CD1-CD1 4.26Å
90	I	98.9	Very high	95.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	107.6	173.9	-57.6	176.3	0	0	0	108.3	V6 C7 I8 V9 I18 V22 I88 M116 L118 L180 M181	V6-I90 HydrophobicContact CG1-CD1 3.94Å; V6-I90 HydrophobicContact CG1-CG1 4.36Å; C7-I90 PolarHBondContact O-N 3.34Å; I8-I90 HydrophobicContact CG1-CD1 4.41Å; V9-I90 PolarHBondContact N-O 2.9Å; I18-I90 HydrophobicContact CG2-CG2 4.26Å; V22-I90 HydrophobicContact CG1-CD1 4.26Å; V22-I90 HydrophobicContact CG2-CD1 3.65Å; I88-I90 HydrophobicContact CG2-CG1 4.47Å; I90-M116 CarbonylContact C-O 3.5Å; I90-M116 WeakPolarHBondContact CA-O 3.18Å; I90-M116 HydrophobicContact CD1-CE 4.35Å; I90-M116 HydrophobicContact CG1-CE 4.16Å; I90-L118 HydrophobicContact CG2-CD1 3.83Å; I90-L118 HydrophobicContact CG2-CD2 4.06Å; I90-L180 HydrophobicContact CD1-CD2 4.16Å; I90-M181 HydrophobicContact CD1-SD 4.06Å
91	F	98.8	Very high	95.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	114.3	-179.8	-62.3	-87.8	0	0	0	110.4	V9 L89 I98 L105 M116 L118 I119 I136 L140 I142 M144	V9-F91 HydrophobicContact CB-CD1 3.98Å; V9-F91 HydrophobicContact CB-CE1 4.37Å; V9-F91 HydrophobicContact CG1-CD1 4.07Å; V9-F91 HydrophobicContact CG1-CE1 4.37Å; V9-F91 HydrophobicContact CG2-CD1 4.28Å; V9-F91 HydrophobicContact CG2-CE1 4.21Å; L89-F91 HydrophobicContact CB-CD2 4.3Å; L89-F91 HydrophobicContact CB-CE2 3.59Å; L89-F91 HydrophobicContact CB-CZ 3.83Å; L89-F91 HydrophobicContact CD1-CE2 4.22Å; L89-F91 HydrophobicContact CD1-CZ 3.71Å; L89-F91 HydrophobicContact CG-CZ 4.42Å; F91-I98 HydrophobicContact CB-CD1 4.44Å; F91-I98 HydrophobicContact CD1-CD1 3.85Å; F91-I98 HydrophobicContact CG-CD1 4.46Å; F91-L105 HydrophobicContact CE1-CD1 3.95Å; F91-M116 PolarHBondContact N-O 3.16Å; F91-L118 PolarHBondContact O-N 3.12Å; F91-I119 HydrophobicContact CB-CD1 4.21Å; F91-I136 HydrophobicContact CB-CD1 4.05Å; F91-I136 HydrophobicContact CD1-CD1 4.41Å; F91-I136 HydrophobicContact CD2-CD1 4.24Å; F91-I136 HydrophobicContact CD2-CG2 4.07Å; F91-I136 HydrophobicContact CE1-CG2 4.16Å; F91-I136 HydrophobicContact CE2-CG2 3.67Å; F91-I136 HydrophobicContact CG-CD1 3.98Å; F91-I136 HydrophobicContact CG-CG2 4.47Å; F91-I136 HydrophobicContact CZ-CG2 3.72Å; F91-L140 HydrophobicContact CE1-CD1 4.02Å; F91-L140 HydrophobicContact CZ-CD1 3.59Å; F91-I142 HydrophobicContact CE2-CD1 4.19Å; F91-I142 HydrophobicContact CZ-CD1 4.34Å; F91-M144 HydrophobicContact CD2-CE 4.04Å; F91-M144 HydrophobicContact CE2-CE 4.3Å; F91-M144 HydrophobicContact CE2-SD 4.29Å
92	V	97.6	Very high	95.3	Very high	10 Å²	10	33.1 Å²	33.1	6%	0.061	17%	0.166	C	C	.	.			trans	-144	60.1	-172.6	61.1	0	0	0	0	111.6	I8 V9 W14 L118	I8-V92 HydrophobicContact CG2-CG1 3.54Å; V9-V92 PolarHBondContact O-N 3.09Å; W14-V92 HydrophobicContact CB-CG2 4.19Å; W14-V92 VanDerWaalsContact CD1-CG2 3.41Å; W14-V92 HydrophobicContact CG-CG2 4Å; V92-L118 HydrophobicContact CB-CB 4.18Å; V92-L118 HydrophobicContact CB-CD2 4.47Å; V92-L118 HydrophobicContact CG2-CB 4.11Å; V92-L118 HydrophobicContact CG2-CD2 4.32Å
93	V	93.7	Very high	95.2	Very high	15 Å²	15	37.3 Å²	37.3	9%	0.091	19%	0.188	C	C	.	.	S	Bend	trans	-121.1	159.7	-179.9	-66	0	0	0	0	110.6	V9 W39 H95 I98 I101 I119	V9-V93 WeakPolarHBondContact O-CG1 3.44Å; W39-V93 HydrophobicContact CE3-CG1 4.33Å; W39-V93 HydrophobicContact CZ3-CG1 3.8Å; V93-H95 PolarHBondContact O-N 3.37Å; V93-I98 HydrophobicContact CG2-CB 4.4Å; V93-I98 HydrophobicContact CG2-CD1 3.93Å; V93-I101 HydrophobicContact CB-CD1 4.19Å; V93-I101 HydrophobicContact CG1-CD1 3.92Å; V93-I101 HydrophobicContact CG2-CD1 3.82Å; V93-I119 HydrophobicContact CG2-CD1 3.66Å; V93-I119 WeakPolarHBondContact O-CG1 3.47Å
94	P	87	Confident	95.2	Very high	65 Å²	65	41.4 Å²	41.4	42%	0.422	21%	0.207	S	C	.	.			trans	-54.6	135.7	165.7	-23	32.8	0	0	0	110.9	Q96 F97	P94-Q96 HydrophobicContact CB-CG 4.33Å; P94-Q96 PolarHBondContact O-N 2.66Å; P94-F97 HydrophobicContact CB-CD2 3.71Å; P94-F97 HydrophobicContact CB-CE2 3.88Å; P94-F97 HydrophobicContact CG-CD2 3.87Å; P94-F97 HydrophobicContact CG-CE2 3.89Å; P94-F97 PolarHBondContact O-N 2.9Å; P94-F97 VanDerWaalsContact O-N 3.07Å
95	H	84.9	Confident	95.3	Very high	27 Å²	27	39.5 Å²	39.5	13%	0.125	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-55	-36.2	-169.4	75	-119.6	0	0	0	112.4	V93 F97 I98 I119 I132 Q298 E301	V93-H95 PolarHBondContact O-N 3.37Å; H95-F97 PolarHBondContact O-N 3.36Å; H95-I98 WeakPolarHBondContact O-CG2 3.37Å; H95-I98 PolarHBondContact O-N 3.17Å; H95-I119 HydrophobicContact CB-CG2 3.63Å; H95-I132 HydrophobicContact CB-CD1 4.21Å; H95-Q298 PolarHBondContact CE1-OE1 2.76Å; H95-Q298 PolarHBondContact ND1-OE1 3.2Å; H95-E301 IonicContact CE1-OE2 2.7Å; H95-E301 IonicContact NE2-OE2 2.73Å
96	Q	82.8	Confident	95.3	Very high	84 Å²	84	41.5 Å²	41.5	39%	0.393	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-60.1	-20.3	-176.4	67.7	-158	19.8	0	0	114	P94	P94-Q96 HydrophobicContact CB-CG 4.33Å; P94-Q96 PolarHBondContact O-N 2.66Å
97	F	90.1	Very high	95.2	Very high	106 Å²	106	45.1 Å²	45.1	47%	0.465	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-95.4	-13.6	-179.5	-57.3	-57.2	0	0	0	113.6	P94 H95 R99 K100 I101	P94-F97 HydrophobicContact CB-CD2 3.71Å; P94-F97 HydrophobicContact CB-CE2 3.88Å; P94-F97 HydrophobicContact CG-CD2 3.87Å; P94-F97 HydrophobicContact CG-CE2 3.89Å; P94-F97 PolarHBondContact O-N 2.9Å; P94-F97 VanDerWaalsContact O-N 3.07Å; H95-F97 PolarHBondContact O-N 3.36Å; F97-R99 PolarHBondContact O-N 2.97Å; F97-K100 PolarHBondContact O-N 3.43Å; F97-I101 HydrophobicContact CB-CD1 4.01Å; F97-I101 WeakPolarHBondContact O-CD1 3.45Å; F97-I101 WeakPolarHBondContact O-CG1 3.36Å; F97-I101 PolarHBondContact O-N 3.03Å
98	I	94.5	Very high	95.2	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-39.6	-167.2	-166.1	54.1	0	0	0	112.9	F91 V93 H95 K100 I101 C102 I119 I132 I136	F91-I98 HydrophobicContact CB-CD1 4.44Å; F91-I98 HydrophobicContact CD1-CD1 3.85Å; F91-I98 HydrophobicContact CG-CD1 4.46Å; V93-I98 HydrophobicContact CG2-CB 4.4Å; V93-I98 HydrophobicContact CG2-CD1 3.93Å; H95-I98 WeakPolarHBondContact O-CG2 3.37Å; H95-I98 PolarHBondContact O-N 3.17Å; I98-K100 PolarHBondContact O-N 3.24Å; I98-I101 PolarHBondContact O-N 2.7Å; I98-C102 PolarHBondContact O-N 3.02Å; I98-C102 PolarHBondContact O-SG 2.77Å; I98-C102 VanDerWaalsContact O-SG 3.33Å; I98-I119 HydrophobicContact CB-CD1 4.18Å; I98-I119 HydrophobicContact CD1-CD1 3.72Å; I98-I119 HydrophobicContact CG1-CD1 3.87Å; I98-I132 HydrophobicContact CG1-CG2 4.4Å; I98-I132 HydrophobicContact CG2-CG2 4.37Å; I98-I136 HydrophobicContact CD1-CD1 3.87Å; I98-I136 HydrophobicContact CD1-CG1 3.96Å; I98-I136 HydrophobicContact CG1-CD1 3.8Å; I98-I136 HydrophobicContact CG1-CG1 3.61Å
99	R	94.3	Very high	95.1	Very high	88 Å²	88	51.1 Å²	51.1	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-47.3	-178.3	-69.4	-179.7	171.1	-119.6	-1.2	111.8	F97 I101 C102 D103 D123 V135	F97-R99 PolarHBondContact O-N 2.97Å; R99-I101 VanDerWaalsContact C-N 3.3Å; R99-I101 PolarHBondContact O-N 3.4Å; R99-C102 PolarHBondContact O-N 3.21Å; R99-D103 PolarHBondContact O-N 2.73Å; R99-D123 IonicContact CZ-OD1 2.8Å; R99-D123 IonicContact CZ-OD2 3.79Å; R99-D123 IonicContact NE-OD1 3.17Å; R99-D123 IonicContact NE-OD2 3.84Å; R99-D123 PolarHBondContact NE-OD2 3.17Å; R99-D123 IonicContact NH2-OD1 2.66Å; R99-D123 PolarHBondContact NH2-OD1 3.22Å; R99-D123 IonicContact NH2-OD2 2.76Å; R99-D123 PolarHBondContact NH2-OD2 3.02Å; R99-V135 HydrophobicContact CG-CG1 4.24Å
100	K	95.9	Very high	95	Very high	143 Å²	143	55.3 Å²	55.3	62%	0.622	28%	0.28	S	S	*	.	H	α-helix	trans	-62.8	-37.4	177.8	-176.1	179.2	178.4	-178.2	0	111.9	F97 I98 D103 Q104	F97-K100 PolarHBondContact O-N 3.43Å; I98-K100 PolarHBondContact O-N 3.24Å; K100-D103 PolarHBondContact O-N 2.73Å; K100-Q104 PolarHBondContact O-N 2.97Å
101	I	98	Very high	94.9	Very high	5 Å²	5	59 Å²	59	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-45.5	176.6	-67	158.4	0	0	0	110.6	V9 W39 V79 V93 F97 I98 R99 D103 Q104 L105	V9-I101 HydrophobicContact CG1-CG2 3.72Å; W39-I101 HydrophobicContact CE3-CD1 4.38Å; W39-I101 HydrophobicContact CH2-CD1 3.55Å; W39-I101 HydrophobicContact CH2-CG1 3.62Å; W39-I101 HydrophobicContact CZ2-CG1 4.49Å; W39-I101 HydrophobicContact CZ3-CD1 3.32Å; W39-I101 HydrophobicContact CZ3-CG1 3.77Å; V79-I101 HydrophobicContact CG2-CG2 3.99Å; V93-I101 HydrophobicContact CB-CD1 4.19Å; V93-I101 HydrophobicContact CG1-CD1 3.92Å; V93-I101 HydrophobicContact CG2-CD1 3.82Å; F97-I101 HydrophobicContact CB-CD1 4.01Å; F97-I101 WeakPolarHBondContact O-CD1 3.45Å; F97-I101 WeakPolarHBondContact O-CG1 3.36Å; F97-I101 PolarHBondContact O-N 3.03Å; I98-I101 PolarHBondContact O-N 2.7Å; R99-I101 VanDerWaalsContact C-N 3.3Å; R99-I101 PolarHBondContact O-N 3.4Å; I101-D103 PolarHBondContact O-N 2.81Å; I101-Q104 PolarHBondContact O-N 3.4Å; I101-Q104 VanDerWaalsContact O-N 3.17Å; I101-L105 HydrophobicContact CG2-CD1 3.92Å; I101-L105 HydrophobicContact CG2-CG 4.44Å; I101-L105 WeakPolarHBondContact O-CG 3.5Å; I101-L105 PolarHBondContact O-N 3.07Å
102	C	98.3	Very high	94.7	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.6	-38.2	174.6	-69.7	0	0	0	0	111.8	I98 R99 Q104 L105 K106 R139 L140	I98-C102 PolarHBondContact O-N 3.02Å; I98-C102 PolarHBondContact O-SG 2.77Å; I98-C102 VanDerWaalsContact O-SG 3.33Å; R99-C102 PolarHBondContact O-N 3.21Å; C102-Q104 VanDerWaalsContact C-N 3.3Å; C102-Q104 PolarHBondContact O-N 2.88Å; C102-L105 PolarHBondContact O-N 3.01Å; C102-K106 WeakPolarHBondContact O-CB 3.13Å; C102-K106 PolarHBondContact O-N 3.06Å; C102-R139 HydrophobicContact CB-CB 4.03Å; C102-L140 HydrophobicContact CB-CD2 4.19Å; C102-L140 HydrophobicContact CB-CG 4.37Å; C102-L140 WeakPolarHBondContact O-CD2 3.38Å
103	D	97.8	Very high	94.8	Very high	92 Å²	92	66 Å²	66	49%	0.492	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-35.6	178.2	-66.7	-24.3	0	0	0	112.6	R99 K100 I101 R139	R99-D103 PolarHBondContact O-N 2.73Å; K100-D103 PolarHBondContact O-N 2.73Å; I101-D103 PolarHBondContact O-N 2.81Å; D103-R139 IonicContact OD1-CZ 2.77Å; D103-R139 IonicContact OD1-NH1 3.85Å; D103-R139 PolarHBondContact OD1-NH1 2.87Å; D103-R139 IonicContact OD2-NH1 3.21Å; D103-R139 PolarHBondContact OD2-NH1 3.42Å
104	Q	98.3	Very high	95	Very high	86 Å²	86	66.3 Å²	66.3	40%	0.402	35%	0.348	S	S	.	.	H	α-helix	trans	-72.1	-41.4	174.8	-67.1	176.2	-10.7	0	0	111.8	V79 V80 K100 I101 C102 H108	V79-Q104 HydrophobicContact CG1-CB 3.75Å; V80-Q104 HydrophobicContact CG2-CB 4.42Å; V80-Q104 VanDerWaalsContact CG2-O 3.31Å; V80-Q104 WeakPolarHBondContact CG2-O 3.48Å; K100-Q104 PolarHBondContact O-N 2.97Å; I101-Q104 PolarHBondContact O-N 3.4Å; I101-Q104 VanDerWaalsContact O-N 3.17Å; C102-Q104 VanDerWaalsContact C-N 3.3Å; C102-Q104 PolarHBondContact O-N 2.88Å; Q104-H108 PolarHBondContact O-ND1 2.89Å
105	L	98.6	Very high	95.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-74.9	-22.9	-178.1	-71.5	177.3	0	0	0	114	V79 A83 F91 I101 C102 G107 H108 L109 L140	V79-L105 HydrophobicContact CG1-CD2 4.2Å; V79-L105 HydrophobicContact CG1-CG 4.32Å; V79-L105 HydrophobicContact CG2-CD1 4.28Å; V79-L105 HydrophobicContact CG2-CD2 4.04Å; V79-L105 HydrophobicContact CG2-CG 4.21Å; V79-L105 WeakPolarHBondContact O-CD2 3.16Å; A83-L105 HydrophobicContact CB-CD2 3.51Å; F91-L105 HydrophobicContact CE1-CD1 3.95Å; I101-L105 HydrophobicContact CG2-CD1 3.92Å; I101-L105 HydrophobicContact CG2-CG 4.44Å; I101-L105 WeakPolarHBondContact O-CG 3.5Å; I101-L105 PolarHBondContact O-N 3.07Å; C102-L105 PolarHBondContact O-N 3.01Å; L105-G107 PolarHBondContact O-N 3.32Å; L105-H108 PolarHBondContact O-N 2.72Å; L105-L109 HydrophobicContact CB-CD2 4.27Å; L105-L109 HydrophobicContact CD2-CD2 4.14Å; L105-L140 HydrophobicContact CB-CD1 4.47Å; L105-L140 HydrophobicContact CB-CD2 3.74Å; L105-L140 HydrophobicContact CD1-CD1 4.37Å
106	K	97.6	Very high	96.3	Very high	131 Å²	131	62 Å²	62	57%	0.57	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	121.7	-175.8	-174	176.7	-175.9	-179.6	0	111.2	C102 H108 L140	C102-K106 WeakPolarHBondContact O-CB 3.13Å; C102-K106 PolarHBondContact O-N 3.06Å; K106-H108 VanDerWaalsContact C-N 3.32Å; K106-H108 PolarHBondContact O-CE1 3.06Å; K106-H108 PolarHBondContact O-ND1 2.57Å; K106-L140 HydrophobicContact CB-CD2 4.41Å
107	G	95.8	Very high	97	Very high	78 Å²	78	58 Å²	58	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	1.6	179.7	0	0	0	0	0	115.5	L105	L105-G107 PolarHBondContact O-N 3.32Å
108	H	97.8	Very high	97.4	Very high	107 Å²	107	53.2 Å²	53.2	50%	0.495	28%	0.283	S	S	.	.			trans	-114.4	12.6	-178	-55.5	95.5	0	0	0	113.6	V80 Q104 L105 K106	V80-H108 HydrophobicContact CG1-CB 3.68Å; Q104-H108 PolarHBondContact O-ND1 2.89Å; L105-H108 PolarHBondContact O-N 2.72Å; K106-H108 VanDerWaalsContact C-N 3.32Å; K106-H108 PolarHBondContact O-CE1 3.06Å; K106-H108 PolarHBondContact O-ND1 2.57Å
109	L	98.1	Very high	97.3	Very high	36 Å²	36	53.4 Å²	53.4	19%	0.188	28%	0.284	C	S	.	.	S	Bend	trans	-93.6	149.5	-179.8	-56.7	-173	0	0	0	111.6	A83 L89 L105 L140 I142	A83-L109 HydrophobicContact CB-CD2 4.21Å; L89-L109 HydrophobicContact CD1-CD1 3.89Å; L89-L109 HydrophobicContact CD1-CD2 3.79Å; L89-L109 HydrophobicContact CD1-CG 4.49Å; L105-L109 HydrophobicContact CB-CD2 4.27Å; L105-L109 HydrophobicContact CD2-CD2 4.14Å; L109-L140 HydrophobicContact CD1-CB 3.99Å; L109-L140 HydrophobicContact CD1-CD1 4.17Å; L109-L140 HydrophobicContact CD1-CD2 4.44Å; L109-L140 HydrophobicContact CD1-CG 4.43Å; L109-I142 HydrophobicContact CD1-CD1 4.23Å; L109-I142 HydrophobicContact CD1-CG2 3.87Å
110	K	97.2	Very high	97.1	Very high	88 Å²	88	51.4 Å²	51.4	38%	0.383	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-61.1	149.7	170.6	-174.3	-176.1	178.7	-173.6	0	110.6	D87 N112 T113	D87-K110 IonicContact OD1-NZ 3.44Å; D87-K110 PolarHBondContact OD1-NZ 2.9Å; D87-K110 IonicContact OD2-NZ 3.75Å; D87-K110 PolarHBondContact OD2-NZ 3.1Å; K110-N112 PolarHBondContact O-N 2.93Å; K110-T113 PolarHBondContact O-N 3.41Å; K110-T113 PolarHBondContact O-OG1 2.96Å
111	A	95.8	Very high	96.6	Very high	76 Å²	76	44.6 Å²	44.6	63%	0.628	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	139.5	171.9	0	0	0	0	0	110.9	T113	A111-T113 PolarHBondContact O-N 3.13Å
112	N	95.9	Very high	96.1	Very high	155 Å²	155	44.4 Å²	44.4	83%	0.829	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	19.9	-178.6	-45.4	-56.4	0	0	0	115.1	K110	K110-N112 PolarHBondContact O-N 2.93Å
113	T	98.4	Very high	95.4	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.012	25%	0.254	C	S	.	.			trans	-58.4	137.8	167.9	-65.5	0	0	0	0	110	A86 D87 L89 K110 A111 I142	A86-T113 PolarHBondContact O-OG1 3.31Å; D87-T113 WeakPolarHBondContact O-CA 3.06Å; L89-T113 HydrophobicContact CD1-CG2 3.77Å; L89-T113 HydrophobicContact CG-CG2 3.67Å; K110-T113 PolarHBondContact O-N 3.41Å; K110-T113 PolarHBondContact O-OG1 2.96Å; A111-T113 PolarHBondContact O-N 3.13Å; T113-I142 WeakPolarHBondContact O-CB 3.27Å; T113-I142 WeakPolarHBondContact O-CG2 3.49Å
114	I	98.7	Very high	94.5	Very high	23 Å²	23	45.1 Å²	45.1	12%	0.118	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	151.4	171.4	59.5	165.9	0	0	0	110.2	D87 I88 L89 P143 Q173 L176	D87-I114 WeakPolarHBondContact O-CG1 3.29Å; D87-I114 PolarHBondContact O-N 2.99Å; I88-I114 WeakPolarHBondContact CA-O 3.23Å; I88-I114 HydrophobicContact CB-CG1 4.47Å; I88-I114 HydrophobicContact CG1-CD1 4.09Å; I88-I114 HydrophobicContact CG1-CG1 3.99Å; L89-I114 PolarHBondContact N-O 3.39Å; I114-P143 HydrophobicContact CG2-CB 4.31Å; I114-P143 HydrophobicContact CG2-CG 4.23Å; I114-Q173 HydrophobicContact CD1-CG 3.64Å; I114-L176 HydrophobicContact CD1-CD2 4.32Å
115	G	98.8	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.3	179.1	0	0	0	0	0	113.1	L89 P143 M144 S145	L89-G115 CarbonylContact O-C 3.49Å; L89-G115 VanDerWaalsContact O-CA 3.32Å; L89-G115 WeakPolarHBondContact O-CA 3.17Å; G115-P143 PolarHBondContact N-O 2.64Å; G115-M144 CarbonylContact O-C 3.56Å; G115-M144 WeakPolarHBondContact O-CA 3.34Å; G115-S145 PolarHBondContact O-N 2.86Å
116	M	98.9	Very high	92.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	122.7	169.3	-176.5	173.2	55.8	0	0	109.9	L89 I90 F91 L118 S145 L147 I166 L177 M181	L89-M116 PolarHBondContact O-N 3.47Å; I90-M116 CarbonylContact C-O 3.5Å; I90-M116 WeakPolarHBondContact CA-O 3.18Å; I90-M116 HydrophobicContact CD1-CE 4.35Å; I90-M116 HydrophobicContact CG1-CE 4.16Å; F91-M116 PolarHBondContact N-O 3.16Å; M116-L118 HydrophobicContact CE-CD1 4.06Å; M116-L118 HydrophobicContact CG-CD1 3.88Å; M116-L118 HydrophobicContact SD-CD1 4.36Å; M116-S145 CarbonylContact C-O 3.51Å; M116-S145 VanDerWaalsContact CA-O 3.26Å; M116-S145 WeakPolarHBondContact CA-O 3.33Å; M116-L147 HydrophobicContact CE-CD1 4.5Å; M116-L147 HydrophobicContact CG-CB 4.41Å; M116-L147 HydrophobicContact SD-CB 3.98Å; M116-L147 HydrophobicContact SD-CD1 4.4Å; M116-I166 HydrophobicContact SD-CD1 4.19Å; M116-I166 HydrophobicContact SD-CG1 4.44Å; M116-L177 HydrophobicContact CB-CD1 4.43Å; M116-L177 HydrophobicContact CB-CD2 4.38Å; M116-L177 HydrophobicContact CE-CD2 4.12Å; M116-L177 HydrophobicContact SD-CB 4.31Å; M116-L177 HydrophobicContact SD-CD1 4.03Å; M116-L177 HydrophobicContact SD-CD2 4.16Å; M116-L177 HydrophobicContact SD-CG 4.41Å; M116-M181 HydrophobicContact CE-CE 4.32Å; M116-M181 HydrophobicContact CE-CG 3.76Å; M116-M181 HydrophobicContact CE-SD 3.85Å
117	S	98.7	Very high	90.8	Very high	0 Å²	0	47 Å²	47	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	130.7	177.3	-178.3	0	0	0	0	111.6	I119 S145 V146 L147	S117-I119 PolarHBondContact OG-N 3.44Å; S117-S145 PolarHBondContact N-O 3.28Å; S117-V146 CarbonylContact O-C 3.55Å; S117-V146 VanDerWaalsContact O-CA 3.25Å; S117-V146 WeakPolarHBondContact O-CA 3.35Å; S117-L147 PolarHBondContact O-N 2.87Å
118	L	97.8	Very high	90	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.037	25%	0.252	C	S	.	.			trans	-108.5	10	170.9	-80.5	60.4	0	0	0	110.9	I18 I90 F91 V92 M116 K120 L147 M181	I18-L118 HydrophobicContact CD1-CD2 3.57Å; I18-L118 HydrophobicContact CG1-CD2 3.65Å; I18-L118 HydrophobicContact CG2-CD2 4.27Å; I90-L118 HydrophobicContact CG2-CD1 3.83Å; I90-L118 HydrophobicContact CG2-CD2 4.06Å; F91-L118 PolarHBondContact O-N 3.12Å; V92-L118 HydrophobicContact CB-CB 4.18Å; V92-L118 HydrophobicContact CB-CD2 4.47Å; V92-L118 HydrophobicContact CG2-CB 4.11Å; V92-L118 HydrophobicContact CG2-CD2 4.32Å; M116-L118 HydrophobicContact CE-CD1 4.06Å; M116-L118 HydrophobicContact CG-CD1 3.88Å; M116-L118 HydrophobicContact SD-CD1 4.36Å; L118-K120 PolarHBondContact O-N 2.57Å; L118-L147 HydrophobicContact CD1-CB 3.72Å; L118-L147 HydrophobicContact CD2-CD2 4.43Å; L118-L147 HydrophobicContact CG-CB 3.94Å; L118-L147 HydrophobicContact CG-CD2 4.14Å; L118-L147 HydrophobicContact CG-CG 4.49Å; L118-M181 HydrophobicContact CD2-CE 4.46Å
119	I	93.8	Very high	89.5	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	23%	0.233	C	C	.	.			trans	-82.6	117.6	-174	-53.6	179	0	0	0	108.6	F91 V93 H95 I98 S117 I132 I136 M148	F91-I119 HydrophobicContact CB-CD1 4.21Å; V93-I119 HydrophobicContact CG2-CD1 3.66Å; V93-I119 WeakPolarHBondContact O-CG1 3.47Å; H95-I119 HydrophobicContact CB-CG2 3.63Å; I98-I119 HydrophobicContact CB-CD1 4.18Å; I98-I119 HydrophobicContact CD1-CD1 3.72Å; I98-I119 HydrophobicContact CG1-CD1 3.87Å; S117-I119 PolarHBondContact OG-N 3.44Å; I119-I132 HydrophobicContact CB-CG2 4.03Å; I119-I132 HydrophobicContact CD1-CG2 4.02Å; I119-I132 HydrophobicContact CG2-CG1 4.46Å; I119-I132 HydrophobicContact CG2-CG2 4.12Å; I119-I136 HydrophobicContact CD1-CD1 4.43Å; I119-M148 WeakPolarHBondContact O-CE 3.47Å
120	K	88.8	Confident	89.2	Confident	45 Å²	45	39.5 Å²	39.5	20%	0.196	23%	0.232	C	C	.	.			trans	-90.2	111	176.1	-64.7	-176.5	-177.4	-170.2	0	109.8	L118 M148 G149 D260	L118-K120 PolarHBondContact O-N 2.57Å; K120-M148 HydrophobicContact CG-SD 3.7Å; K120-G149 PolarHBondContact NZ-O 3.5Å; K120-D260 VanDerWaalsContact NZ-CG 3.28Å; K120-D260 IonicContact NZ-OD1 3.54Å; K120-D260 PolarHBondContact NZ-OD1 2.9Å; K120-D260 IonicContact NZ-OD2 3.99Å; K120-D260 PolarHBondContact NZ-OD2 2.93Å
121	G	85.2	Confident	89.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.214	C	C	.	.			trans	167.3	173.9	179.9	0	0	0	0	0	110.5
122	I	87.5	Confident	89	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	169.9	169.2	59.3	-178.5	0	0	0	108.2	L129 L131 I199 A202 T302 E305 L306 I309	I122-L129 HydrophobicContact CB-CD1 3.69Å; I122-L129 HydrophobicContact CD1-CD1 3.75Å; I122-L129 HydrophobicContact CG1-CD1 4.24Å; I122-L129 HydrophobicContact CG2-CD1 3.61Å; I122-L131 HydrophobicContact CG2-CD2 4.45Å; I122-I199 HydrophobicContact CG2-CD1 3.45Å; I122-I199 VanDerWaalsContact CG2-CD1 3.45Å; I122-A202 HydrophobicContact CG2-CB 3.63Å; I122-T302 HydrophobicContact CD1-CG2 4.15Å; I122-T302 HydrophobicContact CG1-CG2 4.27Å; I122-E305 HydrophobicContact CD1-CB 3.94Å; I122-E305 HydrophobicContact CG1-CB 4.09Å; I122-E305 WeakPolarHBondContact CG1-OE2 3.02Å; I122-L306 HydrophobicContact CD1-CD2 3.72Å; I122-L306 HydrophobicContact CD1-CG 4.25Å; I122-I309 HydrophobicContact CD1-CD1 4.05Å
123	D	85.3	Confident	89.1	Confident	28 Å²	28	24.8 Å²	24.8	15%	0.15	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	166	174.3	-151.4	-35.6	0	0	0	108.7	R99 K130 I132 V135	R99-D123 IonicContact CZ-OD1 2.8Å; R99-D123 IonicContact CZ-OD2 3.79Å; R99-D123 IonicContact NE-OD1 3.17Å; R99-D123 IonicContact NE-OD2 3.84Å; R99-D123 PolarHBondContact NE-OD2 3.17Å; R99-D123 IonicContact NH2-OD1 2.66Å; R99-D123 PolarHBondContact NH2-OD1 3.22Å; R99-D123 IonicContact NH2-OD2 2.76Å; R99-D123 PolarHBondContact NH2-OD2 3.02Å; D123-K130 WeakPolarHBondContact CA-O 3.32Å; D123-K130 HydrophobicContact CB-CB 4.43Å; D123-K130 PolarHBondContact N-O 2.82Å; D123-K130 PolarHBondContact O-N 2.97Å; D123-K130 VanDerWaalsContact O-O 3.09Å; D123-I132 HydrophobicContact CB-CD1 3.98Å; D123-V135 HydrophobicContact CB-CG2 4.07Å
124	E	77.8	Confident	89	Confident	79 Å²	79	27.3 Å²	27.3	37%	0.369	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.3	176.8	-168.4	171	-155.7	0	0	110	S308 H312	E124-S308 WeakPolarHBondContact OE1-CB 3.34Å; E124-S308 PolarHBondContact OE1-OG 3.23Å; E124-H312 IonicContact OE1-CE1 3.09Å; E124-H312 IonicContact OE1-ND1 2.64Å
125	G	74.8	Confident	88.8	Confident	15 Å²	15	26.3 Å²	26.3	16%	0.155	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	173.4	174.9	0	0	0	0	0	112	S127 G128	G125-S127 PolarHBondContact O-N 3.09Å; G125-G128 PolarHBondContact N-O 3.45Å; G125-G128 PolarHBondContact O-N 3.36Å
126	P	72.3	Confident	88.8	Confident	145 Å²	145	26.3 Å²	26.3	94%	0.942	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.9	-179.4	-25.6	34.4	0	0	0	114.8
127	S	69.3	Low	88.8	Confident	97 Å²	97	27 Å²	27	68%	0.678	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	2.5	179.6	50.1	0	0	0	0	114.4	G125	G125-S127 PolarHBondContact O-N 3.09Å
128	G	80.4	Confident	88.6	Confident	7 Å²	7	33.1 Å²	33.1	7%	0.072	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.5	-125.4	-174.7	0	0	0	0	0	112	G125 K130	G125-G128 PolarHBondContact N-O 3.45Å; G125-G128 PolarHBondContact O-N 3.36Å; G128-K130 PolarHBondContact O-N 3.33Å
129	L	86.4	Confident	88.6	Confident	20 Å²	20	36.4 Å²	36.4	11%	0.105	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	132.4	179.8	179.8	69.7	0	0	0	111.1	I122 I199 F238 F242 I309	I122-L129 HydrophobicContact CB-CD1 3.69Å; I122-L129 HydrophobicContact CD1-CD1 3.75Å; I122-L129 HydrophobicContact CG1-CD1 4.24Å; I122-L129 HydrophobicContact CG2-CD1 3.61Å; L129-I199 HydrophobicContact CD1-CD1 3.98Å; L129-I199 HydrophobicContact CD2-CD1 3.93Å; L129-F238 HydrophobicContact CD1-CE1 4.34Å; L129-F238 HydrophobicContact CD2-CE1 3.97Å; L129-F242 HydrophobicContact CB-CB 4.39Å; L129-F242 HydrophobicContact CD2-CB 3.65Å; L129-I309 HydrophobicContact CB-CD1 3.92Å; L129-I309 HydrophobicContact CD1-CD1 3.91Å
130	K	91.6	Very high	88.8	Confident	37 Å²	37	37.2 Å²	37.2	16%	0.161	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.6	165.9	-164.4	167.3	-174	132	0	110.1	D123 G128 E134 V135 E138	D123-K130 WeakPolarHBondContact CA-O 3.32Å; D123-K130 HydrophobicContact CB-CB 4.43Å; D123-K130 PolarHBondContact N-O 2.82Å; D123-K130 PolarHBondContact O-N 2.97Å; D123-K130 VanDerWaalsContact O-O 3.09Å; G128-K130 PolarHBondContact O-N 3.33Å; K130-E134 HydrophobicContact CG-CB 4.29Å; K130-V135 HydrophobicContact CD-CG2 3.71Å; K130-V135 HydrophobicContact CG-CG2 3.82Å; K130-E138 WeakPolarHBondContact CE-OE1 3.48Å; K130-E138 WeakPolarHBondContact CE-OE2 2.89Å; K130-E138 IonicContact NZ-OE1 3.22Å; K130-E138 PolarHBondContact NZ-OE1 3.25Å; K130-E138 IonicContact NZ-OE2 2.77Å; K130-E138 PolarHBondContact NZ-OE2 3.47Å
131	L	94.7	Very high	89.3	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	150.5	178	-62.9	177.5	0	0	0	110.7	I122 S133 E134 V135 D195 E198 I199	I122-L131 HydrophobicContact CG2-CD2 4.45Å; L131-S133 VanDerWaalsContact C-N 3.28Å; L131-S133 PolarHBondContact O-N 3.23Å; L131-E134 HydrophobicContact CB-CB 4.41Å; L131-E134 HydrophobicContact CB-CG 4.01Å; L131-E134 PolarHBondContact N-OE2 3.01Å; L131-E134 WeakPolarHBondContact O-CB 3.42Å; L131-E134 PolarHBondContact O-N 3.36Å; L131-E134 VanDerWaalsContact O-N 3.15Å; L131-V135 WeakPolarHBondContact O-CG2 3.48Å; L131-V135 PolarHBondContact O-N 2.86Å; L131-D195 HydrophobicContact CD1-CB 3.68Å; L131-E198 WeakPolarHBondContact CB-OE2 3.48Å; L131-E198 HydrophobicContact CD1-CB 4.45Å; L131-E198 HydrophobicContact CD2-CB 4.49Å; L131-E198 HydrophobicContact CD2-CG 4.31Å; L131-I199 HydrophobicContact CD2-CB 4.29Å; L131-I199 HydrophobicContact CD2-CD1 4.01Å
132	I	95.1	Very high	89.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-37.6	-179.6	-61.3	-67.6	0	0	0	110.3	H95 I98 I119 D123 E134 V135 I136 E198	H95-I132 HydrophobicContact CB-CD1 4.21Å; I98-I132 HydrophobicContact CG1-CG2 4.4Å; I98-I132 HydrophobicContact CG2-CG2 4.37Å; I119-I132 HydrophobicContact CB-CG2 4.03Å; I119-I132 HydrophobicContact CD1-CG2 4.02Å; I119-I132 HydrophobicContact CG2-CG1 4.46Å; I119-I132 HydrophobicContact CG2-CG2 4.12Å; D123-I132 HydrophobicContact CB-CD1 3.98Å; I132-E134 VanDerWaalsContact C-N 3.31Å; I132-E134 PolarHBondContact O-N 3.09Å; I132-V135 PolarHBondContact O-N 3.22Å; I132-I136 HydrophobicContact CG2-CD1 3.87Å; I132-I136 HydrophobicContact CG2-CG1 4.37Å; I132-I136 VanDerWaalsContact O-CG1 3.28Å; I132-I136 WeakPolarHBondContact O-CG1 2.94Å; I132-I136 PolarHBondContact O-N 3Å; I132-E198 PolarHBondContact N-OE1 3.39Å
133	S	97.3	Very high	90.4	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.035	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-37.7	174	74.6	0	0	0	0	112.4	L131 I136 G137 M144 E198	L131-S133 VanDerWaalsContact C-N 3.28Å; L131-S133 PolarHBondContact O-N 3.23Å; S133-I136 PolarHBondContact O-N 3.26Å; S133-G137 PolarHBondContact O-N 3.09Å; S133-M144 WeakPolarHBondContact O-CG 3.28Å; S133-E198 WeakPolarHBondContact CB-OE2 3.47Å; S133-E198 PolarHBondContact N-OE1 2.97Å; S133-E198 PolarHBondContact OG-OE2 3.33Å
134	E	96	Very high	91	Very high	55 Å²	55	42.7 Å²	42.7	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-45	174.2	-66.3	174	147	0	0	111.1	K130 L131 I132 I136 G137 E138	K130-E134 HydrophobicContact CG-CB 4.29Å; L131-E134 HydrophobicContact CB-CB 4.41Å; L131-E134 HydrophobicContact CB-CG 4.01Å; L131-E134 PolarHBondContact N-OE2 3.01Å; L131-E134 WeakPolarHBondContact O-CB 3.42Å; L131-E134 PolarHBondContact O-N 3.36Å; L131-E134 VanDerWaalsContact O-N 3.15Å; I132-E134 VanDerWaalsContact C-N 3.31Å; I132-E134 PolarHBondContact O-N 3.09Å; E134-I136 VanDerWaalsContact C-N 3.31Å; E134-I136 PolarHBondContact O-N 2.73Å; E134-G137 PolarHBondContact O-N 3.18Å; E134-E138 WeakPolarHBondContact O-CB 3.35Å; E134-E138 VanDerWaalsContact O-CG 3.32Å; E134-E138 WeakPolarHBondContact O-CG 3.26Å; E134-E138 PolarHBondContact O-N 3.25Å
135	V	95.5	Very high	92	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-45.4	176.1	175.9	0	0	0	0	111.2	R99 D123 K130 L131 I132 R139	R99-V135 HydrophobicContact CG-CG1 4.24Å; D123-V135 HydrophobicContact CB-CG2 4.07Å; K130-V135 HydrophobicContact CD-CG2 3.71Å; K130-V135 HydrophobicContact CG-CG2 3.82Å; L131-V135 WeakPolarHBondContact O-CG2 3.48Å; L131-V135 PolarHBondContact O-N 2.86Å; I132-V135 PolarHBondContact O-N 3.22Å; V135-R139 WeakPolarHBondContact O-CB 3.47Å; V135-R139 VanDerWaalsContact O-CG 3.26Å; V135-R139 WeakPolarHBondContact O-CG 3.47Å; V135-R139 PolarHBondContact O-N 3.22Å
136	I	98	Very high	93.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.9	-51.5	179	-64.2	165.1	0	0	0	110.2	F91 I98 I119 I132 S133 E134 E138 R139 L140 M144	F91-I136 HydrophobicContact CB-CD1 4.05Å; F91-I136 HydrophobicContact CD1-CD1 4.41Å; F91-I136 HydrophobicContact CD2-CD1 4.24Å; F91-I136 HydrophobicContact CD2-CG2 4.07Å; F91-I136 HydrophobicContact CE1-CG2 4.16Å; F91-I136 HydrophobicContact CE2-CG2 3.67Å; F91-I136 HydrophobicContact CG-CD1 3.98Å; F91-I136 HydrophobicContact CG-CG2 4.47Å; F91-I136 HydrophobicContact CZ-CG2 3.72Å; I98-I136 HydrophobicContact CD1-CD1 3.87Å; I98-I136 HydrophobicContact CD1-CG1 3.96Å; I98-I136 HydrophobicContact CG1-CD1 3.8Å; I98-I136 HydrophobicContact CG1-CG1 3.61Å; I119-I136 HydrophobicContact CD1-CD1 4.43Å; I132-I136 HydrophobicContact CG2-CD1 3.87Å; I132-I136 HydrophobicContact CG2-CG1 4.37Å; I132-I136 VanDerWaalsContact O-CG1 3.28Å; I132-I136 WeakPolarHBondContact O-CG1 2.94Å; I132-I136 PolarHBondContact O-N 3Å; S133-I136 PolarHBondContact O-N 3.26Å; E134-I136 VanDerWaalsContact C-N 3.31Å; E134-I136 PolarHBondContact O-N 2.73Å; I136-E138 PolarHBondContact O-N 3.09Å; I136-R139 PolarHBondContact O-N 3.42Å; I136-L140 HydrophobicContact CG2-CD1 3.78Å; I136-L140 HydrophobicContact CG2-CG 4.48Å; I136-L140 WeakPolarHBondContact O-CB 3.24Å; I136-L140 WeakPolarHBondContact O-CG 3.39Å; I136-L140 PolarHBondContact O-N 3.14Å; I136-M144 HydrophobicContact CB-CE 4.07Å; I136-M144 HydrophobicContact CB-SD 4.25Å; I136-M144 HydrophobicContact CD1-CE 4.07Å; I136-M144 HydrophobicContact CG2-CE 3.82Å; I136-M144 HydrophobicContact CG2-SD 3.65Å
137	G	97.8	Very high	94.4	Very high	14 Å²	14	31.4 Å²	31.4	14%	0.144	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-43.8	-175.6	0	0	0	0	0	112.6	S133 E134 G141 I142	S133-G137 PolarHBondContact O-N 3.09Å; E134-G137 PolarHBondContact O-N 3.18Å; G137-G141 VanDerWaalsContact O-CA 3.24Å; G137-G141 WeakPolarHBondContact O-CA 3.12Å; G137-G141 PolarHBondContact O-N 3.06Å; G137-I142 PolarHBondContact O-N 3.46Å
138	E	96.4	Very high	95.8	Very high	129 Å²	129	26.8 Å²	26.8	60%	0.603	15%	0.154	S	C	*	.	H	α-helix	trans	-68	-41.8	177	-72.8	177.4	-163.4	0	0	112.9	K130 E134 I136	K130-E138 WeakPolarHBondContact CE-OE1 3.48Å; K130-E138 WeakPolarHBondContact CE-OE2 2.89Å; K130-E138 IonicContact NZ-OE1 3.22Å; K130-E138 PolarHBondContact NZ-OE1 3.25Å; K130-E138 IonicContact NZ-OE2 2.77Å; K130-E138 PolarHBondContact NZ-OE2 3.47Å; E134-E138 WeakPolarHBondContact O-CB 3.35Å; E134-E138 VanDerWaalsContact O-CG 3.32Å; E134-E138 WeakPolarHBondContact O-CG 3.26Å; E134-E138 PolarHBondContact O-N 3.25Å; I136-E138 PolarHBondContact O-N 3.09Å
139	R	97	Very high	96.5	Very high	75 Å²	75	26.4 Å²	26.4	28%	0.283	15%	0.151	S	C	.	.	H	α-helix	trans	-69.3	-38.2	-178.3	-76.9	-176	179.2	-113.6	-1.9	112.3	C102 D103 V135 I136	C102-R139 HydrophobicContact CB-CB 4.03Å; D103-R139 IonicContact OD1-CZ 2.77Å; D103-R139 IonicContact OD1-NH1 3.85Å; D103-R139 PolarHBondContact OD1-NH1 2.87Å; D103-R139 IonicContact OD2-NH1 3.21Å; D103-R139 PolarHBondContact OD2-NH1 3.42Å; V135-R139 WeakPolarHBondContact O-CB 3.47Å; V135-R139 VanDerWaalsContact O-CG 3.26Å; V135-R139 WeakPolarHBondContact O-CG 3.47Å; V135-R139 PolarHBondContact O-N 3.22Å; I136-R139 PolarHBondContact O-N 3.42Å
140	L	98.2	Very high	96.8	Very high	22 Å²	22	26.4 Å²	26.4	12%	0.115	15%	0.154	C	C	.	.	H	α-helix	trans	-97.7	-15.2	-174.2	-60.6	-177.1	0	0	0	113.3	F91 C102 L105 K106 L109 I136 I142	F91-L140 HydrophobicContact CE1-CD1 4.02Å; F91-L140 HydrophobicContact CZ-CD1 3.59Å; C102-L140 HydrophobicContact CB-CD2 4.19Å; C102-L140 HydrophobicContact CB-CG 4.37Å; C102-L140 WeakPolarHBondContact O-CD2 3.38Å; L105-L140 HydrophobicContact CB-CD1 4.47Å; L105-L140 HydrophobicContact CB-CD2 3.74Å; L105-L140 HydrophobicContact CD1-CD1 4.37Å; K106-L140 HydrophobicContact CB-CD2 4.41Å; L109-L140 HydrophobicContact CD1-CB 3.99Å; L109-L140 HydrophobicContact CD1-CD1 4.17Å; L109-L140 HydrophobicContact CD1-CD2 4.44Å; L109-L140 HydrophobicContact CD1-CG 4.43Å; I136-L140 HydrophobicContact CG2-CD1 3.78Å; I136-L140 HydrophobicContact CG2-CG 4.48Å; I136-L140 WeakPolarHBondContact O-CB 3.24Å; I136-L140 WeakPolarHBondContact O-CG 3.39Å; I136-L140 PolarHBondContact O-N 3.14Å; L140-I142 HydrophobicContact CB-CD1 4.24Å; L140-I142 HydrophobicContact CB-CG1 4.05Å; L140-I142 HydrophobicContact CB-CG2 4.48Å; L140-I142 HydrophobicContact CD1-CD1 4.24Å
141	G	97.9	Very high	96.6	Very high	69 Å²	69	25.4 Å²	25.4	71%	0.711	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	34	-179	0	0	0	0	0	113.4	G137	G137-G141 VanDerWaalsContact O-CA 3.24Å; G137-G141 WeakPolarHBondContact O-CA 3.12Å; G137-G141 PolarHBondContact O-N 3.06Å
142	I	98.3	Very high	96.2	Very high	18 Å²	18	28.1 Å²	28.1	9%	0.092	16%	0.164	C	C	.	.			trans	-120.9	149.7	-176.5	64.7	177.3	0	0	0	112.3	L89 F91 L109 T113 G137 L140 M144	L89-I142 HydrophobicContact CD1-CD1 4.26Å; F91-I142 HydrophobicContact CE2-CD1 4.19Å; F91-I142 HydrophobicContact CZ-CD1 4.34Å; L109-I142 HydrophobicContact CD1-CD1 4.23Å; L109-I142 HydrophobicContact CD1-CG2 3.87Å; T113-I142 WeakPolarHBondContact O-CB 3.27Å; T113-I142 WeakPolarHBondContact O-CG2 3.49Å; G137-I142 PolarHBondContact O-N 3.46Å; L140-I142 HydrophobicContact CB-CD1 4.24Å; L140-I142 HydrophobicContact CB-CG1 4.05Å; L140-I142 HydrophobicContact CB-CG2 4.48Å; L140-I142 HydrophobicContact CD1-CD1 4.24Å; I142-M144 HydrophobicContact CD1-SD 4.05Å; I142-M144 HydrophobicContact CG1-SD 4Å
143	P	98.3	Very high	95.9	Very high	72 Å²	72	28.5 Å²	28.5	47%	0.468	17%	0.167	S	C	.	.			trans	-63.1	137.8	170.4	-19.5	32.4	0	0	0	111.3	I114 G115	I114-P143 HydrophobicContact CG2-CB 4.31Å; I114-P143 HydrophobicContact CG2-CG 4.23Å; G115-P143 PolarHBondContact N-O 2.64Å
144	M	98.6	Very high	95.5	Very high	30 Å²	30	30.8 Å²	30.8	15%	0.148	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.5	-177.2	-69.8	-62.1	-59.4	0	0	112.6	F91 G115 S133 I136 I142	F91-M144 HydrophobicContact CD2-CE 4.04Å; F91-M144 HydrophobicContact CE2-CE 4.3Å; F91-M144 HydrophobicContact CE2-SD 4.29Å; G115-M144 CarbonylContact O-C 3.56Å; G115-M144 WeakPolarHBondContact O-CA 3.34Å; S133-M144 WeakPolarHBondContact O-CG 3.28Å; I136-M144 HydrophobicContact CB-CE 4.07Å; I136-M144 HydrophobicContact CB-SD 4.25Å; I136-M144 HydrophobicContact CD1-CE 4.07Å; I136-M144 HydrophobicContact CG2-CE 3.82Å; I136-M144 HydrophobicContact CG2-SD 3.65Å; I142-M144 HydrophobicContact CD1-SD 4.05Å; I142-M144 HydrophobicContact CG1-SD 4Å
145	S	98.8	Very high	95.4	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	172.3	164.4	-55.3	0	0	0	0	109.6	G115 M116 S117 G167 C168 Q173 L177	G115-S145 PolarHBondContact O-N 2.86Å; M116-S145 CarbonylContact C-O 3.51Å; M116-S145 VanDerWaalsContact CA-O 3.26Å; M116-S145 WeakPolarHBondContact CA-O 3.33Å; S117-S145 PolarHBondContact N-O 3.28Å; S145-G167 CarbonylContact C-O 3.56Å; S145-G167 VanDerWaalsContact CA-O 3.25Å; S145-G167 WeakPolarHBondContact CA-O 3.36Å; S145-G167 VanDerWaalsContact CB-O 3.29Å; S145-G167 WeakPolarHBondContact CB-O 3.44Å; S145-C168 PolarHBondContact OG-SG 3.25Å; S145-Q173 PolarHBondContact OG-NE2 3.47Å; S145-L177 VanDerWaalsContact CB-CD1 3.47Å; S145-L177 VanDerWaalsContact OG-CD1 3.23Å; S145-L177 WeakPolarHBondContact OG-CD1 3.04Å
146	V	98.7	Very high	95.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	154.6	174.9	-61.7	0	0	0	0	111.3	S117 M148 I166 G167 V194 V197 E198	S117-V146 CarbonylContact O-C 3.55Å; S117-V146 VanDerWaalsContact O-CA 3.25Å; S117-V146 WeakPolarHBondContact O-CA 3.35Å; V146-M148 HydrophobicContact CB-CE 4.33Å; V146-I166 CarbonylContact O-C 3.52Å; V146-I166 VanDerWaalsContact O-CA 3.24Å; V146-I166 WeakPolarHBondContact O-CA 3.36Å; V146-G167 PolarHBondContact N-O 3.29Å; V146-G167 PolarHBondContact O-N 3.17Å; V146-V194 HydrophobicContact CG1-CG1 4.03Å; V146-V194 HydrophobicContact CG2-CG1 4.06Å; V146-V197 HydrophobicContact CG2-CB 3.93Å; V146-V197 HydrophobicContact CG2-CG1 3.67Å; V146-E198 HydrophobicContact CG1-CB 4.1Å; V146-E198 HydrophobicContact CG1-CG 4.15Å; V146-E198 HydrophobicContact CG2-CB 4.29Å
147	L	98.7	Very high	95.4	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	114.1	169.6	-177.8	160.2	0	0	0	109.3	W14 M116 S117 L118 T164 T165 I166 M181 F186	W14-L147 HydrophobicContact CZ2-CD2 4.4Å; M116-L147 HydrophobicContact CE-CD1 4.5Å; M116-L147 HydrophobicContact CG-CB 4.41Å; M116-L147 HydrophobicContact SD-CB 3.98Å; M116-L147 HydrophobicContact SD-CD1 4.4Å; S117-L147 PolarHBondContact O-N 2.87Å; L118-L147 HydrophobicContact CD1-CB 3.72Å; L118-L147 HydrophobicContact CD2-CD2 4.43Å; L118-L147 HydrophobicContact CG-CB 3.94Å; L118-L147 HydrophobicContact CG-CD2 4.14Å; L118-L147 HydrophobicContact CG-CG 4.49Å; L147-T164 HydrophobicContact CD1-CG2 4.07Å; L147-T164 HydrophobicContact CD2-CG2 4.04Å; L147-T164 WeakPolarHBondContact CD2-OG1 3.47Å; L147-T164 HydrophobicContact CG-CG2 3.95Å; L147-T165 WeakPolarHBondContact CA-O 3.45Å; L147-I166 HydrophobicContact CB-CG1 4.21Å; L147-I166 HydrophobicContact CD1-CD1 4.27Å; L147-I166 HydrophobicContact CD1-CG1 4.03Å; L147-I166 HydrophobicContact CG-CG1 4.13Å; L147-M181 HydrophobicContact CD1-CB 4.4Å; L147-M181 HydrophobicContact CD1-CE 3.57Å; L147-M181 HydrophobicContact CD1-CG 4.16Å; L147-F186 HydrophobicContact CD1-CE1 4.29Å; L147-F186 HydrophobicContact CD2-CZ 4.25Å
148	M	97.9	Very high	95.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.5	-179.6	-57	-56.8	173.4	0	0	110	I119 K120 V146 T164 T165 V197 E198 C256	I119-M148 WeakPolarHBondContact O-CE 3.47Å; K120-M148 HydrophobicContact CG-SD 3.7Å; V146-M148 HydrophobicContact CB-CE 4.33Å; M148-T164 VanDerWaalsContact C-OG1 3.31Å; M148-T164 PolarHBondContact O-OG1 2.9Å; M148-T165 PolarHBondContact N-O 3.41Å; M148-T165 WeakPolarHBondContact O-CA 3.21Å; M148-T165 PolarHBondContact O-N 3.41Å; M148-T165 VanDerWaalsContact O-O 3.07Å; M148-V197 HydrophobicContact CB-CG1 3.82Å; M148-V197 HydrophobicContact CG-CG1 3.95Å; M148-V197 WeakPolarHBondContact CG-O 3.41Å; M148-E198 HydrophobicContact CE-CG 3.92Å; M148-C256 HydrophobicContact CB-CB 3.65Å
149	G	96.1	Very high	95.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.3	172.6	-176.3	0	0	0	0	0	113.6	K120 N151 S255 D260	K120-G149 PolarHBondContact NZ-O 3.5Å; G149-N151 VanDerWaalsContact C-CG 3.49Å; G149-N151 VanDerWaalsContact C-OD1 3.26Å; G149-N151 PolarHBondContact O-N 2.66Å; G149-S255 WeakPolarHBondContact CA-OG 3.39Å; G149-D260 VanDerWaalsContact O-CG 3.31Å
150	A	92.8	Very high	95.5	Very high	20 Å²	20	36.8 Å²	36.8	17%	0.165	21%	0.213	C	C	.	.	S	Bend	trans	-71.6	63.7	178.4	0	0	0	0	0	112.8	S255 A259 D260 T263	A150-S255 PolarHBondContact N-OG 2.84Å; A150-A259 HydrophobicContact CB-CB 3.91Å; A150-D260 HydrophobicContact CB-CB 4.47Å; A150-T263 HydrophobicContact CB-CG2 3.74Å
151	N	86.6	Confident	95.5	Very high	16 Å²	16	42.3 Å²	42.3	9%	0.086	24%	0.236	C	C	.	.			trans	-120.2	82.5	-162.7	-45.9	-22	0	0	0	111.6	W14 G149 A153 V156 E163 T164 F186	W14-N151 HydrophobicContact CH2-CB 3.41Å; W14-N151 VanDerWaalsContact CH2-CB 3.41Å; W14-N151 HydrophobicContact CZ2-CB 3.76Å; W14-N151 HydrophobicContact CZ3-CB 4.11Å; G149-N151 VanDerWaalsContact C-CG 3.49Å; G149-N151 VanDerWaalsContact C-OD1 3.26Å; G149-N151 PolarHBondContact O-N 2.66Å; N151-A153 PolarHBondContact O-N 3.26Å; N151-V156 HydrophobicContact CB-CG2 4.2Å; N151-E163 PolarHBondContact OD1-O 3.48Å; N151-T164 VanDerWaalsContact ND2-CB 3.33Å; N151-T164 WeakPolarHBondContact ND2-CB 3.4Å; N151-T164 PolarHBondContact ND2-OG1 3.44Å; N151-F186 HydrophobicContact CB-CE2 4.27Å
152	I	87.2	Confident	95.5	Very high	60 Å²	60	39.9 Å²	39.9	31%	0.308	21%	0.208	S	C	.	.			trans	-70.8	118.6	173	-60.3	178	0	0	0	108.3	S154 E155 V156	I152-S154 VanDerWaalsContact C-N 3.31Å; I152-S154 PolarHBondContact O-N 3.23Å; I152-E155 HydrophobicContact CB-CB 4.42Å; I152-E155 HydrophobicContact CB-CG 4.18Å; I152-E155 HydrophobicContact CG2-CG 4.27Å; I152-E155 PolarHBondContact O-N 2.98Å; I152-V156 PolarHBondContact O-N 3.33Å
153	A	88.2	Confident	95.5	Very high	8 Å²	8	43.4 Å²	43.4	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-54	-39.9	-171.5	0	0	0	0	0	114.9	N13 W14 A17 N151 V156 A157	N13-A153 WeakPolarHBondContact OD1-CB 3.42Å; W14-A153 HydrophobicContact CB-CB 4.35Å; W14-A153 HydrophobicContact CD2-CB 4.45Å; W14-A153 HydrophobicContact CE3-CB 3.56Å; W14-A153 HydrophobicContact CZ3-CB 4.29Å; A17-A153 HydrophobicContact CB-CB 4.35Å; N151-A153 PolarHBondContact O-N 3.26Å; A153-V156 PolarHBondContact O-N 3.41Å; A153-A157 WeakPolarHBondContact O-CB 3.34Å; A153-A157 PolarHBondContact O-N 3.2Å
154	S	88.6	Confident	95.5	Very high	54 Å²	54	40 Å²	40	38%	0.378	20%	0.202	S	C	.	.	H	α-helix	trans	-64.6	-40.4	176.2	52.9	0	0	0	0	112.2	I152 A157 D158	I152-S154 VanDerWaalsContact C-N 3.31Å; I152-S154 PolarHBondContact O-N 3.23Å; S154-A157 PolarHBondContact O-N 3.45Å; S154-D158 WeakPolarHBondContact O-CB 3.45Å; S154-D158 PolarHBondContact O-N 3.35Å
155	E	93.4	Very high	95.5	Very high	80 Å²	80	38.6 Å²	38.6	37%	0.374	20%	0.195	S	C	.	.	H	α-helix	trans	-70	-37.2	179.3	-61.7	-171.7	154.9	0	0	111.9	I152 A157 D158 E159 K160	I152-E155 HydrophobicContact CB-CB 4.42Å; I152-E155 HydrophobicContact CB-CG 4.18Å; I152-E155 HydrophobicContact CG2-CG 4.27Å; I152-E155 PolarHBondContact O-N 2.98Å; E155-A157 VanDerWaalsContact C-N 3.35Å; E155-D158 CarbonylContact O-C 3.58Å; E155-D158 WeakPolarHBondContact O-CB 3.18Å; E155-D158 PolarHBondContact O-N 2.88Å; E155-E159 PolarHBondContact O-N 3.31Å; E155-K160 HydrophobicContact CB-CB 4.31Å; E155-K160 HydrophobicContact CB-CD 3.98Å; E155-K160 HydrophobicContact CG-CD 4.1Å; E155-K160 WeakPolarHBondContact O-CB 3.34Å; E155-K160 PolarHBondContact O-N 3.04Å
156	V	96.6	Very high	95.5	Very high	10 Å²	10	38.6 Å²	38.6	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-40.7	172.9	176.3	0	0	0	0	110.9	W14 I21 N151 I152 A153 D158 E159 F186	W14-V156 HydrophobicContact CH2-CB 4.36Å; W14-V156 HydrophobicContact CH2-CG1 4.19Å; W14-V156 HydrophobicContact CH2-CG2 3.92Å; W14-V156 HydrophobicContact CZ3-CB 3.8Å; W14-V156 HydrophobicContact CZ3-CG1 3.89Å; W14-V156 HydrophobicContact CZ3-CG2 3.69Å; I21-V156 HydrophobicContact CD1-CG1 3.55Å; N151-V156 HydrophobicContact CB-CG2 4.2Å; I152-V156 PolarHBondContact O-N 3.33Å; A153-V156 PolarHBondContact O-N 3.41Å; V156-D158 VanDerWaalsContact C-N 3.29Å; V156-D158 PolarHBondContact O-N 3.28Å; V156-E159 PolarHBondContact O-N 2.81Å; V156-F186 HydrophobicContact CG1-CD2 4.18Å; V156-F186 HydrophobicContact CG1-CE2 4.43Å; V156-F186 HydrophobicContact CG2-CD2 4.26Å; V156-F186 HydrophobicContact CG2-CE2 4.22Å
157	A	96.5	Very high	95.5	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-69.5	-25.7	176.1	0	0	0	0	0	113.5	A17 K20 L64 H67 A153 S154 E155	A17-A157 HydrophobicContact CB-CB 4.26Å; K20-A157 HydrophobicContact CD-CB 4.16Å; K20-A157 WeakPolarHBondContact CE-O 3.42Å; L64-A157 HydrophobicContact CD1-CB 3.86Å; L64-A157 HydrophobicContact CD2-CB 3.94Å; L64-A157 HydrophobicContact CG-CB 4.36Å; H67-A157 PolarHBondContact ND1-O 3.22Å; A153-A157 WeakPolarHBondContact O-CB 3.34Å; A153-A157 PolarHBondContact O-N 3.2Å; S154-A157 PolarHBondContact O-N 3.45Å; E155-A157 VanDerWaalsContact C-N 3.35Å
158	D	97.7	Very high	95.5	Very high	78 Å²	78	38.6 Å²	38.6	42%	0.417	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-0	169.3	-71.6	-25.9	0	0	0	112.9	H67 S154 E155 V156 K160	H67-D158 IonicContact CE1-OD1 3.1Å; H67-D158 PolarHBondContact CE1-OD1 2.91Å; H67-D158 VanDerWaalsContact CE1-OD1 3.22Å; H67-D158 IonicContact NE2-OD1 2.57Å; S154-D158 WeakPolarHBondContact O-CB 3.45Å; S154-D158 PolarHBondContact O-N 3.35Å; E155-D158 CarbonylContact O-C 3.58Å; E155-D158 WeakPolarHBondContact O-CB 3.18Å; E155-D158 PolarHBondContact O-N 2.88Å; V156-D158 VanDerWaalsContact C-N 3.29Å; V156-D158 PolarHBondContact O-N 3.28Å; D158-K160 HydrophobicContact CB-CD 4.13Å; D158-K160 HydrophobicContact CB-CG 3.98Å; D158-K160 PolarHBondContact O-N 3.42Å; D158-K160 IonicContact OD2-NZ 2.71Å; D158-K160 PolarHBondContact OD2-NZ 2.99Å
159	E	97.9	Very high	95.4	Very high	128 Å²	128	45.3 Å²	45.3	60%	0.598	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	27.5	-175.6	-56.6	176.8	-159.5	0	0	113.5	E155 V156 N185	E155-E159 PolarHBondContact O-N 3.31Å; V156-E159 PolarHBondContact O-N 2.81Å; E159-N185 WeakPolarHBondContact O-CB 3.32Å; E159-N185 PolarHBondContact O-ND2 3.24Å
160	K	98	Very high	95.5	Very high	102 Å²	102	49 Å²	49	44%	0.443	24%	0.244	S	C	.	.			trans	-70.1	143	173.1	-68.2	171	-179.5	147.7	0	109.8	E155 D158 C162	E155-K160 HydrophobicContact CB-CB 4.31Å; E155-K160 HydrophobicContact CB-CD 3.98Å; E155-K160 HydrophobicContact CG-CD 4.1Å; E155-K160 WeakPolarHBondContact O-CB 3.34Å; E155-K160 PolarHBondContact O-N 3.04Å; D158-K160 HydrophobicContact CB-CD 4.13Å; D158-K160 HydrophobicContact CB-CG 3.98Å; D158-K160 PolarHBondContact O-N 3.42Å; D158-K160 IonicContact OD2-NZ 2.71Å; D158-K160 PolarHBondContact OD2-NZ 2.99Å; K160-C162 PolarHBondContact O-N 3.33Å
161	F	98.2	Very high	95.8	Very high	138 Å²	138	51.9 Å²	51.9	61%	0.605	26%	0.261	S	S	*	.			trans	-58.9	127.1	178.9	177.9	-91.4	0	0	0	111.2	N185 R187	F161-N185 CarbonylContact C-O 3.52Å; F161-N185 WeakPolarHBondContact CA-O 3.34Å; F161-R187 HydrophobicContact CD2-CG 4.49Å; F161-R187 HydrophobicContact CE2-CG 3.64Å; F161-R187 HydrophobicContact CZ-CG 4.18Å
162	C	97.8	Very high	96.3	Very high	19 Å²	19	54.5 Å²	54.5	13%	0.128	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	177.1	171	57.9	0	0	0	0	110.1	K160 N185 R187	K160-C162 PolarHBondContact O-N 3.33Å; C162-N185 PolarHBondContact N-O 3.12Å; C162-N185 VanDerWaalsContact O-O 3.07Å; C162-R187 PolarHBondContact O-N 3.4Å
163	E	98.2	Very high	96.8	Very high	92 Å²	92	52.6 Å²	52.6	43%	0.43	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.1	-176.2	54.7	179.6	-126.7	0	0	111.2	N151 R187 S255	N151-E163 PolarHBondContact OD1-O 3.48Å; E163-R187 CarbonylContact C-O 3.55Å; E163-R187 WeakPolarHBondContact CA-O 3.48Å; E163-R187 HydrophobicContact CB-CB 4.16Å; E163-S255 PolarHBondContact O-OG 2.86Å
164	T	98.7	Very high	97.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	163.5	179.5	-164	0	0	0	0	111.2	L147 M148 N151 F186 R187 I188 T189	L147-T164 HydrophobicContact CD1-CG2 4.07Å; L147-T164 HydrophobicContact CD2-CG2 4.04Å; L147-T164 WeakPolarHBondContact CD2-OG1 3.47Å; L147-T164 HydrophobicContact CG-CG2 3.95Å; M148-T164 VanDerWaalsContact C-OG1 3.31Å; M148-T164 PolarHBondContact O-OG1 2.9Å; N151-T164 VanDerWaalsContact ND2-CB 3.33Å; N151-T164 WeakPolarHBondContact ND2-CB 3.4Å; N151-T164 PolarHBondContact ND2-OG1 3.44Å; T164-F186 HydrophobicContact CG2-CD1 4.27Å; T164-F186 HydrophobicContact CG2-CE1 3.43Å; T164-F186 VanDerWaalsContact CG2-CE1 3.43Å; T164-F186 HydrophobicContact CG2-CE2 4.14Å; T164-F186 HydrophobicContact CG2-CZ 3.35Å; T164-R187 PolarHBondContact N-O 3.48Å; T164-I188 HydrophobicContact CG2-CD1 4.23Å; T164-I188 HydrophobicContact CG2-CG1 3.8Å; T164-I188 WeakPolarHBondContact O-CA 3.41Å; T164-T189 PolarHBondContact O-N 2.83Å; T164-T189 VanDerWaalsContact O-N 3.09Å
165	T	98.9	Very high	97.8	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.6	175.9	-47.6	0	0	0	0	110.1	L147 M148 T189 V191 V197 E254 S255 C256	L147-T165 WeakPolarHBondContact CA-O 3.45Å; M148-T165 PolarHBondContact N-O 3.41Å; M148-T165 WeakPolarHBondContact O-CA 3.21Å; M148-T165 PolarHBondContact O-N 3.41Å; M148-T165 VanDerWaalsContact O-O 3.07Å; T165-T189 CarbonylContact C-O 3.53Å; T165-T189 WeakPolarHBondContact CA-O 3.26Å; T165-V191 HydrophobicContact CG2-CG1 4.09Å; T165-V191 HydrophobicContact CG2-CG2 3.68Å; T165-V197 HydrophobicContact CG2-CG1 4.26Å; T165-V197 HydrophobicContact CG2-CG2 3.91Å; T165-E254 HydrophobicContact CG2-CB 4.15Å; T165-E254 HydrophobicContact CG2-CG 4.47Å; T165-E254 WeakPolarHBondContact OG1-CB 3.43Å; T165-S255 PolarHBondContact OG1-N 3.18Å; T165-C256 PolarHBondContact OG1-N 3.46Å; T165-C256 VanDerWaalsContact OG1-N 3.17Å
166	I	98.9	Very high	98	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.2	166.8	-70.8	-178.8	0	0	0	108.6	M116 V146 L147 C168 L177 M181 I188 T189 V190 V191	M116-I166 HydrophobicContact SD-CD1 4.19Å; M116-I166 HydrophobicContact SD-CG1 4.44Å; V146-I166 CarbonylContact O-C 3.52Å; V146-I166 VanDerWaalsContact O-CA 3.24Å; V146-I166 WeakPolarHBondContact O-CA 3.36Å; L147-I166 HydrophobicContact CB-CG1 4.21Å; L147-I166 HydrophobicContact CD1-CD1 4.27Å; L147-I166 HydrophobicContact CD1-CG1 4.03Å; L147-I166 HydrophobicContact CG-CG1 4.13Å; I166-C168 HydrophobicContact CG2-CB 4.1Å; I166-L177 HydrophobicContact CD1-CB 4.03Å; I166-M181 HydrophobicContact CD1-CG 4.49Å; I166-I188 HydrophobicContact CB-CG2 4.21Å; I166-I188 HydrophobicContact CD1-CD1 4.12Å; I166-I188 HydrophobicContact CD1-CG2 3.69Å; I166-I188 HydrophobicContact CG1-CG2 3.72Å; I166-T189 PolarHBondContact N-O 3.03Å; I166-V190 HydrophobicContact CB-CG2 4.27Å; I166-V190 HydrophobicContact CG2-CG1 4.49Å; I166-V190 CarbonylContact O-C 3.55Å; I166-V190 WeakPolarHBondContact O-CA 3.31Å; I166-V191 PolarHBondContact O-N 2.77Å
167	G	98.4	Very high	98.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	116.5	166.4	0	0	0	0	0	109.8	S145 V146 V191	S145-G167 CarbonylContact C-O 3.56Å; S145-G167 VanDerWaalsContact CA-O 3.25Å; S145-G167 WeakPolarHBondContact CA-O 3.36Å; S145-G167 VanDerWaalsContact CB-O 3.29Å; S145-G167 WeakPolarHBondContact CB-O 3.44Å; V146-G167 PolarHBondContact N-O 3.29Å; V146-G167 PolarHBondContact O-N 3.17Å; G167-V191 CarbonylContact C-O 3.59Å; G167-V191 WeakPolarHBondContact CA-O 3.35Å
168	C	98.6	Very high	98.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.014	27%	0.272	C	S	.	.			trans	-150.2	124.3	176.5	-175	0	0	0	0	111.6	S145 I166 D170 G174 V190 V191 Q192	S145-C168 PolarHBondContact OG-SG 3.25Å; I166-C168 HydrophobicContact CG2-CB 4.1Å; C168-D170 PolarHBondContact SG-O 3.09Å; C168-G174 PolarHBondContact SG-N 3.18Å; C168-G174 VanDerWaalsContact SG-N 3.44Å; C168-V190 HydrophobicContact CB-CG1 4.49Å; C168-V191 PolarHBondContact N-O 3.21Å; C168-Q192 WeakPolarHBondContact O-CA 3.36Å
169	K	97.1	Very high	98.3	Very high	140 Å²	140	53.2 Å²	53.2	61%	0.609	27%	0.267	S	S	*	.	S	Bend	trans	-68.7	-41.1	-179.2	-65.3	179.3	-177.2	174.6	0	112.6	P171 V194	K169-P171 WeakPolarHBondContact O-CD 3.49Å; K169-V194 HydrophobicContact CG-CG2 3.8Å
170	D	98	Very high	98.4	Very high	77 Å²	77	47.1 Å²	47.1	41%	0.412	24%	0.238	S	C	.	.	S	Bend	trans	-82.9	118.1	177.3	172.7	16.8	0	0	0	110.5	C168 A172 Q173 G174	C168-D170 PolarHBondContact SG-O 3.09Å; D170-A172 VanDerWaalsContact C-N 3.3Å; D170-A172 PolarHBondContact O-N 3.09Å; D170-A172 PolarHBondContact OD1-N 3.17Å; D170-Q173 HydrophobicContact CB-CB 3.93Å; D170-Q173 PolarHBondContact O-N 3.32Å; D170-Q173 WeakPolarHBondContact OD2-CB 3.42Å; D170-Q173 PolarHBondContact OD2-N 3.27Å; D170-G174 PolarHBondContact O-N 3Å
171	P	97.3	Very high	98.4	Very high	82 Å²	82	42.2 Å²	42.2	53%	0.532	22%	0.217	S	C	.	.	H	α-helix	trans	-59.7	-35.8	178	-23.7	34.7	0	0	0	113.9	K169 G174 Q175	K169-P171 WeakPolarHBondContact O-CD 3.49Å; P171-G174 PolarHBondContact O-N 3.47Å; P171-Q175 PolarHBondContact O-N 2.98Å
172	A	97.9	Very high	98.4	Very high	70 Å²	70	38 Å²	38	58%	0.579	20%	0.199	S	C	*	.	H	α-helix	trans	-69.3	-46.1	-178.7	0	0	0	0	0	110.8	D170 G174 Q175 L176	D170-A172 VanDerWaalsContact C-N 3.3Å; D170-A172 PolarHBondContact O-N 3.09Å; D170-A172 PolarHBondContact OD1-N 3.17Å; A172-G174 VanDerWaalsContact C-N 3.33Å; A172-G174 PolarHBondContact O-N 3.07Å; A172-Q175 PolarHBondContact O-N 3.26Å; A172-L176 PolarHBondContact O-N 2.86Å
173	Q	98.1	Very high	98.5	Very high	21 Å²	21	38.6 Å²	38.6	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-40.9	171.2	177.8	172.4	-24.3	0	0	112.2	I114 S145 D170 Q175 L176 L177	I114-Q173 HydrophobicContact CD1-CG 3.64Å; S145-Q173 PolarHBondContact OG-NE2 3.47Å; D170-Q173 HydrophobicContact CB-CB 3.93Å; D170-Q173 PolarHBondContact O-N 3.32Å; D170-Q173 WeakPolarHBondContact OD2-CB 3.42Å; D170-Q173 PolarHBondContact OD2-N 3.27Å; Q173-Q175 VanDerWaalsContact C-N 3.35Å; Q173-Q175 PolarHBondContact O-N 3.28Å; Q173-L176 WeakPolarHBondContact O-CB 3.44Å; Q173-L176 PolarHBondContact O-N 3.2Å; Q173-L177 HydrophobicContact CG-CD1 3.96Å; Q173-L177 HydrophobicContact CG-CG 4.34Å; Q173-L177 WeakPolarHBondContact O-CG 3.35Å; Q173-L177 PolarHBondContact O-N 3.41Å
174	G	98.6	Very high	98.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-43.5	178.2	0	0	0	0	0	112.5	C168 D170 P171 A172 L177 K178	C168-G174 PolarHBondContact SG-N 3.18Å; C168-G174 VanDerWaalsContact SG-N 3.44Å; D170-G174 PolarHBondContact O-N 3Å; P171-G174 PolarHBondContact O-N 3.47Å; A172-G174 VanDerWaalsContact C-N 3.33Å; A172-G174 PolarHBondContact O-N 3.07Å; G174-L177 PolarHBondContact O-N 2.96Å; G174-K178 WeakPolarHBondContact O-CB 3.3Å; G174-K178 PolarHBondContact O-N 2.9Å
175	Q	98.6	Very high	98.5	Very high	91 Å²	91	42 Å²	42	43%	0.425	23%	0.23	S	C	.	.	H	α-helix	trans	-66.3	-41.2	175.4	-177.8	55.9	34.9	0	0	112	P171 A172 Q173 L177 K178 E179	P171-Q175 PolarHBondContact O-N 2.98Å; A172-Q175 PolarHBondContact O-N 3.26Å; Q173-Q175 VanDerWaalsContact C-N 3.35Å; Q173-Q175 PolarHBondContact O-N 3.28Å; Q175-L177 PolarHBondContact O-N 3.33Å; Q175-K178 WeakPolarHBondContact O-CB 3.19Å; Q175-K178 PolarHBondContact O-N 3.27Å; Q175-E179 PolarHBondContact NE2-OE1 2.79Å; Q175-E179 WeakPolarHBondContact O-CG 3.34Å; Q175-E179 PolarHBondContact O-N 3.23Å
176	L	98.7	Very high	98.5	Very high	38 Å²	38	42.1 Å²	42.1	20%	0.199	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-47.6	174.7	-179.2	70.9	0	0	0	111.6	F32 I88 I114 A172 Q173 K178 E179 L180	F32-L176 HydrophobicContact CE1-CD1 3.71Å; F32-L176 HydrophobicContact CE1-CG 4.17Å; F32-L176 HydrophobicContact CZ-CD1 3.67Å; F32-L176 HydrophobicContact CZ-CG 4.23Å; F32-L176 WeakPolarHBondContact CZ-O 3.45Å; I88-L176 HydrophobicContact CD1-CD2 4.01Å; I88-L176 HydrophobicContact CD1-CG 4.36Å; I114-L176 HydrophobicContact CD1-CD2 4.32Å; A172-L176 PolarHBondContact O-N 2.86Å; Q173-L176 WeakPolarHBondContact O-CB 3.44Å; Q173-L176 PolarHBondContact O-N 3.2Å; L176-K178 VanDerWaalsContact C-N 3.33Å; L176-K178 PolarHBondContact O-N 3.05Å; L176-E179 PolarHBondContact O-N 3.45Å; L176-L180 PolarHBondContact O-N 2.9Å
177	L	98.9	Very high	98.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-35.8	178.3	-67.8	172	0	0	0	111.8	I88 M116 S145 I166 Q173 G174 Q175 L180 M181	I88-L177 HydrophobicContact CG2-CD2 3.96Å; M116-L177 HydrophobicContact CB-CD1 4.43Å; M116-L177 HydrophobicContact CB-CD2 4.38Å; M116-L177 HydrophobicContact CE-CD2 4.12Å; M116-L177 HydrophobicContact SD-CB 4.31Å; M116-L177 HydrophobicContact SD-CD1 4.03Å; M116-L177 HydrophobicContact SD-CD2 4.16Å; M116-L177 HydrophobicContact SD-CG 4.41Å; S145-L177 VanDerWaalsContact CB-CD1 3.47Å; S145-L177 VanDerWaalsContact OG-CD1 3.23Å; S145-L177 WeakPolarHBondContact OG-CD1 3.04Å; I166-L177 HydrophobicContact CD1-CB 4.03Å; Q173-L177 HydrophobicContact CG-CD1 3.96Å; Q173-L177 HydrophobicContact CG-CG 4.34Å; Q173-L177 WeakPolarHBondContact O-CG 3.35Å; Q173-L177 PolarHBondContact O-N 3.41Å; G174-L177 PolarHBondContact O-N 2.96Å; Q175-L177 PolarHBondContact O-N 3.33Å; L177-L180 PolarHBondContact O-N 3.42Å; L177-M181 WeakPolarHBondContact O-CB 3.12Å; L177-M181 WeakPolarHBondContact O-CG 3.39Å; L177-M181 PolarHBondContact O-N 2.83Å
178	K	98.8	Very high	98.5	Very high	51 Å²	51	47.1 Å²	47.1	22%	0.222	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-44.7	172.9	172.9	166.5	178.4	157.1	0	111.9	G174 Q175 L176 L180 M181 Q182 I188 V190	G174-K178 WeakPolarHBondContact O-CB 3.3Å; G174-K178 PolarHBondContact O-N 2.9Å; Q175-K178 WeakPolarHBondContact O-CB 3.19Å; Q175-K178 PolarHBondContact O-N 3.27Å; L176-K178 VanDerWaalsContact C-N 3.33Å; L176-K178 PolarHBondContact O-N 3.05Å; K178-L180 VanDerWaalsContact C-N 3.32Å; K178-L180 PolarHBondContact O-N 3.27Å; K178-M181 PolarHBondContact O-N 3.13Å; K178-Q182 HydrophobicContact CG-CB 4.38Å; K178-Q182 WeakPolarHBondContact O-CB 3.4Å; K178-Q182 PolarHBondContact O-N 2.87Å; K178-I188 HydrophobicContact CB-CG2 4.36Å; K178-I188 HydrophobicContact CD-CB 4.46Å; K178-I188 HydrophobicContact CD-CG2 4.46Å; K178-I188 WeakPolarHBondContact CE-O 3.48Å; K178-I188 HydrophobicContact CG-CB 4.17Å; K178-I188 HydrophobicContact CG-CG2 4.24Å; K178-I188 PolarHBondContact NZ-O 2.95Å; K178-V190 HydrophobicContact CB-CG2 3.86Å; K178-V190 HydrophobicContact CD-CG2 3.92Å; K178-V190 HydrophobicContact CG-CG2 4.46Å
179	E	98.8	Very high	98.5	Very high	65 Å²	65	49.9 Å²	49.9	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-39.5	176.4	-73.3	167.4	-163.2	0	0	112.1	L29 Q31 F32 Q175 L176 M181	L29-E179 WeakPolarHBondContact CD1-O 3.38Å; Q31-E179 PolarHBondContact NE2-OE2 3.45Å; F32-E179 HydrophobicContact CE2-CB 4.24Å; F32-E179 HydrophobicContact CZ-CB 4.46Å; Q175-E179 PolarHBondContact NE2-OE1 2.79Å; Q175-E179 WeakPolarHBondContact O-CG 3.34Å; Q175-E179 PolarHBondContact O-N 3.23Å; L176-E179 PolarHBondContact O-N 3.45Å; E179-M181 VanDerWaalsContact C-N 3.31Å; E179-M181 PolarHBondContact O-N 3.05Å
180	L	98.9	Very high	98.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-36.2	177.1	-175.3	57.3	0	0	0	112.7	V6 V22 N25 F32 I88 I90 L176 L177 K178	V6-L180 HydrophobicContact CG1-CD2 4.08Å; V6-L180 HydrophobicContact CG2-CD1 4.06Å; V6-L180 HydrophobicContact CG2-CD2 3.96Å; V22-L180 HydrophobicContact CG1-CD1 4.05Å; V22-L180 HydrophobicContact CG1-CG 4.45Å; N25-L180 WeakPolarHBondContact CB-O 3.39Å; N25-L180 PolarHBondContact ND2-O 3.49Å; F32-L180 HydrophobicContact CD1-CD1 3.88Å; F32-L180 HydrophobicContact CD2-CD1 3.99Å; F32-L180 HydrophobicContact CE1-CB 4Å; F32-L180 HydrophobicContact CE1-CD1 3.97Å; F32-L180 HydrophobicContact CE1-CD2 4.35Å; F32-L180 HydrophobicContact CE1-CG 4.33Å; F32-L180 HydrophobicContact CE2-CB 3.98Å; F32-L180 HydrophobicContact CE2-CD1 4.06Å; F32-L180 HydrophobicContact CG-CD1 3.92Å; F32-L180 HydrophobicContact CZ-CB 3.58Å; F32-L180 HydrophobicContact CZ-CD1 4.08Å; F32-L180 HydrophobicContact CZ-CG 4.33Å; I88-L180 HydrophobicContact CD1-CD2 4.11Å; I88-L180 HydrophobicContact CG2-CD2 4.18Å; I90-L180 HydrophobicContact CD1-CD2 4.16Å; L176-L180 PolarHBondContact O-N 2.9Å; L177-L180 PolarHBondContact O-N 3.42Å; K178-L180 VanDerWaalsContact C-N 3.32Å; K178-L180 PolarHBondContact O-N 3.27Å
181	M	98.8	Very high	98.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-104.1	-25.3	-167.6	-64.4	-59.4	-68.7	0	0	114.1	I18 I21 V22 I90 M116 L118 L147 I166 L177 K178 E179 F186 I188	I18-M181 HydrophobicContact CD1-CE 3.56Å; I18-M181 HydrophobicContact CG2-CE 4.01Å; I21-M181 WeakPolarHBondContact CG2-O 3.23Å; V22-M181 HydrophobicContact CG2-CE 4.34Å; V22-M181 HydrophobicContact CG2-SD 3.49Å; V22-M181 WeakPolarHBondContact CG2-SD 3.33Å; I90-M181 HydrophobicContact CD1-SD 4.06Å; M116-M181 HydrophobicContact CE-CE 4.32Å; M116-M181 HydrophobicContact CE-CG 3.76Å; M116-M181 HydrophobicContact CE-SD 3.85Å; L118-M181 HydrophobicContact CD2-CE 4.46Å; L147-M181 HydrophobicContact CD1-CB 4.4Å; L147-M181 HydrophobicContact CD1-CE 3.57Å; L147-M181 HydrophobicContact CD1-CG 4.16Å; I166-M181 HydrophobicContact CD1-CG 4.49Å; L177-M181 WeakPolarHBondContact O-CB 3.12Å; L177-M181 WeakPolarHBondContact O-CG 3.39Å; L177-M181 PolarHBondContact O-N 2.83Å; K178-M181 PolarHBondContact O-N 3.13Å; E179-M181 VanDerWaalsContact C-N 3.31Å; E179-M181 PolarHBondContact O-N 3.05Å; M181-F186 WeakPolarHBondContact O-CD1 3.4Å; M181-I188 HydrophobicContact CB-CD1 3.26Å
182	Q	98.8	Very high	98.6	Very high	48 Å²	48	44.8 Å²	44.8	22%	0.224	24%	0.239	C	C	.	.			trans	-76.6	140.9	-170.9	-173.5	172.9	-102.9	0	0	111.5	N25 K178 F186 I188	N25-Q182 PolarHBondContact ND2-O 3.46Å; K178-Q182 HydrophobicContact CG-CB 4.38Å; K178-Q182 WeakPolarHBondContact O-CB 3.4Å; K178-Q182 PolarHBondContact O-N 2.87Å; Q182-F186 WeakPolarHBondContact CA-O 3.35Å; Q182-F186 WeakPolarHBondContact CG-O 3.42Å; Q182-I188 HydrophobicContact CB-CB 4.47Å; Q182-I188 HydrophobicContact CB-CD1 3.93Å; Q182-I188 HydrophobicContact CB-CG1 4.01Å; Q182-I188 HydrophobicContact CG-CG1 4.32Å
183	T	98.8	Very high	98.6	Very high	32 Å²	32	43.5 Å²	43.5	20%	0.196	22%	0.221	C	C	.	.			trans	-129.7	177.1	169.2	79.4	0	0	0	0	109.9	I21 N185 F186 R187	I21-T183 HydrophobicContact CB-CG2 4.38Å; I21-T183 HydrophobicContact CG1-CG2 4.07Å; I21-T183 HydrophobicContact CG2-CG2 3.72Å; T183-N185 PolarHBondContact O-N 3.01Å; T183-N185 PolarHBondContact OG1-N 3.2Å; T183-F186 HydrophobicContact CG2-CB 4.3Å; T183-F186 PolarHBondContact N-O 2.65Å; T183-F186 VanDerWaalsContact OG1-CB 3.3Å; T183-F186 WeakPolarHBondContact OG1-CB 3.31Å; T183-F186 PolarHBondContact OG1-N 2.95Å; T183-R187 WeakPolarHBondContact O-CD 3.44Å; T183-R187 PolarHBondContact O-NH1 2.77Å
184	P	98.6	Very high	98.5	Very high	106 Å²	106	42.7 Å²	42.7	69%	0.688	22%	0.218	S	C	*	.	S	Bend	trans	-57.7	-33.2	170.1	-27.2	37.4	0	0	0	113.5	R187	P184-R187 VanDerWaalsContact O-CD 3.28Å; P184-R187 WeakPolarHBondContact O-CD 3.36Å
185	N	98.3	Very high	98.4	Very high	60 Å²	60	43.1 Å²	43.1	32%	0.321	22%	0.22	S	C	.	.	S	Bend	trans	-108.1	-2.5	-176.6	-66.4	-33.6	0	0	0	114	E159 F161 C162 T183	E159-N185 WeakPolarHBondContact O-CB 3.32Å; E159-N185 PolarHBondContact O-ND2 3.24Å; F161-N185 CarbonylContact C-O 3.52Å; F161-N185 WeakPolarHBondContact CA-O 3.34Å; C162-N185 PolarHBondContact N-O 3.12Å; C162-N185 VanDerWaalsContact O-O 3.07Å; T183-N185 PolarHBondContact O-N 3.01Å; T183-N185 PolarHBondContact OG1-N 3.2Å
186	F	98.7	Very high	98.4	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	87.4	173.9	-167.9	-106.9	0	0	0	108.6	W14 I21 L147 N151 V156 T164 M181 Q182 T183 I188	W14-F186 HydrophobicContact CH2-CE2 4.1Å; W14-F186 HydrophobicContact CH2-CZ 4.21Å; W14-F186 HydrophobicContact CZ2-CZ 4.5Å; I21-F186 HydrophobicContact CD1-CB 4.2Å; I21-F186 HydrophobicContact CD1-CD1 3.99Å; I21-F186 HydrophobicContact CD1-CD2 4.34Å; I21-F186 HydrophobicContact CD1-CE1 4.41Å; I21-F186 HydrophobicContact CD1-CG 3.92Å; L147-F186 HydrophobicContact CD1-CE1 4.29Å; L147-F186 HydrophobicContact CD2-CZ 4.25Å; N151-F186 HydrophobicContact CB-CE2 4.27Å; V156-F186 HydrophobicContact CG1-CD2 4.18Å; V156-F186 HydrophobicContact CG1-CE2 4.43Å; V156-F186 HydrophobicContact CG2-CD2 4.26Å; V156-F186 HydrophobicContact CG2-CE2 4.22Å; T164-F186 HydrophobicContact CG2-CD1 4.27Å; T164-F186 HydrophobicContact CG2-CE1 3.43Å; T164-F186 VanDerWaalsContact CG2-CE1 3.43Å; T164-F186 HydrophobicContact CG2-CE2 4.14Å; T164-F186 HydrophobicContact CG2-CZ 3.35Å; M181-F186 WeakPolarHBondContact O-CD1 3.4Å; Q182-F186 WeakPolarHBondContact CA-O 3.35Å; Q182-F186 WeakPolarHBondContact CG-O 3.42Å; T183-F186 HydrophobicContact CG2-CB 4.3Å; T183-F186 PolarHBondContact N-O 2.65Å; T183-F186 VanDerWaalsContact OG1-CB 3.3Å; T183-F186 WeakPolarHBondContact OG1-CB 3.31Å; T183-F186 PolarHBondContact OG1-N 2.95Å; F186-I188 HydrophobicContact CD1-CD1 4.21Å; F186-I188 HydrophobicContact CD1-CG1 4.3Å; F186-I188 HydrophobicContact CE1-CD1 4.18Å; F186-I188 HydrophobicContact CE1-CG1 4.42Å
187	R	98.8	Very high	98.4	Very high	100 Å²	100	37 Å²	37	38%	0.377	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	143.3	-172.6	-54.5	-52.9	-60.7	170.1	-8.4	111.2	F161 C162 E163 T164 T183 P184	F161-R187 HydrophobicContact CD2-CG 4.49Å; F161-R187 HydrophobicContact CE2-CG 3.64Å; F161-R187 HydrophobicContact CZ-CG 4.18Å; C162-R187 PolarHBondContact O-N 3.4Å; E163-R187 CarbonylContact C-O 3.55Å; E163-R187 WeakPolarHBondContact CA-O 3.48Å; E163-R187 HydrophobicContact CB-CB 4.16Å; T164-R187 PolarHBondContact N-O 3.48Å; T183-R187 WeakPolarHBondContact O-CD 3.44Å; T183-R187 PolarHBondContact O-NH1 2.77Å; P184-R187 VanDerWaalsContact O-CD 3.28Å; P184-R187 WeakPolarHBondContact O-CD 3.36Å
188	I	98.8	Very high	98.3	Very high	4 Å²	4	37 Å²	37	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.2	-171.6	-55.9	-170.5	0	0	0	111.8	T164 I166 K178 M181 Q182 F186 V190	T164-I188 HydrophobicContact CG2-CD1 4.23Å; T164-I188 HydrophobicContact CG2-CG1 3.8Å; T164-I188 WeakPolarHBondContact O-CA 3.41Å; I166-I188 HydrophobicContact CB-CG2 4.21Å; I166-I188 HydrophobicContact CD1-CD1 4.12Å; I166-I188 HydrophobicContact CD1-CG2 3.69Å; I166-I188 HydrophobicContact CG1-CG2 3.72Å; K178-I188 HydrophobicContact CB-CG2 4.36Å; K178-I188 HydrophobicContact CD-CB 4.46Å; K178-I188 HydrophobicContact CD-CG2 4.46Å; K178-I188 WeakPolarHBondContact CE-O 3.48Å; K178-I188 HydrophobicContact CG-CB 4.17Å; K178-I188 HydrophobicContact CG-CG2 4.24Å; K178-I188 PolarHBondContact NZ-O 2.95Å; M181-I188 HydrophobicContact CB-CD1 3.26Å; Q182-I188 HydrophobicContact CB-CB 4.47Å; Q182-I188 HydrophobicContact CB-CD1 3.93Å; Q182-I188 HydrophobicContact CB-CG1 4.01Å; Q182-I188 HydrophobicContact CG-CG1 4.32Å; F186-I188 HydrophobicContact CD1-CD1 4.21Å; F186-I188 HydrophobicContact CD1-CG1 4.3Å; F186-I188 HydrophobicContact CE1-CD1 4.18Å; F186-I188 HydrophobicContact CE1-CG1 4.42Å; I188-V190 HydrophobicContact CG2-CG2 4.3Å
189	T	98.8	Very high	98.2	Very high	61 Å²	61	34.6 Å²	34.6	37%	0.374	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.5	162.4	-57.6	0	0	0	0	109.3	T164 T165 I166 V191 E254	T164-T189 PolarHBondContact O-N 2.83Å; T164-T189 VanDerWaalsContact O-N 3.09Å; T165-T189 CarbonylContact C-O 3.53Å; T165-T189 WeakPolarHBondContact CA-O 3.26Å; I166-T189 PolarHBondContact N-O 3.03Å; T189-V191 HydrophobicContact CG2-CG1 4.14Å; T189-E254 WeakPolarHBondContact CG2-OE2 3.4Å
190	V	98.7	Very high	98.2	Very high	47 Å²	47	31.5 Å²	31.5	29%	0.285	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.3	175.5	-179.4	0	0	0	0	108.1	I166 C168 K178 I188	I166-V190 HydrophobicContact CB-CG2 4.27Å; I166-V190 HydrophobicContact CG2-CG1 4.49Å; I166-V190 CarbonylContact O-C 3.55Å; I166-V190 WeakPolarHBondContact O-CA 3.31Å; C168-V190 HydrophobicContact CB-CG1 4.49Å; K178-V190 HydrophobicContact CB-CG2 3.86Å; K178-V190 HydrophobicContact CD-CG2 3.92Å; K178-V190 HydrophobicContact CG-CG2 4.46Å; I188-V190 HydrophobicContact CG2-CG2 4.3Å
191	V	98.1	Very high	97.9	Very high	21 Å²	21	31.5 Å²	31.5	13%	0.127	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	159	175.7	-55.1	0	0	0	0	109.9	T165 I166 G167 C168 T189 V197 T251 E254	T165-V191 HydrophobicContact CG2-CG1 4.09Å; T165-V191 HydrophobicContact CG2-CG2 3.68Å; I166-V191 PolarHBondContact O-N 2.77Å; G167-V191 CarbonylContact C-O 3.59Å; G167-V191 WeakPolarHBondContact CA-O 3.35Å; C168-V191 PolarHBondContact N-O 3.21Å; T189-V191 HydrophobicContact CG2-CG1 4.14Å; V191-V197 HydrophobicContact CG2-CG2 3.22Å; V191-T251 HydrophobicContact CG2-CG2 4.41Å; V191-E254 HydrophobicContact CG1-CG 4.25Å
192	Q	97.6	Very high	97.6	Very high	124 Å²	124	31.5 Å²	31.5	58%	0.579	17%	0.166	S	C	*	.	S	Bend	trans	-91.6	-16.1	-175.6	-65.9	179.5	0.1	0	0	113.8	C168 V194	C168-Q192 WeakPolarHBondContact O-CA 3.36Å; Q192-V194 VanDerWaalsContact C-N 3.29Å; Q192-V194 PolarHBondContact O-N 3.36Å
193	E	97.7	Very high	97.5	Very high	42 Å²	42	29.2 Å²	29.2	20%	0.196	16%	0.155	C	C	.	.			trans	-81.5	68.1	-176.3	-62.9	176.3	83.2	0	0	111.6	D195 T196 V197 P246 V247 S248 T251	E193-D195 PolarHBondContact O-N 2.92Å; E193-T196 PolarHBondContact O-N 2.81Å; E193-V197 WeakPolarHBondContact O-CG2 3.43Å; E193-V197 PolarHBondContact O-N 2.8Å; E193-P246 HydrophobicContact CG-CG 4.38Å; E193-V247 WeakPolarHBondContact OE1-CA 3.37Å; E193-S248 WeakPolarHBondContact OE1-CB 3.32Å; E193-S248 PolarHBondContact OE1-N 2.96Å; E193-S248 WeakPolarHBondContact OE2-CB 3.46Å; E193-T251 HydrophobicContact CB-CG2 4.44Å; E193-T251 VanDerWaalsContact CD-OG1 3.25Å; E193-T251 PolarHBondContact OE1-OG1 3.25Å; E193-T251 PolarHBondContact OE2-OG1 2.89Å
194	V	97.7	Very high	97.4	Very high	5 Å²	5	28.3 Å²	28.3	3%	0.03	15%	0.148	C	C	.	.	H	α-helix	trans	-48.6	-53.8	-177.3	178.8	0	0	0	0	112	V146 K169 Q192 T196 V197 E198	V146-V194 HydrophobicContact CG1-CG1 4.03Å; V146-V194 HydrophobicContact CG2-CG1 4.06Å; K169-V194 HydrophobicContact CG-CG2 3.8Å; Q192-V194 VanDerWaalsContact C-N 3.29Å; Q192-V194 PolarHBondContact O-N 3.36Å; V194-T196 VanDerWaalsContact C-N 3.31Å; V194-T196 PolarHBondContact O-N 3.35Å; V194-V197 PolarHBondContact O-N 3.36Å; V194-E198 PolarHBondContact O-N 3.45Å
195	D	96.7	Very high	97.3	Very high	9 Å²	9	23.6 Å²	23.6	5%	0.048	12%	0.117	C	C	.	.	H	α-helix	trans	-58.6	-44.4	-176.2	-52.6	13.7	0	0	0	111.3	L131 E193 E198 I199 C243 S244 G245	L131-D195 HydrophobicContact CD1-CB 3.68Å; E193-D195 PolarHBondContact O-N 2.92Å; D195-E198 PolarHBondContact O-N 3.09Å; D195-I199 WeakPolarHBondContact O-CB 3.48Å; D195-I199 WeakPolarHBondContact O-CG2 3.33Å; D195-I199 PolarHBondContact O-N 3.06Å; D195-C243 HydrophobicContact CB-CB 3.96Å; D195-S244 PolarHBondContact OD2-N 3.26Å; D195-G245 PolarHBondContact OD2-N 3.03Å
196	T	97.9	Very high	97.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.7	-41.4	179.3	-52.1	0	0	0	0	111.8	E193 V194 I199 C200 P246 V247 T251 F252	E193-T196 PolarHBondContact O-N 2.81Å; V194-T196 VanDerWaalsContact C-N 3.31Å; V194-T196 PolarHBondContact O-N 3.35Å; T196-I199 WeakPolarHBondContact O-CG2 3.41Å; T196-C200 PolarHBondContact O-N 3.41Å; T196-C200 PolarHBondContact O-SG 3.1Å; T196-P246 PolarHBondContact OG1-O 2.97Å; T196-V247 HydrophobicContact CG2-CG1 4.03Å; T196-T251 HydrophobicContact CG2-CG2 3.71Å; T196-F252 HydrophobicContact CG2-CD2 4.23Å; T196-F252 HydrophobicContact CG2-CE2 3.55Å; T196-F252 HydrophobicContact CG2-CZ 3.88Å
197	V	98.3	Very high	97.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.5	-44.9	175.9	173.6	0	0	0	0	110.9	V146 M148 T165 V191 E193 V194 T251 C256	V146-V197 HydrophobicContact CG2-CB 3.93Å; V146-V197 HydrophobicContact CG2-CG1 3.67Å; M148-V197 HydrophobicContact CB-CG1 3.82Å; M148-V197 HydrophobicContact CG-CG1 3.95Å; M148-V197 WeakPolarHBondContact CG-O 3.41Å; T165-V197 HydrophobicContact CG2-CG1 4.26Å; T165-V197 HydrophobicContact CG2-CG2 3.91Å; V191-V197 HydrophobicContact CG2-CG2 3.22Å; E193-V197 WeakPolarHBondContact O-CG2 3.43Å; E193-V197 PolarHBondContact O-N 2.8Å; V194-V197 PolarHBondContact O-N 3.36Å; V197-T251 HydrophobicContact CG2-CG2 3.89Å; V197-C256 HydrophobicContact CG1-CB 3.9Å
198	E	97.8	Very high	97.2	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-67.1	-47.7	-177.1	-169.7	167.5	-168.5	0	0	112.4	L131 I132 S133 V146 M148 V194 D195 C200 G201	L131-E198 WeakPolarHBondContact CB-OE2 3.48Å; L131-E198 HydrophobicContact CD1-CB 4.45Å; L131-E198 HydrophobicContact CD2-CB 4.49Å; L131-E198 HydrophobicContact CD2-CG 4.31Å; I132-E198 PolarHBondContact N-OE1 3.39Å; S133-E198 WeakPolarHBondContact CB-OE2 3.47Å; S133-E198 PolarHBondContact N-OE1 2.97Å; S133-E198 PolarHBondContact OG-OE2 3.33Å; V146-E198 HydrophobicContact CG1-CB 4.1Å; V146-E198 HydrophobicContact CG1-CG 4.15Å; V146-E198 HydrophobicContact CG2-CB 4.29Å; M148-E198 HydrophobicContact CE-CG 3.92Å; V194-E198 PolarHBondContact O-N 3.45Å; D195-E198 PolarHBondContact O-N 3.09Å; E198-C200 VanDerWaalsContact C-N 3.26Å; E198-C200 PolarHBondContact O-N 3.48Å; E198-G201 PolarHBondContact O-N 3.04Å; E198-G201 VanDerWaalsContact O-N 3.13Å
199	I	96.7	Very high	97.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.1	-32.9	-176.5	-163	58.4	0	0	0	111.7	I122 L129 L131 D195 T196 G201 A202 L203 F238 A239	I122-I199 HydrophobicContact CG2-CD1 3.45Å; I122-I199 VanDerWaalsContact CG2-CD1 3.45Å; L129-I199 HydrophobicContact CD1-CD1 3.98Å; L129-I199 HydrophobicContact CD2-CD1 3.93Å; L131-I199 HydrophobicContact CD2-CB 4.29Å; L131-I199 HydrophobicContact CD2-CD1 4.01Å; D195-I199 WeakPolarHBondContact O-CB 3.48Å; D195-I199 WeakPolarHBondContact O-CG2 3.33Å; D195-I199 PolarHBondContact O-N 3.06Å; T196-I199 WeakPolarHBondContact O-CG2 3.41Å; I199-G201 VanDerWaalsContact C-N 3.31Å; I199-G201 PolarHBondContact O-N 3.3Å; I199-A202 PolarHBondContact O-N 2.62Å; I199-L203 HydrophobicContact CD1-CD1 4.47Å; I199-L203 HydrophobicContact CD1-CD2 4.36Å; I199-L203 HydrophobicContact CD1-CG 4.17Å; I199-L203 HydrophobicContact CG1-CD1 3.8Å; I199-L203 HydrophobicContact CG1-CG 3.94Å; I199-L203 WeakPolarHBondContact O-CG 3.36Å; I199-L203 PolarHBondContact O-N 3.28Å; I199-F238 HydrophobicContact CD1-CE1 4.24Å; I199-F238 HydrophobicContact CG1-CD1 4.34Å; I199-A239 HydrophobicContact CG2-CB 3.83Å
200	C	97.3	Very high	97.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58	-44.4	175.3	-72	0	0	0	0	111.9	T196 E198 A202 K204 M235 F252 C256	T196-C200 PolarHBondContact O-N 3.41Å; T196-C200 PolarHBondContact O-SG 3.1Å; E198-C200 VanDerWaalsContact C-N 3.26Å; E198-C200 PolarHBondContact O-N 3.48Å; C200-A202 PolarHBondContact O-N 2.82Å; C200-K204 WeakPolarHBondContact O-CB 3.28Å; C200-K204 WeakPolarHBondContact O-CG 3.44Å; C200-K204 PolarHBondContact O-N 3.44Å; C200-M235 HydrophobicContact CB-CE 4.21Å; C200-F252 VanDerWaalsContact SG-CD1 3.51Å; C200-F252 WeakPolarHBondContact SG-CE1 3.27Å; C200-C256 WeakPolarHBondContact CB-O 3.48Å
201	G	92.7	Very high	97.2	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.1	-28.8	-179.6	0	0	0	0	0	113.6	E198 I199 K204 N205	E198-G201 PolarHBondContact O-N 3.04Å; E198-G201 VanDerWaalsContact O-N 3.13Å; I199-G201 VanDerWaalsContact C-N 3.31Å; I199-G201 PolarHBondContact O-N 3.3Å; G201-K204 WeakPolarHBondContact O-CE 3.34Å; G201-K204 WeakPolarHBondContact O-CG 3.43Å; G201-N205 PolarHBondContact O-ND2 3.23Å
202	A	92.3	Very high	97.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-80.4	-57.3	175.8	0	0	0	0	0	112	I122 I199 C200 K204 N205	I122-A202 HydrophobicContact CG2-CB 3.63Å; I199-A202 PolarHBondContact O-N 2.62Å; C200-A202 PolarHBondContact O-N 2.82Å; A202-K204 VanDerWaalsContact C-N 3.3Å; A202-K204 PolarHBondContact O-N 2.9Å; A202-N205 PolarHBondContact O-N 3.03Å
203	L	97	Very high	97.2	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-62.7	-34.6	-171.2	-62.7	-179.3	0	0	0	113	I199 N205 V206 V207 M235 F238 L306 F322	I199-L203 HydrophobicContact CD1-CD1 4.47Å; I199-L203 HydrophobicContact CD1-CD2 4.36Å; I199-L203 HydrophobicContact CD1-CG 4.17Å; I199-L203 HydrophobicContact CG1-CD1 3.8Å; I199-L203 HydrophobicContact CG1-CG 3.94Å; I199-L203 WeakPolarHBondContact O-CG 3.36Å; I199-L203 PolarHBondContact O-N 3.28Å; L203-N205 PolarHBondContact O-N 3.33Å; L203-V206 WeakPolarHBondContact O-CB 3.41Å; L203-V206 PolarHBondContact O-N 2.86Å; L203-V207 PolarHBondContact O-N 2.96Å; L203-M235 HydrophobicContact CB-CE 4.45Å; L203-M235 HydrophobicContact CB-CG 3.67Å; L203-M235 HydrophobicContact CB-SD 4.48Å; L203-M235 HydrophobicContact CD1-CB 4.09Å; L203-M235 HydrophobicContact CD1-CG 4.08Å; L203-F238 HydrophobicContact CD1-CB 4.02Å; L203-F238 HydrophobicContact CD1-CD1 3.83Å; L203-F238 HydrophobicContact CD1-CG 4.19Å; L203-F238 HydrophobicContact CD2-CD1 4.04Å; L203-F238 HydrophobicContact CD2-CE1 4.25Å; L203-F238 HydrophobicContact CD2-CG 4.46Å; L203-L306 HydrophobicContact CD2-CD1 3.66Å; L203-L306 HydrophobicContact CD2-CD2 3.47Å; L203-L306 VanDerWaalsContact CD2-CD2 3.47Å; L203-L306 HydrophobicContact CD2-CG 4.13Å; L203-F322 HydrophobicContact CB-CZ 4.3Å; L203-F322 HydrophobicContact CD1-CE2 4.49Å; L203-F322 HydrophobicContact CD1-CZ 4.39Å; L203-F322 HydrophobicContact CD2-CE2 4.28Å; L203-F322 HydrophobicContact CD2-CZ 4.43Å
204	K	96.9	Very high	97.3	Very high	13 Å²	13	1.8 Å²	1.8	6%	0.057	1%	0.009	C	C	.	.	H	α-helix	trans	-56.6	-28.3	179.4	66.8	91.4	-179.2	178.6	0	113.4	C200 G201 A202 V206 V207 A208 M235 D260 L261 T264	C200-K204 WeakPolarHBondContact O-CB 3.28Å; C200-K204 WeakPolarHBondContact O-CG 3.44Å; C200-K204 PolarHBondContact O-N 3.44Å; G201-K204 WeakPolarHBondContact O-CE 3.34Å; G201-K204 WeakPolarHBondContact O-CG 3.43Å; A202-K204 VanDerWaalsContact C-N 3.3Å; A202-K204 PolarHBondContact O-N 2.9Å; K204-V206 VanDerWaalsContact C-N 3.28Å; K204-V206 PolarHBondContact O-N 2.96Å; K204-V207 PolarHBondContact O-N 2.9Å; K204-A208 WeakPolarHBondContact O-CB 3.44Å; K204-A208 PolarHBondContact O-N 3.24Å; K204-M235 HydrophobicContact CB-CE 4.03Å; K204-M235 HydrophobicContact CB-SD 4.34Å; K204-D260 VanDerWaalsContact CE-OD2 3.31Å; K204-D260 WeakPolarHBondContact CE-OD2 3.35Å; K204-D260 IonicContact NZ-OD1 2.81Å; K204-L261 HydrophobicContact CB-CB 4.27Å; K204-L261 HydrophobicContact CB-CD1 3.87Å; K204-T264 HydrophobicContact CD-CG2 3.86Å; K204-T264 WeakPolarHBondContact CD-OG1 3.2Å; K204-T264 VanDerWaalsContact NZ-CG2 3.3Å; K204-T264 PolarHBondContact NZ-OG1 3.44Å
205	N	95.6	Very high	97.3	Very high	7 Å²	7	2.6 Å²	2.6	4%	0.037	1%	0.013	C	C	.	.	H	α-helix	trans	-68.2	-30.6	179.3	-71.1	-44.3	0	0	0	111.9	G201 A202 L203 V209 N270	G201-N205 PolarHBondContact O-ND2 3.23Å; A202-N205 PolarHBondContact O-N 3.03Å; L203-N205 PolarHBondContact O-N 3.33Å; N205-V209 WeakPolarHBondContact O-CG2 3.44Å; N205-V209 PolarHBondContact O-N 2.93Å; N205-N270 VanDerWaalsContact CG-ND2 3.33Å; N205-N270 PolarHBondContact OD1-ND2 2.8Å
206	V	97.9	Very high	97.4	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-68.4	-47.3	175.1	-178	0	0	0	0	109.7	L203 K204 A208 V209 G210 T302 A303 L306 F322 V325	L203-V206 WeakPolarHBondContact O-CB 3.41Å; L203-V206 PolarHBondContact O-N 2.86Å; K204-V206 VanDerWaalsContact C-N 3.28Å; K204-V206 PolarHBondContact O-N 2.96Å; V206-A208 VanDerWaalsContact C-N 3.27Å; V206-A208 PolarHBondContact O-N 3.03Å; V206-V209 WeakPolarHBondContact O-CB 3.41Å; V206-V209 PolarHBondContact O-N 3.07Å; V206-V209 VanDerWaalsContact O-N 3.09Å; V206-G210 PolarHBondContact O-N 3.38Å; V206-T302 HydrophobicContact CG2-CG2 3.75Å; V206-A303 HydrophobicContact CG1-CB 4.01Å; V206-A303 HydrophobicContact CG2-CB 4.12Å; V206-L306 HydrophobicContact CG2-CD1 3.87Å; V206-F322 HydrophobicContact CB-CD1 4.27Å; V206-F322 HydrophobicContact CG1-CB 4.32Å; V206-F322 HydrophobicContact CG1-CD1 3.75Å; V206-F322 HydrophobicContact CG1-CE1 4.49Å; V206-F322 HydrophobicContact CG1-CG 4.3Å; V206-V325 HydrophobicContact CG1-CB 3.88Å; V206-V325 HydrophobicContact CG1-CG1 3.83Å; V206-V325 HydrophobicContact CG1-CG2 4.18Å
207	V	98.6	Very high	97.4	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-60.2	-39.3	176.3	-172.8	0	0	0	0	111.3	L203 K204 V209 G210 A211 V227 M235 L261 L321 F322	L203-V207 PolarHBondContact O-N 2.96Å; K204-V207 PolarHBondContact O-N 2.9Å; V207-V209 VanDerWaalsContact C-N 3.29Å; V207-V209 PolarHBondContact O-N 3.45Å; V207-G210 WeakPolarHBondContact O-CA 3.37Å; V207-G210 PolarHBondContact O-N 3.48Å; V207-G210 VanDerWaalsContact O-N 3.12Å; V207-A211 PolarHBondContact O-N 3.41Å; V207-V227 HydrophobicContact CG1-CG1 4.22Å; V207-M235 HydrophobicContact CG2-CG 4.39Å; V207-M235 HydrophobicContact CG2-SD 4.05Å; V207-L261 HydrophobicContact CB-CD1 3.59Å; V207-L261 HydrophobicContact CG1-CD1 3.71Å; V207-L261 HydrophobicContact CG2-CD1 4.09Å; V207-L321 HydrophobicContact CG2-CD2 4.46Å; V207-F322 HydrophobicContact CG2-CE1 3.79Å
208	A	98.3	Very high	97.3	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.9	-29.3	177.1	0	0	0	0	0	113.9	K204 V206 G212 T264 C265 N270 R271	K204-A208 WeakPolarHBondContact O-CB 3.44Å; K204-A208 PolarHBondContact O-N 3.24Å; V206-A208 VanDerWaalsContact C-N 3.27Å; V206-A208 PolarHBondContact O-N 3.03Å; A208-G212 PolarHBondContact O-N 3.35Å; A208-T264 HydrophobicContact CB-CG2 3.46Å; A208-T264 VanDerWaalsContact CB-CG2 3.46Å; A208-C265 VanDerWaalsContact CA-SG 3.55Å; A208-N270 HydrophobicContact CB-CB 4.07Å; A208-R271 WeakPolarHBondContact O-CA 3.44Å
209	V	98.5	Very high	97.3	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.006	8%	0.079	C	C	.	.	H	α-helix	trans	-66.4	-47.6	170.3	172.4	0	0	0	0	109.8	N205 V206 V207 A211 G212 F213 N270 A274 P300 V325	N205-V209 WeakPolarHBondContact O-CG2 3.44Å; N205-V209 PolarHBondContact O-N 2.93Å; V206-V209 WeakPolarHBondContact O-CB 3.41Å; V206-V209 PolarHBondContact O-N 3.07Å; V206-V209 VanDerWaalsContact O-N 3.09Å; V207-V209 VanDerWaalsContact C-N 3.29Å; V207-V209 PolarHBondContact O-N 3.45Å; V209-A211 VanDerWaalsContact C-N 3.31Å; V209-A211 PolarHBondContact O-N 2.77Å; V209-G212 PolarHBondContact O-N 2.98Å; V209-G212 VanDerWaalsContact O-N 3.09Å; V209-F213 HydrophobicContact CG1-CD1 4.45Å; V209-F213 HydrophobicContact CG1-CD2 4.37Å; V209-F213 HydrophobicContact CG1-CE1 3.76Å; V209-F213 HydrophobicContact CG1-CE2 3.68Å; V209-F213 HydrophobicContact CG1-CZ 3.32Å; V209-F213 WeakPolarHBondContact O-CG 3.43Å; V209-F213 PolarHBondContact O-N 2.79Å; V209-N270 HydrophobicContact CG2-CB 3.99Å; V209-A274 HydrophobicContact CB-CB 4.29Å; V209-A274 HydrophobicContact CG1-CB 3.86Å; V209-A274 VanDerWaalsContact O-CB 3.29Å; V209-A274 WeakPolarHBondContact O-CB 3.42Å; V209-P300 HydrophobicContact CG2-CG 4.24Å; V209-V325 HydrophobicContact CB-CG1 3.82Å; V209-V325 HydrophobicContact CG1-CG1 3.59Å
210	G	98.5	Very high	97.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57	-42.2	174.3	0	0	0	0	0	113.1	V206 V207 G212 F213 C214 F338	V206-G210 PolarHBondContact O-N 3.38Å; V207-G210 WeakPolarHBondContact O-CA 3.37Å; V207-G210 PolarHBondContact O-N 3.48Å; V207-G210 VanDerWaalsContact O-N 3.12Å; G210-G212 VanDerWaalsContact C-N 3.34Å; G210-G212 PolarHBondContact O-N 3.43Å; G210-F213 WeakPolarHBondContact O-CB 3.38Å; G210-F213 PolarHBondContact O-N 3.18Å; G210-C214 PolarHBondContact O-N 3.15Å; G210-C214 VanDerWaalsContact O-N 3.16Å; G210-F338 VanDerWaalsContact CA-CZ 3.45Å; G210-F338 WeakPolarHBondContact O-CE1 3.49Å
211	A	98.6	Very high	97.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.9	-40	175.1	0	0	0	0	0	112.2	V207 V209 C214 D215 K224 V227 C265	V207-A211 PolarHBondContact O-N 3.41Å; V209-A211 VanDerWaalsContact C-N 3.31Å; V209-A211 PolarHBondContact O-N 2.77Å; A211-C214 WeakPolarHBondContact O-CB 3.42Å; A211-C214 PolarHBondContact O-N 3.38Å; A211-D215 PolarHBondContact O-N 3.25Å; A211-K224 HydrophobicContact CB-CG 4.31Å; A211-V227 HydrophobicContact CB-CG1 4.31Å; A211-C265 HydrophobicContact CB-CB 3.82Å
212	G	98.4	Very high	97.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-35	174.4	0	0	0	0	0	113.4	A208 V209 G210 C214 D215 G216 R271 E275	A208-G212 PolarHBondContact O-N 3.35Å; V209-G212 PolarHBondContact O-N 2.98Å; V209-G212 VanDerWaalsContact O-N 3.09Å; G210-G212 VanDerWaalsContact C-N 3.34Å; G210-G212 PolarHBondContact O-N 3.43Å; G212-C214 VanDerWaalsContact C-N 3.29Å; G212-C214 PolarHBondContact O-N 2.9Å; G212-D215 WeakPolarHBondContact O-CB 3.2Å; G212-D215 PolarHBondContact O-N 3Å; G212-G216 PolarHBondContact O-N 3.18Å; G212-R271 WeakPolarHBondContact CA-O 3.31Å; G212-E275 WeakPolarHBondContact O-CA 3.43Å; G212-E275 PolarHBondContact O-N 3.21Å
213	F	98.6	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-42.9	170.3	-62.8	-26.5	0	0	0	111.4	V209 G210 D215 G216 L217 A274 F277 A278 V325 V328 V335 F338	V209-F213 HydrophobicContact CG1-CD1 4.45Å; V209-F213 HydrophobicContact CG1-CD2 4.37Å; V209-F213 HydrophobicContact CG1-CE1 3.76Å; V209-F213 HydrophobicContact CG1-CE2 3.68Å; V209-F213 HydrophobicContact CG1-CZ 3.32Å; V209-F213 WeakPolarHBondContact O-CG 3.43Å; V209-F213 PolarHBondContact O-N 2.79Å; G210-F213 WeakPolarHBondContact O-CB 3.38Å; G210-F213 PolarHBondContact O-N 3.18Å; F213-D215 VanDerWaalsContact C-N 3.32Å; F213-D215 PolarHBondContact O-N 2.98Å; F213-G216 PolarHBondContact O-N 3.44Å; F213-L217 WeakPolarHBondContact O-CB 3.38Å; F213-L217 VanDerWaalsContact O-CG 3.25Å; F213-L217 WeakPolarHBondContact O-CG 3.37Å; F213-L217 PolarHBondContact O-N 2.92Å; F213-A274 HydrophobicContact CD1-CB 3.82Å; F213-A274 HydrophobicContact CE1-CB 3.84Å; F213-F277 HydrophobicContact CD1-CD1 4.22Å; F213-F277 AromaticContact CE1-CD1 3.61Å; F213-F277 HydrophobicContact CE1-CD1 3.61Å; F213-F277 HydrophobicContact CE1-CE1 4.1Å; F213-F277 HydrophobicContact CE1-CG 4.4Å; F213-F277 HydrophobicContact CZ-CD1 4.4Å; F213-A278 HydrophobicContact CD1-CB 4.36Å; F213-V325 HydrophobicContact CE2-CG2 4.42Å; F213-V328 HydrophobicContact CD2-CG1 4.33Å; F213-V328 HydrophobicContact CE1-CG1 4.1Å; F213-V328 HydrophobicContact CE2-CB 3.86Å; F213-V328 HydrophobicContact CE2-CG1 3.62Å; F213-V328 HydrophobicContact CE2-CG2 4.46Å; F213-V328 HydrophobicContact CZ-CB 4.07Å; F213-V328 HydrophobicContact CZ-CG1 3.49Å; F213-V328 VanDerWaalsContact CZ-CG1 3.49Å; F213-V335 HydrophobicContact CB-CG2 3.81Å; F213-V335 HydrophobicContact CD1-CG2 3.87Å; F213-V335 HydrophobicContact CD2-CG2 4.27Å; F213-V335 HydrophobicContact CG-CG2 3.75Å; F213-F338 HydrophobicContact CB-CD1 4.38Å; F213-F338 HydrophobicContact CD2-CD2 4.01Å; F213-F338 HydrophobicContact CD2-CE2 4.28Å; F213-F338 HydrophobicContact CD2-CG 4.24Å
214	C	98.2	Very high	97.8	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-60.3	-40.5	175.9	-68.8	0	0	0	0	113.1	G210 A211 G212 G216 L217 G218 F219	G210-C214 PolarHBondContact O-N 3.15Å; G210-C214 VanDerWaalsContact O-N 3.16Å; A211-C214 WeakPolarHBondContact O-CB 3.42Å; A211-C214 PolarHBondContact O-N 3.38Å; G212-C214 VanDerWaalsContact C-N 3.29Å; G212-C214 PolarHBondContact O-N 2.9Å; C214-G216 VanDerWaalsContact C-N 3.34Å; C214-L217 PolarHBondContact O-N 3.24Å; C214-G218 PolarHBondContact O-N 3.21Å; C214-F219 HydrophobicContact CB-CB 4.29Å; C214-F219 HydrophobicContact CB-CD2 4.09Å; C214-F219 PolarHBondContact O-N 3.06Å
215	D	98.4	Very high	97.9	Very high	23 Å²	23	30.5 Å²	30.5	12%	0.123	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-38.9	174.8	-73.2	-31.2	0	0	0	112.6	A211 G212 F213 G218 K224 R271 E275 R279	A211-D215 PolarHBondContact O-N 3.25Å; G212-D215 WeakPolarHBondContact O-CB 3.2Å; G212-D215 PolarHBondContact O-N 3Å; F213-D215 VanDerWaalsContact C-N 3.32Å; F213-D215 PolarHBondContact O-N 2.98Å; D215-G218 PolarHBondContact O-N 2.87Å; D215-K224 WeakPolarHBondContact OD1-CE 3.32Å; D215-K224 IonicContact OD1-NZ 2.73Å; D215-K224 PolarHBondContact OD1-NZ 3.39Å; D215-K224 WeakPolarHBondContact OD2-CE 3.26Å; D215-K224 IonicContact OD2-NZ 2.69Å; D215-K224 PolarHBondContact OD2-NZ 3.39Å; D215-K224 VanDerWaalsContact OD2-NZ 3.09Å; D215-R271 WeakPolarHBondContact OD2-CD 3.43Å; D215-R271 IonicContact OD2-CZ 3.57Å; D215-R271 IonicContact OD2-NE 3.68Å; D215-R271 IonicContact OD2-NH1 2.77Å; D215-R271 PolarHBondContact OD2-NH1 2.83Å; D215-E275 HydrophobicContact CB-CB 4.17Å; D215-E275 HydrophobicContact CB-CG 3.91Å; D215-R279 PolarHBondContact O-NH2 2.99Å
216	G	98.1	Very high	98	Very high	13 Å²	13	32 Å²	32	13%	0.134	21%	0.211	C	C	.	.	H	α-helix	trans	-71.3	-31.9	178.4	0	0	0	0	0	113.2	G212 F213 C214 G218 R279	G212-G216 PolarHBondContact O-N 3.18Å; F213-G216 PolarHBondContact O-N 3.44Å; C214-G216 VanDerWaalsContact C-N 3.34Å; G216-G218 VanDerWaalsContact C-N 3.27Å; G216-G218 PolarHBondContact O-N 2.95Å; G216-R279 WeakPolarHBondContact O-CG 3.43Å
217	L	98	Very high	98	Very high	56 Å²	56	32 Å²	32	29%	0.293	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.5	174.9	-68	171.9	0	0	0	113.8	F213 C214 F219 V335	F213-L217 WeakPolarHBondContact O-CB 3.38Å; F213-L217 VanDerWaalsContact O-CG 3.25Å; F213-L217 WeakPolarHBondContact O-CG 3.37Å; F213-L217 PolarHBondContact O-N 2.92Å; C214-L217 PolarHBondContact O-N 3.24Å; L217-F219 HydrophobicContact CB-CD2 3.89Å; L217-F219 HydrophobicContact CB-CE2 3.81Å; L217-F219 HydrophobicContact CB-CZ 4.44Å; L217-F219 HydrophobicContact CD1-CD2 4.28Å; L217-F219 HydrophobicContact CD1-CE2 3.66Å; L217-F219 HydrophobicContact CD1-CZ 4.49Å; L217-F219 HydrophobicContact CG-CE2 4.4Å; L217-V335 HydrophobicContact CD1-CG2 4.37Å; L217-V335 HydrophobicContact CD2-CG1 4.21Å
218	G	97.7	Very high	98	Very high	65 Å²	65	32.9 Å²	32.9	67%	0.67	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.6	21.2	178.3	0	0	0	0	0	114.4	C214 D215 G216	C214-G218 PolarHBondContact O-N 3.21Å; D215-G218 PolarHBondContact O-N 2.87Å; G216-G218 VanDerWaalsContact C-N 3.27Å; G216-G218 PolarHBondContact O-N 2.95Å
219	F	97.6	Very high	98	Very high	75 Å²	75	37.9 Å²	37.9	33%	0.329	23%	0.234	S	C	.	.			trans	-74.6	153.1	172.8	-64.1	-50.1	0	0	0	111.8	C214 L217 T223 I339	C214-F219 HydrophobicContact CB-CB 4.29Å; C214-F219 HydrophobicContact CB-CD2 4.09Å; C214-F219 PolarHBondContact O-N 3.06Å; L217-F219 HydrophobicContact CB-CD2 3.89Å; L217-F219 HydrophobicContact CB-CE2 3.81Å; L217-F219 HydrophobicContact CB-CZ 4.44Å; L217-F219 HydrophobicContact CD1-CD2 4.28Å; L217-F219 HydrophobicContact CD1-CE2 3.66Å; L217-F219 HydrophobicContact CD1-CZ 4.49Å; L217-F219 HydrophobicContact CG-CE2 4.4Å; F219-T223 HydrophobicContact CB-CG2 3.92Å; F219-T223 HydrophobicContact CD2-CG2 3.98Å; F219-T223 HydrophobicContact CG-CG2 3.97Å; F219-I339 HydrophobicContact CE2-CB 4.33Å; F219-I339 HydrophobicContact CE2-CD1 4.35Å; F219-I339 HydrophobicContact CZ-CB 4.27Å; F219-I339 HydrophobicContact CZ-CD1 4.44Å; F219-I339 HydrophobicContact CZ-CG1 4.28Å
220	G	95.6	Very high	98	Very high	48 Å²	48	38 Å²	38	50%	0.495	23%	0.234	S	C	.	.			trans	-86.9	-178.3	179.3	0	0	0	0	0	114.5	N222 T223 K224	G220-N222 VanDerWaalsContact C-N 3.3Å; G220-N222 PolarHBondContact O-N 3.13Å; G220-T223 PolarHBondContact O-N 3.04Å; G220-T223 VanDerWaalsContact O-N 3.14Å; G220-K224 PolarHBondContact O-N 3.1Å
221	D	97	Very high	98	Very high	102 Å²	102	38 Å²	38	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-32.6	-174.6	-67.6	-49.8	0	0	0	114	T223 K224 A225	D221-T223 VanDerWaalsContact C-N 3.33Å; D221-T223 PolarHBondContact O-N 3.47Å; D221-K224 PolarHBondContact O-N 3.17Å; D221-A225 WeakPolarHBondContact O-CB 3.34Å; D221-A225 PolarHBondContact O-N 3.28Å
222	N	97.9	Very high	98	Very high	147 Å²	147	39.4 Å²	39.4	79%	0.786	24%	0.242	S	C	*	.	H	α-helix	trans	-60.8	-42.4	176.5	-70.5	-17.7	0	0	0	112	G220 A225 A226	G220-N222 VanDerWaalsContact C-N 3.3Å; G220-N222 PolarHBondContact O-N 3.13Å; N222-A225 PolarHBondContact O-N 3.3Å; N222-A226 PolarHBondContact O-N 3.38Å
223	T	97.8	Very high	98	Very high	37 Å²	37	42 Å²	42	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-42.5	177.1	-53.1	0	0	0	0	110.6	F219 G220 D221 A225 A226 V227 I339	F219-T223 HydrophobicContact CB-CG2 3.92Å; F219-T223 HydrophobicContact CD2-CG2 3.98Å; F219-T223 HydrophobicContact CG-CG2 3.97Å; G220-T223 PolarHBondContact O-N 3.04Å; G220-T223 VanDerWaalsContact O-N 3.14Å; D221-T223 VanDerWaalsContact C-N 3.33Å; D221-T223 PolarHBondContact O-N 3.47Å; T223-A225 VanDerWaalsContact C-N 3.35Å; T223-A225 PolarHBondContact O-N 3Å; T223-A226 WeakPolarHBondContact O-CB 3.19Å; T223-A226 PolarHBondContact O-N 3.5Å; T223-V227 PolarHBondContact O-N 3.49Å; T223-I339 HydrophobicContact CG2-CD1 3.98Å
224	K	98.2	Very high	98	Very high	15 Å²	15	42.2 Å²	42.2	7%	0.065	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-42.3	176.5	-173.3	-178.5	-64.9	176.2	0	111.9	A211 D215 G220 D221 A226 V227 I228 Y266	A211-K224 HydrophobicContact CB-CG 4.31Å; D215-K224 WeakPolarHBondContact OD1-CE 3.32Å; D215-K224 IonicContact OD1-NZ 2.73Å; D215-K224 PolarHBondContact OD1-NZ 3.39Å; D215-K224 WeakPolarHBondContact OD2-CE 3.26Å; D215-K224 IonicContact OD2-NZ 2.69Å; D215-K224 PolarHBondContact OD2-NZ 3.39Å; D215-K224 VanDerWaalsContact OD2-NZ 3.09Å; G220-K224 PolarHBondContact O-N 3.1Å; D221-K224 PolarHBondContact O-N 3.17Å; K224-A226 VanDerWaalsContact C-N 3.32Å; K224-A226 PolarHBondContact O-N 2.93Å; K224-V227 WeakPolarHBondContact O-CB 3.34Å; K224-V227 PolarHBondContact O-N 3.38Å; K224-I228 HydrophobicContact CG-CD1 4.13Å; K224-I228 WeakPolarHBondContact O-CG1 3.46Å; K224-I228 PolarHBondContact O-N 2.98Å; K224-Y266 HydrophobicContact CD-CD1 4.45Å; K224-Y266 HydrophobicContact CD-CE1 4Å; K224-Y266 HydrophobicContact CD-CE2 4.14Å
225	A	98.2	Very high	98	Very high	50 Å²	50	42.1 Å²	42.1	41%	0.413	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-40.2	175.4	0	0	0	0	0	111.7	D221 N222 T223 I228 R229	D221-A225 WeakPolarHBondContact O-CB 3.34Å; D221-A225 PolarHBondContact O-N 3.28Å; N222-A225 PolarHBondContact O-N 3.3Å; T223-A225 VanDerWaalsContact C-N 3.35Å; T223-A225 PolarHBondContact O-N 3Å; A225-I228 PolarHBondContact O-N 2.67Å; A225-R229 WeakPolarHBondContact O-CB 3.29Å; A225-R229 PolarHBondContact O-N 3.23Å
226	A	98.2	Very high	98	Very high	40 Å²	40	42.1 Å²	42.1	33%	0.331	26%	0.255	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174.1	0	0	0	0	0	112.2	N222 T223 K224 R229 L230	N222-A226 PolarHBondContact O-N 3.38Å; T223-A226 WeakPolarHBondContact O-CB 3.19Å; T223-A226 PolarHBondContact O-N 3.5Å; K224-A226 VanDerWaalsContact C-N 3.32Å; K224-A226 PolarHBondContact O-N 2.93Å; A226-R229 PolarHBondContact O-N 2.99Å; A226-L230 WeakPolarHBondContact O-CB 3.25Å; A226-L230 VanDerWaalsContact O-CG 3.32Å; A226-L230 WeakPolarHBondContact O-CG 3.36Å; A226-L230 PolarHBondContact O-N 3.45Å
227	V	98.4	Very high	97.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-45.5	174	170.2	0	0	0	0	111.6	V207 A211 T223 K224 G231 L321 F338 L342	V207-V227 HydrophobicContact CG1-CG1 4.22Å; A211-V227 HydrophobicContact CB-CG1 4.31Å; T223-V227 PolarHBondContact O-N 3.49Å; K224-V227 WeakPolarHBondContact O-CB 3.34Å; K224-V227 PolarHBondContact O-N 3.38Å; V227-G231 WeakPolarHBondContact O-CA 3.41Å; V227-G231 PolarHBondContact O-N 2.91Å; V227-L321 HydrophobicContact CG1-CD1 4.29Å; V227-F338 HydrophobicContact CG2-CE1 3.97Å; V227-F338 HydrophobicContact CG2-CZ 4.5Å; V227-L342 HydrophobicContact CG2-CD1 3.42Å; V227-L342 VanDerWaalsContact CG2-CD1 3.42Å; V227-L342 HydrophobicContact CG2-CD2 4.15Å; V227-L342 HydrophobicContact CG2-CG 4.45Å
228	I	98.6	Very high	97.9	Very high	18 Å²	18	40.6 Å²	40.6	9%	0.092	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-47.7	177.5	-69.7	167.8	0	0	0	110.2	K224 A225 L232 L261 I262 C265 Y266	K224-I228 HydrophobicContact CG-CD1 4.13Å; K224-I228 WeakPolarHBondContact O-CG1 3.46Å; K224-I228 PolarHBondContact O-N 2.98Å; A225-I228 PolarHBondContact O-N 2.67Å; I228-L232 WeakPolarHBondContact O-CB 3.25Å; I228-L232 PolarHBondContact O-N 2.81Å; I228-L261 HydrophobicContact CG2-CD2 3.88Å; I228-L261 HydrophobicContact CG2-CG 4.1Å; I228-I262 HydrophobicContact CG2-CG1 4.38Å; I228-C265 HydrophobicContact CD1-CB 3.75Å; I228-C265 HydrophobicContact CG1-CB 3.83Å; I228-Y266 HydrophobicContact CD1-CD2 4.41Å; I228-Y266 HydrophobicContact CD1-CE2 3.85Å
229	R	98.5	Very high	97.8	Very high	104 Å²	104	37.5 Å²	37.5	39%	0.392	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-50.6	-179.6	-169.4	-161	79.5	83.7	-5.5	111.8	A225 A226 L232 M233 H348	A225-R229 WeakPolarHBondContact O-CB 3.29Å; A225-R229 PolarHBondContact O-N 3.23Å; A226-R229 PolarHBondContact O-N 2.99Å; R229-L232 WeakPolarHBondContact O-CB 3.31Å; R229-L232 PolarHBondContact O-N 3.31Å; R229-M233 WeakPolarHBondContact O-CG 3.33Å; R229-M233 PolarHBondContact O-N 2.92Å; R229-H348 PolarHBondContact NH2-CE1 2.87Å; R229-H348 PolarHBondContact NH2-NE2 3.04Å
230	L	98.4	Very high	97.7	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-179.4	-70.5	175.5	0	0	0	111.4	A226 L232 M233 E234 L321 L342 H345 E347	A226-L230 WeakPolarHBondContact O-CB 3.25Å; A226-L230 VanDerWaalsContact O-CG 3.32Å; A226-L230 WeakPolarHBondContact O-CG 3.36Å; A226-L230 PolarHBondContact O-N 3.45Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.31Å; L230-M233 WeakPolarHBondContact O-CB 3.39Å; L230-M233 PolarHBondContact O-N 2.76Å; L230-M233 VanDerWaalsContact O-N 3.13Å; L230-E234 PolarHBondContact O-N 2.88Å; L230-L321 HydrophobicContact CB-CD1 4.04Å; L230-L342 HydrophobicContact CD1-CB 4.14Å; L230-L342 HydrophobicContact CD1-CD2 3.91Å; L230-H345 HydrophobicContact CD1-CB 4.18Å; L230-H345 HydrophobicContact CD2-CB 4.27Å; L230-E347 HydrophobicContact CD2-CB 4.06Å; L230-E347 HydrophobicContact CD2-CG 4.41Å
231	G	98.4	Very high	97.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-40.2	173.2	0	0	0	0	0	112.3	V227 M233 E234 M235	V227-G231 WeakPolarHBondContact O-CA 3.41Å; V227-G231 PolarHBondContact O-N 2.91Å; G231-M233 VanDerWaalsContact C-N 3.34Å; G231-M233 PolarHBondContact O-N 3.46Å; G231-E234 PolarHBondContact O-N 3.3Å; G231-M235 WeakPolarHBondContact O-CG 3.5Å; G231-M235 PolarHBondContact O-N 2.92Å
232	L	98.4	Very high	97.5	Very high	29 Å²	29	38.4 Å²	38.4	15%	0.152	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-39.4	173.5	-175.9	61.9	0	0	0	112.2	I228 R229 L230 M235 I236 F252 V258 L261	I228-L232 WeakPolarHBondContact O-CB 3.25Å; I228-L232 PolarHBondContact O-N 2.81Å; R229-L232 WeakPolarHBondContact O-CB 3.31Å; R229-L232 PolarHBondContact O-N 3.31Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.31Å; L232-M235 HydrophobicContact CD1-CE 4.46Å; L232-M235 HydrophobicContact CD1-SD 4.38Å; L232-M235 WeakPolarHBondContact O-CB 3.21Å; L232-M235 PolarHBondContact O-N 3.16Å; L232-I236 HydrophobicContact CG-CD1 4.22Å; L232-I236 VanDerWaalsContact O-CG1 3.32Å; L232-I236 WeakPolarHBondContact O-CG1 3.24Å; L232-I236 PolarHBondContact O-N 2.81Å; L232-F252 HydrophobicContact CD1-CB 4.24Å; L232-F252 HydrophobicContact CD1-CD1 4.03Å; L232-V258 HydrophobicContact CD2-CG2 4.48Å; L232-L261 HydrophobicContact CB-CD2 3.82Å; L232-L261 HydrophobicContact CD1-CD2 4.12Å; L232-L261 HydrophobicContact CG-CD2 4.47Å
233	M	98.1	Very high	97.2	Very high	55 Å²	55	32.3 Å²	32.3	27%	0.271	18%	0.175	S	C	.	.	H	α-helix	trans	-63.1	-44.6	175.2	-65.4	-55.9	-70.8	0	0	111.5	R229 L230 G231 M235 I236 A237 E347	R229-M233 WeakPolarHBondContact O-CG 3.33Å; R229-M233 PolarHBondContact O-N 2.92Å; L230-M233 WeakPolarHBondContact O-CB 3.39Å; L230-M233 PolarHBondContact O-N 2.76Å; L230-M233 VanDerWaalsContact O-N 3.13Å; G231-M233 VanDerWaalsContact C-N 3.34Å; G231-M233 PolarHBondContact O-N 3.46Å; M233-M235 VanDerWaalsContact C-N 3.32Å; M233-M235 PolarHBondContact O-N 3.24Å; M233-I236 PolarHBondContact O-N 2.83Å; M233-I236 HydrophobicContact SD-CD1 4.49Å; M233-A237 WeakPolarHBondContact O-CB 3.45Å; M233-A237 PolarHBondContact O-N 3.33Å; M233-E347 HydrophobicContact CB-CG 3.88Å; M233-E347 VanDerWaalsContact CE-CD 3.46Å; M233-E347 HydrophobicContact CE-CG 4.47Å; M233-E347 WeakPolarHBondContact CE-OE2 3.39Å; M233-E347 HydrophobicContact CG-CG 4.13Å
234	E	98.4	Very high	96.8	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.019	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-37.2	173.4	-76.2	-166.8	-168.8	0	0	112.2	L230 G231 A237 F238 F319 P320 L321 F322 H345	L230-E234 PolarHBondContact O-N 2.88Å; G231-E234 PolarHBondContact O-N 3.3Å; E234-A237 PolarHBondContact O-N 3.36Å; E234-F238 WeakPolarHBondContact O-CB 3.5Å; E234-F238 PolarHBondContact O-N 2.88Å; E234-F319 HydrophobicContact CB-CD1 3.99Å; E234-F319 HydrophobicContact CG-CD1 4.05Å; E234-F319 WeakPolarHBondContact O-CE1 3.5Å; E234-P320 WeakPolarHBondContact OE1-CD 3.4Å; E234-P320 WeakPolarHBondContact OE1-CG 3.2Å; E234-L321 VanDerWaalsContact OE1-CB 3.27Å; E234-L321 WeakPolarHBondContact OE1-CB 3.46Å; E234-L321 PolarHBondContact OE1-N 2.86Å; E234-F322 HydrophobicContact CB-CD1 4.43Å; E234-F322 HydrophobicContact CB-CD2 4.26Å; E234-F322 HydrophobicContact CB-CE1 3.99Å; E234-F322 HydrophobicContact CB-CE2 3.81Å; E234-F322 HydrophobicContact CB-CZ 3.66Å; E234-F322 WeakPolarHBondContact OE2-CD1 3.44Å; E234-F322 WeakPolarHBondContact OE2-CD2 3.44Å; E234-F322 WeakPolarHBondContact OE2-CG 3.21Å; E234-F322 PolarHBondContact OE2-N 3.47Å; E234-H345 IonicContact OE1-CD2 2.82Å; E234-H345 IonicContact OE1-NE2 2.62Å; E234-H345 PolarHBondContact OE1-NE2 3.45Å; E234-H345 VanDerWaalsContact OE1-NE2 3.1Å
235	M	98.4	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-46.4	173.8	-70.5	167.7	61.5	0	0	111.9	C200 L203 K204 V207 G231 L232 M233 F238 A239 F252 L261 F322	C200-M235 HydrophobicContact CB-CE 4.21Å; L203-M235 HydrophobicContact CB-CE 4.45Å; L203-M235 HydrophobicContact CB-CG 3.67Å; L203-M235 HydrophobicContact CB-SD 4.48Å; L203-M235 HydrophobicContact CD1-CB 4.09Å; L203-M235 HydrophobicContact CD1-CG 4.08Å; K204-M235 HydrophobicContact CB-CE 4.03Å; K204-M235 HydrophobicContact CB-SD 4.34Å; V207-M235 HydrophobicContact CG2-CG 4.39Å; V207-M235 HydrophobicContact CG2-SD 4.05Å; G231-M235 WeakPolarHBondContact O-CG 3.5Å; G231-M235 PolarHBondContact O-N 2.92Å; L232-M235 HydrophobicContact CD1-CE 4.46Å; L232-M235 HydrophobicContact CD1-SD 4.38Å; L232-M235 WeakPolarHBondContact O-CB 3.21Å; L232-M235 PolarHBondContact O-N 3.16Å; M233-M235 VanDerWaalsContact C-N 3.32Å; M233-M235 PolarHBondContact O-N 3.24Å; M235-F238 PolarHBondContact O-N 2.69Å; M235-A239 WeakPolarHBondContact O-CB 3.48Å; M235-A239 PolarHBondContact O-N 3.36Å; M235-F252 HydrophobicContact CB-CD1 4.48Å; M235-F252 HydrophobicContact CB-CE1 4.05Å; M235-L261 HydrophobicContact SD-CD1 4.14Å; M235-L261 HydrophobicContact SD-CD2 3.98Å; M235-F322 HydrophobicContact CG-CE1 4.42Å; M235-F322 HydrophobicContact CG-CZ 3.9Å
236	I	98	Very high	95.7	Very high	23 Å²	23	38.5 Å²	38.5	12%	0.118	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-47.4	177.7	-66.5	163.6	0	0	0	110.5	L232 M233 F238 A239 K240 F252	L232-I236 HydrophobicContact CG-CD1 4.22Å; L232-I236 VanDerWaalsContact O-CG1 3.32Å; L232-I236 WeakPolarHBondContact O-CG1 3.24Å; L232-I236 PolarHBondContact O-N 2.81Å; M233-I236 PolarHBondContact O-N 2.83Å; M233-I236 HydrophobicContact SD-CD1 4.49Å; I236-F238 VanDerWaalsContact C-N 3.34Å; I236-F238 PolarHBondContact O-N 3.21Å; I236-A239 PolarHBondContact O-N 3Å; I236-K240 HydrophobicContact CG2-CD 4.13Å; I236-K240 WeakPolarHBondContact O-CB 3.47Å; I236-K240 WeakPolarHBondContact O-CG 3.46Å; I236-K240 PolarHBondContact O-N 3.49Å; I236-F252 HydrophobicContact CB-CE1 4.38Å; I236-F252 HydrophobicContact CB-CE2 4.42Å; I236-F252 HydrophobicContact CB-CZ 4.32Å; I236-F252 HydrophobicContact CD1-CB 4.37Å; I236-F252 HydrophobicContact CD1-CD1 4.49Å; I236-F252 HydrophobicContact CD1-CG 4.22Å; I236-F252 HydrophobicContact CG1-CB 4.17Å; I236-F252 HydrophobicContact CG1-CD1 3.52Å; I236-F252 HydrophobicContact CG1-CD2 3.71Å; I236-F252 HydrophobicContact CG1-CE1 3.75Å; I236-F252 HydrophobicContact CG1-CE2 3.94Å; I236-F252 HydrophobicContact CG1-CG 3.51Å; I236-F252 HydrophobicContact CG1-CZ 3.97Å
237	A	97	Very high	95.5	Very high	36 Å²	36	38 Å²	38	30%	0.298	21%	0.213	S	C	.	.	H	α-helix	trans	-62.5	-41.8	179.9	0	0	0	0	0	111.7	M233 E234 L241 F319	M233-A237 WeakPolarHBondContact O-CB 3.45Å; M233-A237 PolarHBondContact O-N 3.33Å; E234-A237 PolarHBondContact O-N 3.36Å; A237-L241 WeakPolarHBondContact O-CG 3.33Å; A237-L241 PolarHBondContact O-N 3.23Å; A237-F319 HydrophobicContact CB-CE1 3.99Å; A237-F319 HydrophobicContact CB-CZ 4.37Å
238	F	96.8	Very high	95.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-50.4	178.3	-169.1	-88.2	0	0	0	110.9	L129 I199 L203 E234 M235 I236 K240 L241 F242 L306 I309 L310 F319 F322	L129-F238 HydrophobicContact CD1-CE1 4.34Å; L129-F238 HydrophobicContact CD2-CE1 3.97Å; I199-F238 HydrophobicContact CD1-CE1 4.24Å; I199-F238 HydrophobicContact CG1-CD1 4.34Å; L203-F238 HydrophobicContact CD1-CB 4.02Å; L203-F238 HydrophobicContact CD1-CD1 3.83Å; L203-F238 HydrophobicContact CD1-CG 4.19Å; L203-F238 HydrophobicContact CD2-CD1 4.04Å; L203-F238 HydrophobicContact CD2-CE1 4.25Å; L203-F238 HydrophobicContact CD2-CG 4.46Å; E234-F238 WeakPolarHBondContact O-CB 3.5Å; E234-F238 PolarHBondContact O-N 2.88Å; M235-F238 PolarHBondContact O-N 2.69Å; I236-F238 VanDerWaalsContact C-N 3.34Å; I236-F238 PolarHBondContact O-N 3.21Å; F238-K240 VanDerWaalsContact C-N 3.32Å; F238-K240 PolarHBondContact O-N 3.25Å; F238-L241 PolarHBondContact O-N 2.88Å; F238-F242 HydrophobicContact CD1-CB 4.35Å; F238-F242 AromaticContact CD1-CD2 3.93Å; F238-F242 HydrophobicContact CD1-CD2 3.93Å; F238-F242 HydrophobicContact CD1-CG 4.46Å; F238-F242 AromaticContact CD2-CD2 3.58Å; F238-F242 HydrophobicContact CD2-CD2 3.58Å; F238-F242 AromaticContact CD2-CE2 3.65Å; F238-F242 HydrophobicContact CD2-CE2 3.65Å; F238-F242 HydrophobicContact CE1-CB 4.03Å; F238-F242 AromaticContact CE1-CD2 3.85Å; F238-F242 HydrophobicContact CE1-CD2 3.85Å; F238-F242 HydrophobicContact CE1-CG 4.08Å; F238-F242 AromaticContact CE2-CD2 3.46Å; F238-F242 HydrophobicContact CE2-CD2 3.46Å; F238-F242 VanDerWaalsContact CE2-CD2 3.46Å; F238-F242 AromaticContact CE2-CE2 3.44Å; F238-F242 HydrophobicContact CE2-CE2 3.44Å; F238-F242 VanDerWaalsContact CE2-CE2 3.44Å; F238-F242 HydrophobicContact CE2-CG 4.25Å; F238-F242 HydrophobicContact CE2-CZ 4.19Å; F238-F242 AromaticContact CG-CD2 3.8Å; F238-F242 HydrophobicContact CG-CD2 3.8Å; F238-F242 HydrophobicContact CG-CE2 4.32Å; F238-F242 HydrophobicContact CZ-CB 4.37Å; F238-F242 AromaticContact CZ-CD2 3.6Å; F238-F242 HydrophobicContact CZ-CD2 3.6Å; F238-F242 AromaticContact CZ-CE2 3.99Å; F238-F242 HydrophobicContact CZ-CE2 3.99Å; F238-F242 AromaticContact CZ-CG 3.95Å; F238-F242 HydrophobicContact CZ-CG 3.95Å; F238-F242 VanDerWaalsContact O-CD2 3.28Å; F238-F242 WeakPolarHBondContact O-CD2 3.42Å; F238-F242 PolarHBondContact O-N 2.93Å; F238-L306 HydrophobicContact CD1-CD2 4.41Å; F238-L306 HydrophobicContact CD2-CD2 4.23Å; F238-L306 HydrophobicContact CE1-CD2 3.74Å; F238-L306 HydrophobicContact CE2-CD2 3.56Å; F238-L306 HydrophobicContact CZ-CD2 3.27Å; F238-I309 HydrophobicContact CZ-CG2 4.2Å; F238-L310 HydrophobicContact CD2-CD2 4.24Å; F238-L310 HydrophobicContact CE2-CD2 3.96Å; F238-L310 HydrophobicContact CE2-CG 4.2Å; F238-F319 HydrophobicContact CB-CD1 4.45Å; F238-F319 HydrophobicContact CB-CE1 3.64Å; F238-F319 HydrophobicContact CB-CZ 4.02Å; F238-F319 HydrophobicContact CD2-CD1 4.46Å; F238-F319 HydrophobicContact CD2-CE1 4.04Å; F238-F319 HydrophobicContact CD2-CE2 4.37Å; F238-F319 AromaticContact CD2-CZ 3.98Å; F238-F319 HydrophobicContact CD2-CZ 3.98Å; F238-F319 HydrophobicContact CG-CE1 4.36Å; F238-F319 HydrophobicContact CG-CZ 4.48Å; F238-F322 HydrophobicContact CB-CE2 4.17Å; F238-F322 HydrophobicContact CG-CE2 4.48Å
239	A	96.6	Very high	95.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-44.8	178.7	0	0	0	0	0	112	I199 M235 I236 L241 F242 C243 V247 F252	I199-A239 HydrophobicContact CG2-CB 3.83Å; M235-A239 WeakPolarHBondContact O-CB 3.48Å; M235-A239 PolarHBondContact O-N 3.36Å; I236-A239 PolarHBondContact O-N 3Å; A239-L241 PolarHBondContact O-N 3.46Å; A239-F242 PolarHBondContact O-N 3.48Å; A239-C243 VanDerWaalsContact O-CB 3.27Å; A239-C243 WeakPolarHBondContact O-CB 3.11Å; A239-C243 PolarHBondContact O-N 3.18Å; A239-V247 HydrophobicContact CB-CG1 3.81Å; A239-V247 HydrophobicContact CB-CG2 4.48Å; A239-F252 HydrophobicContact CB-CE2 4.47Å; A239-F252 HydrophobicContact CB-CZ 3.63Å
240	K	95.9	Very high	95.2	Very high	118 Å²	118	39.9 Å²	39.9	51%	0.513	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-27.6	177.8	-77	179.9	177.7	178	0	114	I236 F238 V247	I236-K240 HydrophobicContact CG2-CD 4.13Å; I236-K240 WeakPolarHBondContact O-CB 3.47Å; I236-K240 WeakPolarHBondContact O-CG 3.46Å; I236-K240 PolarHBondContact O-N 3.49Å; F238-K240 VanDerWaalsContact C-N 3.32Å; F238-K240 PolarHBondContact O-N 3.25Å; K240-V247 HydrophobicContact CG-CB 4.09Å; K240-V247 HydrophobicContact CG-CG1 3.82Å
241	L	93.9	Very high	95.2	Very high	94 Å²	94	39.9 Å²	39.9	49%	0.492	25%	0.247	S	C	.	.	H	α-helix	trans	-89.1	-30.3	179.6	-70.8	177.2	0	0	0	113.2	A237 F238 A239 L315 F319	A237-L241 WeakPolarHBondContact O-CG 3.33Å; A237-L241 PolarHBondContact O-N 3.23Å; F238-L241 PolarHBondContact O-N 2.88Å; A239-L241 PolarHBondContact O-N 3.46Å; L241-L315 HydrophobicContact CD1-CD1 4.33Å; L241-F319 HydrophobicContact CD1-CE2 4.21Å; L241-F319 HydrophobicContact CD1-CZ 3.94Å
242	F	92.7	Very high	95.2	Very high	32 Å²	32	40 Å²	40	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-118.8	-18.5	-165.5	-68.6	-79.2	0	0	0	115.3	L129 F238 A239 I309 L310 K313 L315	L129-F242 HydrophobicContact CB-CB 4.39Å; L129-F242 HydrophobicContact CD2-CB 3.65Å; F238-F242 HydrophobicContact CD1-CB 4.35Å; F238-F242 AromaticContact CD1-CD2 3.93Å; F238-F242 HydrophobicContact CD1-CD2 3.93Å; F238-F242 HydrophobicContact CD1-CG 4.46Å; F238-F242 AromaticContact CD2-CD2 3.58Å; F238-F242 HydrophobicContact CD2-CD2 3.58Å; F238-F242 AromaticContact CD2-CE2 3.65Å; F238-F242 HydrophobicContact CD2-CE2 3.65Å; F238-F242 HydrophobicContact CE1-CB 4.03Å; F238-F242 AromaticContact CE1-CD2 3.85Å; F238-F242 HydrophobicContact CE1-CD2 3.85Å; F238-F242 HydrophobicContact CE1-CG 4.08Å; F238-F242 AromaticContact CE2-CD2 3.46Å; F238-F242 HydrophobicContact CE2-CD2 3.46Å; F238-F242 VanDerWaalsContact CE2-CD2 3.46Å; F238-F242 AromaticContact CE2-CE2 3.44Å; F238-F242 HydrophobicContact CE2-CE2 3.44Å; F238-F242 VanDerWaalsContact CE2-CE2 3.44Å; F238-F242 HydrophobicContact CE2-CG 4.25Å; F238-F242 HydrophobicContact CE2-CZ 4.19Å; F238-F242 AromaticContact CG-CD2 3.8Å; F238-F242 HydrophobicContact CG-CD2 3.8Å; F238-F242 HydrophobicContact CG-CE2 4.32Å; F238-F242 HydrophobicContact CZ-CB 4.37Å; F238-F242 AromaticContact CZ-CD2 3.6Å; F238-F242 HydrophobicContact CZ-CD2 3.6Å; F238-F242 AromaticContact CZ-CE2 3.99Å; F238-F242 HydrophobicContact CZ-CE2 3.99Å; F238-F242 AromaticContact CZ-CG 3.95Å; F238-F242 HydrophobicContact CZ-CG 3.95Å; F238-F242 VanDerWaalsContact O-CD2 3.28Å; F238-F242 WeakPolarHBondContact O-CD2 3.42Å; F238-F242 PolarHBondContact O-N 2.93Å; A239-F242 PolarHBondContact O-N 3.48Å; F242-I309 HydrophobicContact CD1-CG2 3.84Å; F242-I309 HydrophobicContact CE1-CG2 3.37Å; F242-I309 HydrophobicContact CZ-CG2 3.83Å; F242-L310 HydrophobicContact CE2-CD2 3.82Å; F242-L310 HydrophobicContact CZ-CD2 3.86Å; F242-K313 HydrophobicContact CE1-CG 3.81Å; F242-K313 HydrophobicContact CZ-CG 4.15Å; F242-L315 HydrophobicContact CZ-CD1 4.1Å
243	C	92.8	Very high	95.2	Very high	19 Å²	19	44.9 Å²	44.9	13%	0.128	27%	0.273	C	S	.	.			trans	-76.7	144.7	174	-66.7	0	0	0	0	111	D195 A239 V247	D195-C243 HydrophobicContact CB-CB 3.96Å; A239-C243 VanDerWaalsContact O-CB 3.27Å; A239-C243 WeakPolarHBondContact O-CB 3.11Å; A239-C243 PolarHBondContact O-N 3.18Å; C243-V247 HydrophobicContact CB-CG2 3.68Å
244	S	88.8	Confident	95.2	Very high	107 Å²	107	45 Å²	45	75%	0.748	27%	0.273	S	S	*	.	S	Bend	trans	-81.9	-32.2	-180	-59.6	0	0	0	0	112.2	D195	D195-S244 PolarHBondContact OD2-N 3.26Å
245	G	83.8	Confident	95.2	Very high	25 Å²	25	44.9 Å²	44.9	26%	0.258	27%	0.273	S	S	.	.	S	Bend	trans	-82.9	176.5	177.8	0	0	0	0	0	115.1	D195	D195-G245 PolarHBondContact OD2-N 3.03Å
246	P	89	Confident	95.1	Very high	101 Å²	101	44.9 Å²	44.9	66%	0.656	27%	0.273	S	S	*	.			trans	-59.3	142	170.3	25.9	-32.3	0	0	0	110.6	E193 T196	E193-P246 HydrophobicContact CG-CG 4.38Å; T196-P246 PolarHBondContact OG1-O 2.97Å
247	V	95.2	Very high	95.1	Very high	30 Å²	30	43.8 Å²	43.8	18%	0.182	27%	0.268	C	S	.	.			trans	-127.1	104.3	178.6	-177.1	0	0	0	0	109.4	E193 T196 A239 K240 C243 F252	E193-V247 WeakPolarHBondContact OE1-CA 3.37Å; T196-V247 HydrophobicContact CG2-CG1 4.03Å; A239-V247 HydrophobicContact CB-CG1 3.81Å; A239-V247 HydrophobicContact CB-CG2 4.48Å; K240-V247 HydrophobicContact CG-CB 4.09Å; K240-V247 HydrophobicContact CG-CG1 3.82Å; C243-V247 HydrophobicContact CB-CG2 3.68Å; V247-F252 HydrophobicContact CG1-CE2 3.83Å; V247-F252 HydrophobicContact CG1-CZ 4.29Å
248	S	96.4	Very high	95.2	Very high	46 Å²	46	44.1 Å²	44.1	32%	0.322	27%	0.266	S	S	.	.			trans	-93.9	136.7	174.1	-176.1	0	0	0	0	110.8	E193 A250 T251 F252	E193-S248 WeakPolarHBondContact OE1-CB 3.32Å; E193-S248 PolarHBondContact OE1-N 2.96Å; E193-S248 WeakPolarHBondContact OE2-CB 3.46Å; S248-A250 PolarHBondContact O-N 3.28Å; S248-A250 WeakPolarHBondContact OG-CB 3.47Å; S248-A250 PolarHBondContact OG-N 2.77Å; S248-T251 PolarHBondContact O-N 3.39Å; S248-T251 PolarHBondContact O-OG1 2.94Å; S248-F252 WeakPolarHBondContact O-CD2 3.37Å
249	S	94.7	Very high	95.2	Very high	59 Å²	59	45.4 Å²	45.4	41%	0.413	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-60.8	-22.8	169.6	-62.2	0	0	0	0	112.1	T251 F252	S249-T251 VanDerWaalsContact C-N 3.33Å; S249-T251 PolarHBondContact O-N 2.81Å; S249-F252 WeakPolarHBondContact O-CB 3.25Å; S249-F252 PolarHBondContact O-N 3.3Å
250	A	97.4	Very high	95.3	Very high	56 Å²	56	45.6 Å²	45.6	46%	0.463	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-65.6	-34.2	177.8	0	0	0	0	0	112.4	S248 F252 L253	S248-A250 PolarHBondContact O-N 3.28Å; S248-A250 WeakPolarHBondContact OG-CB 3.47Å; S248-A250 PolarHBondContact OG-N 2.77Å; A250-F252 PolarHBondContact O-N 2.77Å; A250-L253 WeakPolarHBondContact O-CB 3.4Å; A250-L253 PolarHBondContact O-N 2.97Å
251	T	98	Very high	95.4	Very high	4 Å²	4	40 Å²	40	3%	0.025	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-61.8	-28.5	177.1	-35.4	0	0	0	0	112	V191 E193 T196 V197 S248 S249 L253 E254	V191-T251 HydrophobicContact CG2-CG2 4.41Å; E193-T251 HydrophobicContact CB-CG2 4.44Å; E193-T251 VanDerWaalsContact CD-OG1 3.25Å; E193-T251 PolarHBondContact OE1-OG1 3.25Å; E193-T251 PolarHBondContact OE2-OG1 2.89Å; T196-T251 HydrophobicContact CG2-CG2 3.71Å; V197-T251 HydrophobicContact CG2-CG2 3.89Å; S248-T251 PolarHBondContact O-N 3.39Å; S248-T251 PolarHBondContact O-OG1 2.94Å; S249-T251 VanDerWaalsContact C-N 3.33Å; S249-T251 PolarHBondContact O-N 2.81Å; T251-L253 PolarHBondContact O-N 3.43Å; T251-E254 VanDerWaalsContact O-CB 3.28Å; T251-E254 WeakPolarHBondContact O-CB 3.26Å; T251-E254 PolarHBondContact O-N 2.91Å
252	F	98.3	Very high	95.5	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.009	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-73.7	-13.5	176.6	-67	-97.2	0	0	0	113	T196 C200 L232 M235 I236 A239 V247 S248 S249 A250 G257 V258	T196-F252 HydrophobicContact CG2-CD2 4.23Å; T196-F252 HydrophobicContact CG2-CE2 3.55Å; T196-F252 HydrophobicContact CG2-CZ 3.88Å; C200-F252 VanDerWaalsContact SG-CD1 3.51Å; C200-F252 WeakPolarHBondContact SG-CE1 3.27Å; L232-F252 HydrophobicContact CD1-CB 4.24Å; L232-F252 HydrophobicContact CD1-CD1 4.03Å; M235-F252 HydrophobicContact CB-CD1 4.48Å; M235-F252 HydrophobicContact CB-CE1 4.05Å; I236-F252 HydrophobicContact CB-CE1 4.38Å; I236-F252 HydrophobicContact CB-CE2 4.42Å; I236-F252 HydrophobicContact CB-CZ 4.32Å; I236-F252 HydrophobicContact CD1-CB 4.37Å; I236-F252 HydrophobicContact CD1-CD1 4.49Å; I236-F252 HydrophobicContact CD1-CG 4.22Å; I236-F252 HydrophobicContact CG1-CB 4.17Å; I236-F252 HydrophobicContact CG1-CD1 3.52Å; I236-F252 HydrophobicContact CG1-CD2 3.71Å; I236-F252 HydrophobicContact CG1-CE1 3.75Å; I236-F252 HydrophobicContact CG1-CE2 3.94Å; I236-F252 HydrophobicContact CG1-CG 3.51Å; I236-F252 HydrophobicContact CG1-CZ 3.97Å; A239-F252 HydrophobicContact CB-CE2 4.47Å; A239-F252 HydrophobicContact CB-CZ 3.63Å; V247-F252 HydrophobicContact CG1-CE2 3.83Å; V247-F252 HydrophobicContact CG1-CZ 4.29Å; S248-F252 WeakPolarHBondContact O-CD2 3.37Å; S249-F252 WeakPolarHBondContact O-CB 3.25Å; S249-F252 PolarHBondContact O-N 3.3Å; A250-F252 PolarHBondContact O-N 2.77Å; F252-G257 WeakPolarHBondContact O-CA 3.28Å; F252-V258 WeakPolarHBondContact O-CB 3.41Å; F252-V258 PolarHBondContact O-N 3.47Å
253	L	98.3	Very high	95.6	Very high	131 Å²	131	39.6 Å²	39.6	69%	0.686	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-86.9	-11.8	172.5	-55.9	179.8	0	0	0	112.4	A250 T251	A250-L253 WeakPolarHBondContact O-CB 3.4Å; A250-L253 PolarHBondContact O-N 2.97Å; T251-L253 PolarHBondContact O-N 3.43Å
254	E	98.6	Very high	95.7	Very high	57 Å²	57	39 Å²	39	27%	0.266	25%	0.25	S	C	.	.	S	Bend	trans	-71.5	168.1	172.1	-61.3	-69.6	165.5	0	0	111.4	T165 T189 V191 T251 C256 G257	T165-E254 HydrophobicContact CG2-CB 4.15Å; T165-E254 HydrophobicContact CG2-CG 4.47Å; T165-E254 WeakPolarHBondContact OG1-CB 3.43Å; T189-E254 WeakPolarHBondContact CG2-OE2 3.4Å; V191-E254 HydrophobicContact CG1-CG 4.25Å; T251-E254 VanDerWaalsContact O-CB 3.28Å; T251-E254 WeakPolarHBondContact O-CB 3.26Å; T251-E254 PolarHBondContact O-N 2.91Å; E254-C256 PolarHBondContact O-N 3.24Å; E254-C256 VanDerWaalsContact O-N 3.15Å; E254-G257 PolarHBondContact O-N 3.09Å
255	S	98.2	Very high	96.1	Very high	3 Å²	3	34 Å²	34	2%	0.021	21%	0.214	C	C	.	.	I	π-helix	trans	-54.8	-35.5	-179.4	176.6	0	0	0	0	113.6	G149 A150 E163 T165 G257 D260	G149-S255 WeakPolarHBondContact CA-OG 3.39Å; A150-S255 PolarHBondContact N-OG 2.84Å; E163-S255 PolarHBondContact O-OG 2.86Å; T165-S255 PolarHBondContact OG1-N 3.18Å; S255-G257 PolarHBondContact O-N 2.8Å; S255-D260 WeakPolarHBondContact O-CB 3.07Å; S255-D260 PolarHBondContact O-N 3.34Å
256	C	97.9	Very high	96.6	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.222	C	C	.	.	I	π-helix	trans	-62.5	-26.4	177	62	0	0	0	0	114.4	M148 T165 V197 C200 E254	M148-C256 HydrophobicContact CB-CB 3.65Å; T165-C256 PolarHBondContact OG1-N 3.46Å; T165-C256 VanDerWaalsContact OG1-N 3.17Å; V197-C256 HydrophobicContact CG1-CB 3.9Å; C200-C256 WeakPolarHBondContact CB-O 3.48Å; E254-C256 PolarHBondContact O-N 3.24Å; E254-C256 VanDerWaalsContact O-N 3.15Å
257	G	98.1	Very high	96.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-94.9	-99.8	-178.4	0	0	0	0	0	111.7	F252 E254 S255 A259 D260 L261	F252-G257 WeakPolarHBondContact O-CA 3.28Å; E254-G257 PolarHBondContact O-N 3.09Å; S255-G257 PolarHBondContact O-N 2.8Å; G257-A259 PolarHBondContact O-N 2.71Å; G257-D260 PolarHBondContact O-N 3.37Å; G257-L261 VanDerWaalsContact O-CB 3.25Å; G257-L261 WeakPolarHBondContact O-CB 3.46Å; G257-L261 PolarHBondContact O-N 3.43Å
258	V	98.1	Very high	96.2	Very high	42 Å²	42	34.9 Å²	34.9	26%	0.255	22%	0.215	S	C	.	.	I	π-helix	trans	-61.1	-39.4	-170.3	67.8	0	0	0	0	113	L232 F252 I262	L232-V258 HydrophobicContact CD2-CG2 4.48Å; F252-V258 WeakPolarHBondContact O-CB 3.41Å; F252-V258 PolarHBondContact O-N 3.47Å; V258-I262 HydrophobicContact CG2-CD1 3.78Å; V258-I262 HydrophobicContact CG2-CG1 4.41Å; V258-I262 WeakPolarHBondContact O-CB 3.37Å; V258-I262 WeakPolarHBondContact O-CD1 3.49Å; V258-I262 WeakPolarHBondContact O-CG1 3.3Å; V258-I262 PolarHBondContact O-N 3.29Å
259	A	97.5	Very high	95.9	Very high	28 Å²	28	38.3 Å²	38.3	23%	0.231	22%	0.221	C	C	.	.	I	π-helix	trans	-70.1	-48.7	-178	0	0	0	0	0	111.9	A150 G257 L261 I262 T263	A150-A259 HydrophobicContact CB-CB 3.91Å; G257-A259 PolarHBondContact O-N 2.71Å; A259-L261 VanDerWaalsContact C-N 3.26Å; A259-L261 PolarHBondContact O-N 2.52Å; A259-I262 PolarHBondContact O-N 3.35Å; A259-T263 PolarHBondContact O-N 2.8Å
260	D	96.9	Very high	95.9	Very high	3 Å²	3	36 Å²	36	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-37.4	177.3	-167.6	14.8	0	0	0	110.9	K120 G149 A150 K204 S255 G257 T263 T264	K120-D260 VanDerWaalsContact NZ-CG 3.28Å; K120-D260 IonicContact NZ-OD1 3.54Å; K120-D260 PolarHBondContact NZ-OD1 2.9Å; K120-D260 IonicContact NZ-OD2 3.99Å; K120-D260 PolarHBondContact NZ-OD2 2.93Å; G149-D260 VanDerWaalsContact O-CG 3.31Å; A150-D260 HydrophobicContact CB-CB 4.47Å; K204-D260 VanDerWaalsContact CE-OD2 3.31Å; K204-D260 WeakPolarHBondContact CE-OD2 3.35Å; K204-D260 IonicContact NZ-OD1 2.81Å; S255-D260 WeakPolarHBondContact O-CB 3.07Å; S255-D260 PolarHBondContact O-N 3.34Å; G257-D260 PolarHBondContact O-N 3.37Å; D260-T263 WeakPolarHBondContact O-CG2 3.21Å; D260-T264 WeakPolarHBondContact O-CB 3.33Å; D260-T264 PolarHBondContact O-N 2.79Å; D260-T264 PolarHBondContact O-OG1 2.92Å; D260-T264 PolarHBondContact OD1-OG1 2.99Å
261	L	97.9	Very high	95.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.7	-52.8	174	178.9	61.8	0	0	0	111.8	K204 V207 I228 L232 M235 G257 A259 T264 C265	K204-L261 HydrophobicContact CB-CB 4.27Å; K204-L261 HydrophobicContact CB-CD1 3.87Å; V207-L261 HydrophobicContact CB-CD1 3.59Å; V207-L261 HydrophobicContact CG1-CD1 3.71Å; V207-L261 HydrophobicContact CG2-CD1 4.09Å; I228-L261 HydrophobicContact CG2-CD2 3.88Å; I228-L261 HydrophobicContact CG2-CG 4.1Å; L232-L261 HydrophobicContact CB-CD2 3.82Å; L232-L261 HydrophobicContact CD1-CD2 4.12Å; L232-L261 HydrophobicContact CG-CD2 4.47Å; M235-L261 HydrophobicContact SD-CD1 4.14Å; M235-L261 HydrophobicContact SD-CD2 3.98Å; G257-L261 VanDerWaalsContact O-CB 3.25Å; G257-L261 WeakPolarHBondContact O-CB 3.46Å; G257-L261 PolarHBondContact O-N 3.43Å; A259-L261 VanDerWaalsContact C-N 3.26Å; A259-L261 PolarHBondContact O-N 2.52Å; L261-T264 PolarHBondContact O-N 2.75Å; L261-C265 WeakPolarHBondContact O-CB 3.4Å; L261-C265 PolarHBondContact O-N 2.94Å; L261-C265 PolarHBondContact O-SG 3.2Å
262	I	97.9	Very high	95.8	Very high	79 Å²	79	40 Å²	40	41%	0.405	21%	0.209	S	C	.	.	H	α-helix	trans	-59.3	-54.9	-179.9	-70.6	166.3	0	0	0	110.4	I228 V258 A259 T264 C265 Y266	I228-I262 HydrophobicContact CG2-CG1 4.38Å; V258-I262 HydrophobicContact CG2-CD1 3.78Å; V258-I262 HydrophobicContact CG2-CG1 4.41Å; V258-I262 WeakPolarHBondContact O-CB 3.37Å; V258-I262 WeakPolarHBondContact O-CD1 3.49Å; V258-I262 WeakPolarHBondContact O-CG1 3.3Å; V258-I262 PolarHBondContact O-N 3.29Å; A259-I262 PolarHBondContact O-N 3.35Å; I262-T264 PolarHBondContact O-N 2.87Å; I262-C265 PolarHBondContact O-N 2.97Å; I262-C265 VanDerWaalsContact O-N 3.12Å; I262-Y266 HydrophobicContact CG2-CD2 4.09Å; I262-Y266 HydrophobicContact CG2-CE2 4.37Å; I262-Y266 WeakPolarHBondContact O-CD2 3.43Å; I262-Y266 PolarHBondContact O-N 3.36Å; I262-Y266 VanDerWaalsContact O-N 3.1Å
263	T	94.7	Very high	95.8	Very high	39 Å²	39	39.9 Å²	39.9	24%	0.239	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-36.3	-176.6	-165.5	0	0	0	0	111.6	A150 A259 D260 Y266 G267	A150-T263 HydrophobicContact CB-CG2 3.74Å; A259-T263 PolarHBondContact O-N 2.8Å; D260-T263 WeakPolarHBondContact O-CG2 3.21Å; T263-Y266 PolarHBondContact O-N 3.02Å; T263-G267 PolarHBondContact O-N 3.12Å
264	T	94.1	Very high	95.8	Very high	8 Å²	8	33.8 Å²	33.8	5%	0.049	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-39	178.8	-55	0	0	0	0	112	K204 A208 D260 L261 I262 Y266 G268	K204-T264 HydrophobicContact CD-CG2 3.86Å; K204-T264 WeakPolarHBondContact CD-OG1 3.2Å; K204-T264 VanDerWaalsContact NZ-CG2 3.3Å; K204-T264 PolarHBondContact NZ-OG1 3.44Å; A208-T264 HydrophobicContact CB-CG2 3.46Å; A208-T264 VanDerWaalsContact CB-CG2 3.46Å; D260-T264 WeakPolarHBondContact O-CB 3.33Å; D260-T264 PolarHBondContact O-N 2.79Å; D260-T264 PolarHBondContact O-OG1 2.92Å; D260-T264 PolarHBondContact OD1-OG1 2.99Å; L261-T264 PolarHBondContact O-N 2.75Å; I262-T264 PolarHBondContact O-N 2.87Å; T264-Y266 VanDerWaalsContact C-N 3.26Å; T264-Y266 PolarHBondContact O-N 2.84Å; T264-G268 VanDerWaalsContact O-CA 3.3Å; T264-G268 WeakPolarHBondContact O-CA 3.49Å; T264-G268 PolarHBondContact O-N 2.87Å
265	C	97.2	Very high	95.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.4	-18.1	177.4	-71.9	0	0	0	0	113.8	A208 A211 I228 L261 I262 R271	A208-C265 VanDerWaalsContact CA-SG 3.55Å; A211-C265 HydrophobicContact CB-CB 3.82Å; I228-C265 HydrophobicContact CD1-CB 3.75Å; I228-C265 HydrophobicContact CG1-CB 3.83Å; L261-C265 WeakPolarHBondContact O-CB 3.4Å; L261-C265 PolarHBondContact O-N 2.94Å; L261-C265 PolarHBondContact O-SG 3.2Å; I262-C265 PolarHBondContact O-N 2.97Å; I262-C265 VanDerWaalsContact O-N 3.12Å; C265-R271 WeakPolarHBondContact O-CD 3.39Å; C265-R271 VanDerWaalsContact O-CG 3.26Å; C265-R271 WeakPolarHBondContact O-CG 3.5Å
266	Y	94.9	Very high	95.8	Very high	109 Å²	109	33.3 Å²	33.3	43%	0.427	18%	0.178	S	C	.	.	H	α-helix	trans	-102.4	-40.7	175.9	-81.7	-90.1	0	0	0	113.5	K224 I228 I262 T263 T264 R271	K224-Y266 HydrophobicContact CD-CD1 4.45Å; K224-Y266 HydrophobicContact CD-CE1 4Å; K224-Y266 HydrophobicContact CD-CE2 4.14Å; I228-Y266 HydrophobicContact CD1-CD2 4.41Å; I228-Y266 HydrophobicContact CD1-CE2 3.85Å; I262-Y266 HydrophobicContact CG2-CD2 4.09Å; I262-Y266 HydrophobicContact CG2-CE2 4.37Å; I262-Y266 WeakPolarHBondContact O-CD2 3.43Å; I262-Y266 PolarHBondContact O-N 3.36Å; I262-Y266 VanDerWaalsContact O-N 3.1Å; T263-Y266 PolarHBondContact O-N 3.02Å; T264-Y266 VanDerWaalsContact C-N 3.26Å; T264-Y266 PolarHBondContact O-N 2.84Å; Y266-R271 VanDerWaalsContact O-CD 3.24Å; Y266-R271 WeakPolarHBondContact O-CD 3.45Å; Y266-R271 PolarHBondContact O-NE 2.89Å; Y266-R271 VanDerWaalsContact O-NE 3.09Å
267	G	87.3	Confident	95.8	Very high	54 Å²	54	34.8 Å²	34.8	56%	0.557	18%	0.184	S	C	*	.	H	α-helix	trans	-121.7	-5.7	-171.5	0	0	0	0	0	115.7	T263	T263-G267 PolarHBondContact O-N 3.12Å
268	G	87.6	Confident	95.8	Very high	13 Å²	13	35.7 Å²	35.7	13%	0.134	19%	0.192	C	C	.	.			trans	-72.9	153.6	-171.9	0	0	0	0	0	114.8	T264 N270 R271 K272	T264-G268 VanDerWaalsContact O-CA 3.3Å; T264-G268 WeakPolarHBondContact O-CA 3.49Å; T264-G268 PolarHBondContact O-N 2.87Å; G268-N270 VanDerWaalsContact C-N 3.27Å; G268-N270 PolarHBondContact O-N 2.89Å; G268-R271 WeakPolarHBondContact O-CB 3.48Å; G268-R271 PolarHBondContact O-N 3.35Å; G268-K272 PolarHBondContact O-N 3.21Å; G268-K272 VanDerWaalsContact O-N 3.09Å
269	R	90.6	Very high	95.8	Very high	118 Å²	118	40.9 Å²	40.9	45%	0.445	21%	0.207	S	C	.	.	H	α-helix	trans	-56.8	-38.5	173.3	-67.9	169.6	-68.3	165.1	8.2	112.6	K272 V273 L292 Q295	R269-K272 PolarHBondContact O-N 2.71Å; R269-V273 PolarHBondContact O-N 2.95Å; R269-L292 HydrophobicContact CB-CD2 4.14Å; R269-L292 HydrophobicContact CG-CD2 4.1Å; R269-Q295 VanDerWaalsContact CD-OE1 3.28Å
270	N	94.6	Very high	95.8	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.059	22%	0.219	C	C	.	.	H	α-helix	trans	-58.7	-48	176.5	-64.2	-62.4	0	0	0	111.4	N205 A208 V209 G268 A274 L297 G299	N205-N270 VanDerWaalsContact CG-ND2 3.33Å; N205-N270 PolarHBondContact OD1-ND2 2.8Å; A208-N270 HydrophobicContact CB-CB 4.07Å; V209-N270 HydrophobicContact CG2-CB 3.99Å; G268-N270 VanDerWaalsContact C-N 3.27Å; G268-N270 PolarHBondContact O-N 2.89Å; N270-A274 WeakPolarHBondContact O-CB 3.36Å; N270-A274 PolarHBondContact O-N 3.22Å; N270-L297 HydrophobicContact CB-CD2 4.4Å; N270-L297 WeakPolarHBondContact OD1-CD2 3.36Å; N270-G299 PolarHBondContact OD1-N 2.95Å
271	R	97.3	Very high	95.7	Very high	34 Å²	34	46.4 Å²	46.4	13%	0.128	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-49.5	176.9	-172.9	-142.1	71.6	66.6	4.4	111.4	A208 G212 D215 C265 Y266 G268 V273 A274 E275	A208-R271 WeakPolarHBondContact O-CA 3.44Å; G212-R271 WeakPolarHBondContact CA-O 3.31Å; D215-R271 WeakPolarHBondContact OD2-CD 3.43Å; D215-R271 IonicContact OD2-CZ 3.57Å; D215-R271 IonicContact OD2-NE 3.68Å; D215-R271 IonicContact OD2-NH1 2.77Å; D215-R271 PolarHBondContact OD2-NH1 2.83Å; C265-R271 WeakPolarHBondContact O-CD 3.39Å; C265-R271 VanDerWaalsContact O-CG 3.26Å; C265-R271 WeakPolarHBondContact O-CG 3.5Å; Y266-R271 VanDerWaalsContact O-CD 3.24Å; Y266-R271 WeakPolarHBondContact O-CD 3.45Å; Y266-R271 PolarHBondContact O-NE 2.89Å; Y266-R271 VanDerWaalsContact O-NE 3.09Å; G268-R271 WeakPolarHBondContact O-CB 3.48Å; G268-R271 PolarHBondContact O-N 3.35Å; R271-V273 PolarHBondContact O-N 3.2Å; R271-A274 PolarHBondContact O-N 3.47Å; R271-E275 IonicContact CZ-OE2 3.5Å; R271-E275 IonicContact NH1-OE2 2.66Å; R271-E275 PolarHBondContact NH1-OE2 3.18Å; R271-E275 IonicContact NH2-OE2 3.9Å; R271-E275 PolarHBondContact NH2-OE2 3.39Å; R271-E275 WeakPolarHBondContact O-CB 3.4Å; R271-E275 PolarHBondContact O-N 3.21Å
272	K	96.4	Very high	95.7	Very high	108 Å²	108	49.8 Å²	49.8	47%	0.47	27%	0.266	S	S	.	.	H	α-helix	trans	-58.8	-44.3	-177.6	-171.9	-176.4	178.2	-178.8	0	112.9	G268 R269 A276 M291	G268-K272 PolarHBondContact O-N 3.21Å; G268-K272 VanDerWaalsContact O-N 3.09Å; R269-K272 PolarHBondContact O-N 2.71Å; K272-A276 PolarHBondContact O-N 3.39Å; K272-M291 HydrophobicContact CD-CE 4.08Å; K272-M291 HydrophobicContact CG-CE 3.74Å
273	V	97.7	Very high	95.6	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-75.9	-38.1	179.4	171.8	0	0	0	0	111.4	R269 R271 E275 A276 F277 I284 L287 M291 L292 L297	R269-V273 PolarHBondContact O-N 2.95Å; R271-V273 PolarHBondContact O-N 3.2Å; V273-E275 VanDerWaalsContact C-N 3.31Å; V273-E275 PolarHBondContact O-N 3.36Å; V273-A276 PolarHBondContact O-N 3.27Å; V273-F277 WeakPolarHBondContact O-CB 3.39Å; V273-F277 PolarHBondContact O-N 2.87Å; V273-I284 HydrophobicContact CG1-CD1 4.38Å; V273-L287 HydrophobicContact CG1-CB 3.68Å; V273-L287 HydrophobicContact CG1-CD1 4.2Å; V273-M291 HydrophobicContact CG2-CB 4.43Å; V273-M291 HydrophobicContact CG2-CE 4.33Å; V273-M291 HydrophobicContact CG2-SD 4.06Å; V273-L292 HydrophobicContact CG2-CD2 4.11Å; V273-L292 HydrophobicContact CG2-CG 4.32Å; V273-L297 HydrophobicContact CB-CD1 3.41Å; V273-L297 VanDerWaalsContact CB-CD1 3.41Å; V273-L297 HydrophobicContact CG1-CD1 3.42Å; V273-L297 VanDerWaalsContact CG1-CD1 3.42Å; V273-L297 HydrophobicContact CG2-CD1 3.49Å; V273-L297 VanDerWaalsContact CG2-CD1 3.49Å
274	A	98.3	Very high	95.5	Very high	2 Å²	2	48.3 Å²	48.3	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-36.2	175.9	0	0	0	0	0	112.6	V209 F213 N270 R271 F277 A278	V209-A274 HydrophobicContact CB-CB 4.29Å; V209-A274 HydrophobicContact CG1-CB 3.86Å; V209-A274 VanDerWaalsContact O-CB 3.29Å; V209-A274 WeakPolarHBondContact O-CB 3.42Å; F213-A274 HydrophobicContact CD1-CB 3.82Å; F213-A274 HydrophobicContact CE1-CB 3.84Å; N270-A274 WeakPolarHBondContact O-CB 3.36Å; N270-A274 PolarHBondContact O-N 3.22Å; R271-A274 PolarHBondContact O-N 3.47Å; A274-F277 WeakPolarHBondContact O-CB 3.43Å; A274-F277 PolarHBondContact O-N 3.19Å; A274-A278 WeakPolarHBondContact O-CB 3.48Å; A274-A278 PolarHBondContact O-N 2.96Å
275	E	98.6	Very high	95.4	Very high	34 Å²	34	53.5 Å²	53.5	16%	0.159	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-48.5	170.4	177.6	-170.4	-178.5	0	0	111.5	G212 D215 R271 V273 F277 A278 R279	G212-E275 WeakPolarHBondContact O-CA 3.43Å; G212-E275 PolarHBondContact O-N 3.21Å; D215-E275 HydrophobicContact CB-CB 4.17Å; D215-E275 HydrophobicContact CB-CG 3.91Å; R271-E275 IonicContact CZ-OE2 3.5Å; R271-E275 IonicContact NH1-OE2 2.66Å; R271-E275 PolarHBondContact NH1-OE2 3.18Å; R271-E275 IonicContact NH2-OE2 3.9Å; R271-E275 PolarHBondContact NH2-OE2 3.39Å; R271-E275 WeakPolarHBondContact O-CB 3.4Å; R271-E275 PolarHBondContact O-N 3.21Å; V273-E275 VanDerWaalsContact C-N 3.31Å; V273-E275 PolarHBondContact O-N 3.36Å; E275-F277 VanDerWaalsContact C-N 3.33Å; E275-F277 PolarHBondContact O-N 3.29Å; E275-A278 PolarHBondContact O-N 3.17Å; E275-R279 WeakPolarHBondContact O-CG 3.44Å; E275-R279 PolarHBondContact O-N 3.15Å; E275-R279 VanDerWaalsContact O-N 3.09Å; E275-R279 IonicContact OE1-CZ 3.73Å; E275-R279 IonicContact OE1-NH1 3.7Å; E275-R279 PolarHBondContact OE1-NH1 2.67Å; E275-R279 IonicContact OE1-NH2 2.96Å; E275-R279 PolarHBondContact OE1-NH2 3.27Å
276	A	98.3	Very high	95.3	Very high	17 Å²	17	57.2 Å²	57.2	14%	0.14	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-38.7	178.2	0	0	0	0	0	112.1	K272 V273 R279 T280 L287 M291	K272-A276 PolarHBondContact O-N 3.39Å; V273-A276 PolarHBondContact O-N 3.27Å; A276-R279 PolarHBondContact O-N 3.19Å; A276-T280 WeakPolarHBondContact O-CB 3.32Å; A276-T280 WeakPolarHBondContact O-CG2 3.21Å; A276-T280 PolarHBondContact O-N 2.83Å; A276-T280 PolarHBondContact O-OG1 2.83Å; A276-L287 HydrophobicContact CB-CD1 4.09Å; A276-L287 HydrophobicContact CB-CD2 4.02Å; A276-M291 HydrophobicContact CB-CE 4.04Å; A276-M291 HydrophobicContact CB-SD 3.81Å
277	F	98.3	Very high	95.4	Very high	31 Å²	31	52.2 Å²	52.2	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-52.5	173.8	173.1	-88.8	0	0	0	110.5	F213 V273 A274 E275 R279 T280 G281 K282 I284 L287 V328 V335	F213-F277 HydrophobicContact CD1-CD1 4.22Å; F213-F277 AromaticContact CE1-CD1 3.61Å; F213-F277 HydrophobicContact CE1-CD1 3.61Å; F213-F277 HydrophobicContact CE1-CE1 4.1Å; F213-F277 HydrophobicContact CE1-CG 4.4Å; F213-F277 HydrophobicContact CZ-CD1 4.4Å; V273-F277 WeakPolarHBondContact O-CB 3.39Å; V273-F277 PolarHBondContact O-N 2.87Å; A274-F277 WeakPolarHBondContact O-CB 3.43Å; A274-F277 PolarHBondContact O-N 3.19Å; E275-F277 VanDerWaalsContact C-N 3.33Å; E275-F277 PolarHBondContact O-N 3.29Å; F277-R279 VanDerWaalsContact C-N 3.26Å; F277-R279 PolarHBondContact O-N 2.88Å; F277-T280 PolarHBondContact O-N 3.44Å; F277-G281 PolarHBondContact O-N 2.88Å; F277-K282 WeakPolarHBondContact CD2-O 3.41Å; F277-I284 HydrophobicContact CB-CD1 3.98Å; F277-I284 HydrophobicContact CD2-CD1 3.59Å; F277-I284 HydrophobicContact CD2-CG1 3.93Å; F277-I284 HydrophobicContact CE2-CD1 4.29Å; F277-I284 HydrophobicContact CE2-CG1 4.21Å; F277-I284 HydrophobicContact CG-CD1 3.86Å; F277-L287 VanDerWaalsContact CA-CD1 3.43Å; F277-L287 HydrophobicContact CB-CD1 3.73Å; F277-L287 VanDerWaalsContact N-CD1 3.3Å; F277-V328 HydrophobicContact CD1-CG1 4.49Å; F277-V328 HydrophobicContact CE1-CG1 3.58Å; F277-V328 HydrophobicContact CZ-CG1 4.2Å; F277-V335 HydrophobicContact CE1-CB 4.43Å
278	A	98.1	Very high	95.5	Very high	18 Å²	18	50.5 Å²	50.5	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-30	-178	0	0	0	0	0	113.3	F213 A274 E275 V335	F213-A278 HydrophobicContact CD1-CB 4.36Å; A274-A278 WeakPolarHBondContact O-CB 3.48Å; A274-A278 PolarHBondContact O-N 2.96Å; E275-A278 PolarHBondContact O-N 3.17Å; A278-V335 HydrophobicContact CB-CG1 4.24Å; A278-V335 HydrophobicContact CB-CG2 3.84Å
279	R	98.2	Very high	95.7	Very high	151 Å²	151	56.7 Å²	56.7	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-83	-34.7	178.2	-72.9	-176.8	179.7	153.1	13.8	114.6	D215 G216 E275 A276 F277	D215-R279 PolarHBondContact O-NH2 2.99Å; G216-R279 WeakPolarHBondContact O-CG 3.43Å; E275-R279 WeakPolarHBondContact O-CG 3.44Å; E275-R279 PolarHBondContact O-N 3.15Å; E275-R279 VanDerWaalsContact O-N 3.09Å; E275-R279 IonicContact OE1-CZ 3.73Å; E275-R279 IonicContact OE1-NH1 3.7Å; E275-R279 PolarHBondContact OE1-NH1 2.67Å; E275-R279 IonicContact OE1-NH2 2.96Å; E275-R279 PolarHBondContact OE1-NH2 3.27Å; A276-R279 PolarHBondContact O-N 3.19Å; F277-R279 VanDerWaalsContact C-N 3.26Å; F277-R279 PolarHBondContact O-N 2.88Å
280	T	97.8	Very high	95.8	Very high	81 Å²	81	55.7 Å²	55.7	50%	0.497	28%	0.284	S	S	.	.	H	α-helix	trans	-108.4	-21.4	-166.6	65.3	0	0	0	0	113.8	A276 F277 K282	A276-T280 WeakPolarHBondContact O-CB 3.32Å; A276-T280 WeakPolarHBondContact O-CG2 3.21Å; A276-T280 PolarHBondContact O-N 2.83Å; A276-T280 PolarHBondContact O-OG1 2.83Å; F277-T280 PolarHBondContact O-N 3.44Å; T280-K282 PolarHBondContact O-N 2.95Å; T280-K282 PolarHBondContact OG1-N 3.3Å
281	G	94.4	Very high	95.7	Very high	67 Å²	67	57.7 Å²	57.7	69%	0.691	29%	0.294	S	S	*	.			trans	68.8	4.1	-172.5	0	0	0	0	0	114.5	F277	F277-G281 PolarHBondContact O-N 2.88Å
282	K	97.1	Very high	95.1	Very high	70 Å²	70	56.6 Å²	56.6	30%	0.304	29%	0.291	S	S	.	.			trans	-62.9	151.3	171.4	-71.7	-179.3	173.5	-166.8	0	110.3	F277 T280 Q286 L287 E290	F277-K282 WeakPolarHBondContact CD2-O 3.41Å; T280-K282 PolarHBondContact O-N 2.95Å; T280-K282 PolarHBondContact OG1-N 3.3Å; K282-Q286 HydrophobicContact CD-CG 4.33Å; K282-L287 HydrophobicContact CB-CD1 4.22Å; K282-L287 HydrophobicContact CB-CD2 4.03Å; K282-L287 HydrophobicContact CB-CG 3.9Å; K282-L287 HydrophobicContact CD-CD2 3.82Å; K282-E290 IonicContact NZ-OE1 3.89Å; K282-E290 PolarHBondContact NZ-OE1 3.07Å; K282-E290 IonicContact NZ-OE2 2.81Å; K282-E290 PolarHBondContact NZ-OE2 2.96Å
283	S	95.8	Very high	94.3	Very high	59 Å²	59	58.6 Å²	58.6	41%	0.413	31%	0.307	S	S	.	.			trans	-67.1	153.9	176.3	71.7	0	0	0	0	111.9	E285 Q286 L287	S283-E285 PolarHBondContact O-N 2.86Å; S283-Q286 PolarHBondContact O-N 3.18Å; S283-Q286 WeakPolarHBondContact OG-CB 3.47Å; S283-Q286 PolarHBondContact OG-N 2.91Å; S283-L287 PolarHBondContact O-N 3.29Å; S283-L287 VanDerWaalsContact O-N 3.08Å
284	I	93.7	Very high	93.1	Very high	29 Å²	29	62 Å²	62	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-55.8	-41.3	174.3	-64.7	-64.4	0	0	0	111	V273 F277 Q286 L287 E288 P300	V273-I284 HydrophobicContact CG1-CD1 4.38Å; F277-I284 HydrophobicContact CB-CD1 3.98Å; F277-I284 HydrophobicContact CD2-CD1 3.59Å; F277-I284 HydrophobicContact CD2-CG1 3.93Å; F277-I284 HydrophobicContact CE2-CD1 4.29Å; F277-I284 HydrophobicContact CE2-CG1 4.21Å; F277-I284 HydrophobicContact CG-CD1 3.86Å; I284-Q286 PolarHBondContact O-N 3.47Å; I284-L287 PolarHBondContact O-N 3.29Å; I284-E288 WeakPolarHBondContact O-CB 3.23Å; I284-E288 PolarHBondContact O-N 2.76Å; I284-P300 HydrophobicContact CG2-CG 4.06Å
285	E	92.4	Very high	92.1	Very high	116 Å²	116	65.9 Å²	65.9	54%	0.542	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-41.5	178.8	-169.3	-167.5	168	0	0	112.2	S283 E288 K289	S283-E285 PolarHBondContact O-N 2.86Å; E285-E288 PolarHBondContact O-N 3.01Å; E285-K289 WeakPolarHBondContact O-CG 3.44Å; E285-K289 PolarHBondContact O-N 2.93Å; E285-K289 WeakPolarHBondContact OE1-CE 3.29Å; E285-K289 IonicContact OE1-NZ 3.66Å; E285-K289 PolarHBondContact OE1-NZ 3.22Å
286	Q	94.9	Very high	91.1	Very high	78 Å²	78	68.3 Å²	68.3	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-47.6	177.9	-179.5	176.1	-4.3	0	0	110.8	K282 S283 I284 E288 K289 E290	K282-Q286 HydrophobicContact CD-CG 4.33Å; S283-Q286 PolarHBondContact O-N 3.18Å; S283-Q286 WeakPolarHBondContact OG-CB 3.47Å; S283-Q286 PolarHBondContact OG-N 2.91Å; I284-Q286 PolarHBondContact O-N 3.47Å; Q286-E288 VanDerWaalsContact C-N 3.32Å; Q286-E288 PolarHBondContact O-N 2.98Å; Q286-K289 PolarHBondContact O-N 2.86Å; Q286-E290 HydrophobicContact CG-CG 4.44Å; Q286-E290 VanDerWaalsContact CG-OE1 3.29Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.38Å; Q286-E290 PolarHBondContact NE2-OE1 2.98Å; Q286-E290 WeakPolarHBondContact O-CG 3.4Å; Q286-E290 PolarHBondContact O-N 3.35Å
287	L	95.9	Very high	90.5	Very high	4 Å²	4	67.8 Å²	67.8	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-66.4	-34.5	179.6	-66.5	170.3	0	0	0	112.3	V273 A276 F277 K282 S283 I284 E290 M291	V273-L287 HydrophobicContact CG1-CB 3.68Å; V273-L287 HydrophobicContact CG1-CD1 4.2Å; A276-L287 HydrophobicContact CB-CD1 4.09Å; A276-L287 HydrophobicContact CB-CD2 4.02Å; F277-L287 VanDerWaalsContact CA-CD1 3.43Å; F277-L287 HydrophobicContact CB-CD1 3.73Å; F277-L287 VanDerWaalsContact N-CD1 3.3Å; K282-L287 HydrophobicContact CB-CD1 4.22Å; K282-L287 HydrophobicContact CB-CD2 4.03Å; K282-L287 HydrophobicContact CB-CG 3.9Å; K282-L287 HydrophobicContact CD-CD2 3.82Å; S283-L287 PolarHBondContact O-N 3.29Å; S283-L287 VanDerWaalsContact O-N 3.08Å; I284-L287 PolarHBondContact O-N 3.29Å; L287-E290 PolarHBondContact O-N 3.5Å; L287-M291 HydrophobicContact CB-SD 4.08Å; L287-M291 HydrophobicContact CD2-SD 3.94Å; L287-M291 WeakPolarHBondContact O-CB 3.25Å; L287-M291 VanDerWaalsContact O-CG 3.27Å; L287-M291 WeakPolarHBondContact O-CG 3.24Å; L287-M291 PolarHBondContact O-N 3.06Å
288	E	90.3	Very high	89.9	Confident	19 Å²	19	67.3 Å²	67.3	9%	0.089	36%	0.363	C	S	.	.	H	α-helix	trans	-57.9	-48.9	173	-170.8	-176.2	-131.8	0	0	111	I284 E285 Q286 L292 K296 L297	I284-E288 WeakPolarHBondContact O-CB 3.23Å; I284-E288 PolarHBondContact O-N 2.76Å; E285-E288 PolarHBondContact O-N 3.01Å; Q286-E288 VanDerWaalsContact C-N 3.32Å; Q286-E288 PolarHBondContact O-N 2.98Å; E288-L292 HydrophobicContact CG-CD1 4.06Å; E288-L292 VanDerWaalsContact O-CB 3.32Å; E288-L292 WeakPolarHBondContact O-CB 3.33Å; E288-L292 PolarHBondContact O-N 2.9Å; E288-L292 VanDerWaalsContact O-N 3.1Å; E288-K296 VanDerWaalsContact OE1-CA 3.23Å; E288-K296 WeakPolarHBondContact OE1-CA 3.37Å; E288-K296 WeakPolarHBondContact OE1-CD 3.21Å; E288-K296 IonicContact OE1-NZ 2.69Å; E288-K296 IonicContact OE2-NZ 2.85Å; E288-K296 PolarHBondContact OE2-NZ 2.92Å; E288-L297 HydrophobicContact CG-CB 4.38Å; E288-L297 PolarHBondContact OE1-N 3.3Å
289	K	90.7	Very high	89.6	Confident	143 Å²	143	66.5 Å²	66.5	62%	0.622	36%	0.356	S	S	*	.	H	α-helix	trans	-64.4	-41.6	178.3	-70.4	175.1	-172.2	166.7	0	112.4	E285 Q286	E285-K289 WeakPolarHBondContact O-CG 3.44Å; E285-K289 PolarHBondContact O-N 2.93Å; E285-K289 WeakPolarHBondContact OE1-CE 3.29Å; E285-K289 IonicContact OE1-NZ 3.66Å; E285-K289 PolarHBondContact OE1-NZ 3.22Å; Q286-K289 PolarHBondContact O-N 2.86Å
290	E	94	Very high	89.5	Confident	96 Å²	96	59.5 Å²	59.5	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-73.4	-34	-177.3	-71.9	177.5	-172	0	0	113.2	K282 Q286 L287	K282-E290 IonicContact NZ-OE1 3.89Å; K282-E290 PolarHBondContact NZ-OE1 3.07Å; K282-E290 IonicContact NZ-OE2 2.81Å; K282-E290 PolarHBondContact NZ-OE2 2.96Å; Q286-E290 HydrophobicContact CG-CG 4.44Å; Q286-E290 VanDerWaalsContact CG-OE1 3.29Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.38Å; Q286-E290 PolarHBondContact NE2-OE1 2.98Å; Q286-E290 WeakPolarHBondContact O-CG 3.4Å; Q286-E290 PolarHBondContact O-N 3.35Å; L287-E290 PolarHBondContact O-N 3.5Å
291	M	92.4	Very high	89.1	Confident	54 Å²	54	57.7 Å²	57.7	27%	0.266	32%	0.316	S	S	.	.	H	α-helix	trans	-110.7	-20.6	-165.1	-58.5	175.8	67.7	0	0	114.7	K272 V273 A276 L287	K272-M291 HydrophobicContact CD-CE 4.08Å; K272-M291 HydrophobicContact CG-CE 3.74Å; V273-M291 HydrophobicContact CG2-CB 4.43Å; V273-M291 HydrophobicContact CG2-CE 4.33Å; V273-M291 HydrophobicContact CG2-SD 4.06Å; A276-M291 HydrophobicContact CB-CE 4.04Å; A276-M291 HydrophobicContact CB-SD 3.81Å; L287-M291 HydrophobicContact CB-SD 4.08Å; L287-M291 HydrophobicContact CD2-SD 3.94Å; L287-M291 WeakPolarHBondContact O-CB 3.25Å; L287-M291 VanDerWaalsContact O-CG 3.27Å; L287-M291 WeakPolarHBondContact O-CG 3.24Å; L287-M291 PolarHBondContact O-N 3.06Å
292	L	83.2	Confident	89	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.052	28%	0.283	C	S	.	.	S	Bend	trans	-110.4	1.5	-167.9	-59.5	-163.4	0	0	0	115.1	R269 V273 E288 G294 Q295 L297	R269-L292 HydrophobicContact CB-CD2 4.14Å; R269-L292 HydrophobicContact CG-CD2 4.1Å; V273-L292 HydrophobicContact CG2-CD2 4.11Å; V273-L292 HydrophobicContact CG2-CG 4.32Å; E288-L292 HydrophobicContact CG-CD1 4.06Å; E288-L292 VanDerWaalsContact O-CB 3.32Å; E288-L292 WeakPolarHBondContact O-CB 3.33Å; E288-L292 PolarHBondContact O-N 2.9Å; E288-L292 VanDerWaalsContact O-N 3.1Å; L292-G294 PolarHBondContact O-N 2.94Å; L292-G294 VanDerWaalsContact O-N 3.14Å; L292-Q295 HydrophobicContact CB-CB 4.14Å; L292-Q295 VanDerWaalsContact CB-O 3.31Å; L292-Q295 WeakPolarHBondContact CB-O 3.49Å; L292-Q295 WeakPolarHBondContact O-CB 3.35Å; L292-Q295 WeakPolarHBondContact O-CG 3.39Å; L292-Q295 PolarHBondContact O-N 3.06Å; L292-L297 HydrophobicContact CD1-CB 4.18Å; L292-L297 HydrophobicContact CD1-CD1 3.91Å; L292-L297 HydrophobicContact CD1-CG 4.18Å
293	N	79.9	Confident	88.9	Confident	150 Å²	150	51.1 Å²	51.1	80%	0.802	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	44.8	175.6	-66.4	-0.4	0	0	0	113.4
294	G	73.8	Confident	88.8	Confident	74 Å²	74	54.5 Å²	54.5	76%	0.763	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-3.6	-179.8	0	0	0	0	0	115.6	L292	L292-G294 PolarHBondContact O-N 2.94Å; L292-G294 VanDerWaalsContact O-N 3.14Å
295	Q	75.7	Confident	88.7	Confident	83 Å²	83	54.4 Å²	54.4	39%	0.388	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-76.5	149.5	169.3	-55	176.4	28.6	0	0	111	R269 L292	R269-Q295 VanDerWaalsContact CD-OE1 3.28Å; L292-Q295 HydrophobicContact CB-CB 4.14Å; L292-Q295 VanDerWaalsContact CB-O 3.31Å; L292-Q295 WeakPolarHBondContact CB-O 3.49Å; L292-Q295 WeakPolarHBondContact O-CB 3.35Å; L292-Q295 WeakPolarHBondContact O-CG 3.39Å; L292-Q295 PolarHBondContact O-N 3.06Å
296	K	77.9	Confident	88.8	Confident	84 Å²	84	48.9 Å²	48.9	37%	0.365	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-99	147.6	-177.3	-70.4	-61.7	-169.5	170.3	0	114.4	E288	E288-K296 VanDerWaalsContact OE1-CA 3.23Å; E288-K296 WeakPolarHBondContact OE1-CA 3.37Å; E288-K296 WeakPolarHBondContact OE1-CD 3.21Å; E288-K296 IonicContact OE1-NZ 2.69Å; E288-K296 IonicContact OE2-NZ 2.85Å; E288-K296 PolarHBondContact OE2-NZ 2.92Å
297	L	85	Confident	88.8	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.031	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-99.7	121.4	-178	-141.7	151.2	0	0	0	110	N270 V273 E288 L292 P300	N270-L297 HydrophobicContact CB-CD2 4.4Å; N270-L297 WeakPolarHBondContact OD1-CD2 3.36Å; V273-L297 HydrophobicContact CB-CD1 3.41Å; V273-L297 VanDerWaalsContact CB-CD1 3.41Å; V273-L297 HydrophobicContact CG1-CD1 3.42Å; V273-L297 VanDerWaalsContact CG1-CD1 3.42Å; V273-L297 HydrophobicContact CG2-CD1 3.49Å; V273-L297 VanDerWaalsContact CG2-CD1 3.49Å; E288-L297 HydrophobicContact CG-CB 4.38Å; E288-L297 PolarHBondContact OE1-N 3.3Å; L292-L297 HydrophobicContact CD1-CB 4.18Å; L292-L297 HydrophobicContact CD1-CD1 3.91Å; L292-L297 HydrophobicContact CD1-CG 4.18Å; L297-P300 HydrophobicContact CD2-CG 3.77Å
298	Q	86.7	Confident	88.7	Confident	22 Å²	22	47.2 Å²	47.2	10%	0.103	24%	0.24	C	C	.	.			trans	-98.5	-27.5	-168.8	-56.8	-70.8	-96.6	0	0	112.9	H95 E301 T302	H95-Q298 PolarHBondContact CE1-OE1 2.76Å; H95-Q298 PolarHBondContact ND1-OE1 3.2Å; Q298-E301 PolarHBondContact NE2-OE2 2.87Å; Q298-E301 PolarHBondContact O-N 3.5Å; Q298-T302 WeakPolarHBondContact O-CB 3.39Å; Q298-T302 PolarHBondContact O-N 2.88Å; Q298-T302 PolarHBondContact O-OG1 2.84Å; Q298-T302 VanDerWaalsContact O-OG1 3.06Å
299	G	92.8	Very high	88.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-54.7	-174.6	0	0	0	0	0	114.3	N270 E301 T302 A303	N270-G299 PolarHBondContact OD1-N 2.95Å; G299-E301 PolarHBondContact O-N 3.14Å; G299-T302 PolarHBondContact O-N 3.23Å; G299-A303 PolarHBondContact O-N 2.81Å
300	P	94.3	Very high	88.9	Confident	4 Å²	4	39.6 Å²	39.6	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-41.5	177.4	-26.3	37.6	0	0	0	112.6	V209 I284 L297 A303 R304 C329 Y330	V209-P300 HydrophobicContact CG2-CG 4.24Å; I284-P300 HydrophobicContact CG2-CG 4.06Å; L297-P300 HydrophobicContact CD2-CG 3.77Å; P300-A303 PolarHBondContact O-N 3.47Å; P300-R304 PolarHBondContact O-N 3.08Å; P300-C329 HydrophobicContact CB-CB 4.28Å; P300-Y330 HydrophobicContact CB-CE2 4.05Å; P300-Y330 WeakPolarHBondContact CB-OH 3.32Å; P300-Y330 WeakPolarHBondContact O-CE2 3.39Å; P300-Y330 PolarHBondContact O-OH 3.31Å
301	E	90.4	Very high	88.9	Confident	43 Å²	43	40.5 Å²	40.5	20%	0.201	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-46.8	178.4	-68.1	179.1	161.1	0	0	111	H95 Q298 G299 A303 R304 E305 Y330	H95-E301 IonicContact CE1-OE2 2.7Å; H95-E301 IonicContact NE2-OE2 2.73Å; Q298-E301 PolarHBondContact NE2-OE2 2.87Å; Q298-E301 PolarHBondContact O-N 3.5Å; G299-E301 PolarHBondContact O-N 3.14Å; E301-A303 VanDerWaalsContact C-N 3.32Å; E301-A303 PolarHBondContact O-N 2.81Å; E301-R304 WeakPolarHBondContact O-CB 3.39Å; E301-R304 PolarHBondContact O-N 3.25Å; E301-R304 VanDerWaalsContact O-N 3.14Å; E301-E305 PolarHBondContact O-N 3.18Å; E301-E305 VanDerWaalsContact O-N 3.07Å; E301-Y330 PolarHBondContact N-OH 2.93Å
302	T	92.3	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.2	-39.8	173.6	-59.3	0	0	0	0	111.7	I122 V206 Q298 G299 R304 E305 L306	I122-T302 HydrophobicContact CD1-CG2 4.15Å; I122-T302 HydrophobicContact CG1-CG2 4.27Å; V206-T302 HydrophobicContact CG2-CG2 3.75Å; Q298-T302 WeakPolarHBondContact O-CB 3.39Å; Q298-T302 PolarHBondContact O-N 2.88Å; Q298-T302 PolarHBondContact O-OG1 2.84Å; Q298-T302 VanDerWaalsContact O-OG1 3.06Å; G299-T302 PolarHBondContact O-N 3.23Å; T302-R304 VanDerWaalsContact C-N 3.28Å; T302-R304 PolarHBondContact O-N 2.83Å; T302-E305 PolarHBondContact O-N 2.95Å; T302-L306 HydrophobicContact CG2-CD1 4.39Å; T302-L306 HydrophobicContact CG2-CG 4.36Å; T302-L306 VanDerWaalsContact O-CG 3.29Å; T302-L306 WeakPolarHBondContact O-CG 3.42Å; T302-L306 PolarHBondContact O-N 2.83Å
303	A	95.5	Very high	89.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-36.6	176.9	0	0	0	0	0	112.5	V206 G299 P300 E301 L306 H307 V325	V206-A303 HydrophobicContact CG1-CB 4.01Å; V206-A303 HydrophobicContact CG2-CB 4.12Å; G299-A303 PolarHBondContact O-N 2.81Å; P300-A303 PolarHBondContact O-N 3.47Å; E301-A303 VanDerWaalsContact C-N 3.32Å; E301-A303 PolarHBondContact O-N 2.81Å; A303-L306 PolarHBondContact O-N 2.84Å; A303-H307 PolarHBondContact O-N 2.89Å; A303-V325 HydrophobicContact CB-CG1 4.02Å
304	R	93.6	Very high	89.9	Confident	129 Å²	129	45.2 Å²	45.2	49%	0.487	24%	0.243	S	C	.	.	H	α-helix	trans	-66.8	-41.5	174.2	-177.9	-177.4	66.6	176.8	-1.7	112	P300 E301 T302 H307 S308 Y326 Y330	P300-R304 PolarHBondContact O-N 3.08Å; E301-R304 WeakPolarHBondContact O-CB 3.39Å; E301-R304 PolarHBondContact O-N 3.25Å; E301-R304 VanDerWaalsContact O-N 3.14Å; T302-R304 VanDerWaalsContact C-N 3.28Å; T302-R304 PolarHBondContact O-N 2.83Å; R304-H307 PolarHBondContact O-N 2.84Å; R304-S308 PolarHBondContact O-N 3.31Å; R304-S308 VanDerWaalsContact O-N 3.08Å; R304-Y326 HydrophobicContact CB-CD2 4.18Å; R304-Y326 HydrophobicContact CB-CE2 4.23Å; R304-Y326 HydrophobicContact CG-CE2 4.17Å; R304-Y330 HydrophobicContact CB-CD2 4.42Å; R304-Y330 HydrophobicContact CB-CE2 3.87Å
305	E	91.8	Very high	90.9	Very high	28 Å²	28	43.3 Å²	43.3	13%	0.131	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-44.2	174.9	-69.5	166	172	0	0	111.3	I122 E301 T302 H307 S308 I309	I122-E305 HydrophobicContact CD1-CB 3.94Å; I122-E305 HydrophobicContact CG1-CB 4.09Å; I122-E305 WeakPolarHBondContact CG1-OE2 3.02Å; E301-E305 PolarHBondContact O-N 3.18Å; E301-E305 VanDerWaalsContact O-N 3.07Å; T302-E305 PolarHBondContact O-N 2.95Å; E305-H307 VanDerWaalsContact C-N 3.31Å; E305-H307 PolarHBondContact O-N 3.1Å; E305-S308 PolarHBondContact O-N 2.84Å; E305-I309 WeakPolarHBondContact O-CD1 3.5Å; E305-I309 VanDerWaalsContact O-CG1 3.31Å; E305-I309 WeakPolarHBondContact O-CG1 3.34Å; E305-I309 PolarHBondContact O-N 2.85Å
306	L	93.6	Very high	91.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.7	-42	174.6	-65.5	177.4	0	0	0	111.8	I122 L203 V206 F238 T302 A303 I309 L310 F322 M323	I122-L306 HydrophobicContact CD1-CD2 3.72Å; I122-L306 HydrophobicContact CD1-CG 4.25Å; L203-L306 HydrophobicContact CD2-CD1 3.66Å; L203-L306 HydrophobicContact CD2-CD2 3.47Å; L203-L306 VanDerWaalsContact CD2-CD2 3.47Å; L203-L306 HydrophobicContact CD2-CG 4.13Å; V206-L306 HydrophobicContact CG2-CD1 3.87Å; F238-L306 HydrophobicContact CD1-CD2 4.41Å; F238-L306 HydrophobicContact CD2-CD2 4.23Å; F238-L306 HydrophobicContact CE1-CD2 3.74Å; F238-L306 HydrophobicContact CE2-CD2 3.56Å; F238-L306 HydrophobicContact CZ-CD2 3.27Å; T302-L306 HydrophobicContact CG2-CD1 4.39Å; T302-L306 HydrophobicContact CG2-CG 4.36Å; T302-L306 VanDerWaalsContact O-CG 3.29Å; T302-L306 WeakPolarHBondContact O-CG 3.42Å; T302-L306 PolarHBondContact O-N 2.83Å; A303-L306 PolarHBondContact O-N 2.84Å; L306-I309 PolarHBondContact O-N 3.09Å; L306-L310 VanDerWaalsContact O-CB 3.3Å; L306-L310 WeakPolarHBondContact O-CB 3.44Å; L306-L310 WeakPolarHBondContact O-CG 3.4Å; L306-L310 PolarHBondContact O-N 2.98Å; L306-F322 HydrophobicContact CD1-CB 4.3Å; L306-F322 HydrophobicContact CD1-CD2 3.81Å; L306-F322 HydrophobicContact CD1-CE2 4.23Å; L306-F322 HydrophobicContact CD1-CG 4Å; L306-M323 HydrophobicContact CB-CE 4.19Å
307	H	95.3	Very high	92.6	Very high	24 Å²	24	43.7 Å²	43.7	11%	0.111	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-47.1	176.2	176.4	-94.6	0	0	0	111.6	A303 R304 E305 I309 L310 Q311 M323 Y326	A303-H307 PolarHBondContact O-N 2.89Å; R304-H307 PolarHBondContact O-N 2.84Å; E305-H307 VanDerWaalsContact C-N 3.31Å; E305-H307 PolarHBondContact O-N 3.1Å; H307-I309 PolarHBondContact O-N 2.88Å; H307-L310 PolarHBondContact O-N 3.45Å; H307-Q311 PolarHBondContact CE1-OE1 3.2Å; H307-Q311 WeakPolarHBondContact O-CB 3.1Å; H307-Q311 PolarHBondContact O-N 3.21Å; H307-M323 HydrophobicContact CB-CE 4.11Å; H307-M323 HydrophobicContact CB-SD 4.03Å; H307-Y326 HydrophobicContact CB-CD1 3.79Å; H307-Y326 HydrophobicContact CB-CD2 3.79Å; H307-Y326 HydrophobicContact CB-CE1 3.94Å; H307-Y326 HydrophobicContact CB-CE2 3.94Å; H307-Y326 HydrophobicContact CB-CG 3.71Å; H307-Y326 AromaticContact CD2-CD1 3.47Å; H307-Y326 VanDerWaalsContact CD2-CD1 3.47Å; H307-Y326 WeakPolarHBondContact CD2-CD1 3.35Å; H307-Y326 AromaticContact CD2-CE1 3.27Å; H307-Y326 WeakPolarHBondContact CD2-CE1 3.46Å; H307-Y326 AromaticContact CD2-CZ 3.97Å; H307-Y326 AromaticContact CE1-CE1 3.75Å; H307-Y326 AromaticContact CE1-CZ 3.89Å; H307-Y326 AromaticContact CG-CD1 3.58Å; H307-Y326 AromaticContact CG-CE1 3.31Å; H307-Y326 AromaticContact CG-CE2 3.99Å; H307-Y326 AromaticContact CG-CZ 3.55Å; H307-Y326 AromaticContact ND1-CE1 3.63Å; H307-Y326 AromaticContact ND1-CZ 3.5Å; H307-Y326 AromaticContact NE2-CE1 3.57Å
308	S	92.8	Very high	93	Very high	23 Å²	23	49.3 Å²	49.3	16%	0.161	25%	0.249	C	C	.	.	H	α-helix	trans	-57.2	-49.2	176.5	-170.1	0	0	0	0	111.8	E124 R304 E305 L310 Q311 H312	E124-S308 WeakPolarHBondContact OE1-CB 3.34Å; E124-S308 PolarHBondContact OE1-OG 3.23Å; R304-S308 PolarHBondContact O-N 3.31Å; R304-S308 VanDerWaalsContact O-N 3.08Å; E305-S308 PolarHBondContact O-N 2.84Å; S308-L310 PolarHBondContact O-N 3.14Å; S308-Q311 PolarHBondContact O-N 3.43Å; S308-H312 PolarHBondContact O-N 2.83Å; S308-H312 PolarHBondContact O-ND1 3.2Å; S308-H312 VanDerWaalsContact O-ND1 3.1Å; S308-H312 PolarHBondContact OG-CE1 2.71Å
309	I	92.1	Very high	93.5	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-46.9	-179.8	-66.6	162	0	0	0	111.2	I122 L129 F238 F242 E305 L306 H307 K313	I122-I309 HydrophobicContact CD1-CD1 4.05Å; L129-I309 HydrophobicContact CB-CD1 3.92Å; L129-I309 HydrophobicContact CD1-CD1 3.91Å; F238-I309 HydrophobicContact CZ-CG2 4.2Å; F242-I309 HydrophobicContact CD1-CG2 3.84Å; F242-I309 HydrophobicContact CE1-CG2 3.37Å; F242-I309 HydrophobicContact CZ-CG2 3.83Å; E305-I309 WeakPolarHBondContact O-CD1 3.5Å; E305-I309 VanDerWaalsContact O-CG1 3.31Å; E305-I309 WeakPolarHBondContact O-CG1 3.34Å; E305-I309 PolarHBondContact O-N 2.85Å; L306-I309 PolarHBondContact O-N 3.09Å; H307-I309 PolarHBondContact O-N 2.88Å; I309-K313 WeakPolarHBondContact O-CG 3.42Å; I309-K313 PolarHBondContact O-N 3.34Å
310	L	94.3	Very high	93.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.9	-37	-178.5	-68.9	173.6	0	0	0	112.1	F238 F242 L306 H307 S308 K313 G314 L315 V316 F319 M323	F238-L310 HydrophobicContact CD2-CD2 4.24Å; F238-L310 HydrophobicContact CE2-CD2 3.96Å; F238-L310 HydrophobicContact CE2-CG 4.2Å; F242-L310 HydrophobicContact CE2-CD2 3.82Å; F242-L310 HydrophobicContact CZ-CD2 3.86Å; L306-L310 VanDerWaalsContact O-CB 3.3Å; L306-L310 WeakPolarHBondContact O-CB 3.44Å; L306-L310 WeakPolarHBondContact O-CG 3.4Å; L306-L310 PolarHBondContact O-N 2.98Å; H307-L310 PolarHBondContact O-N 3.45Å; S308-L310 PolarHBondContact O-N 3.14Å; L310-K313 CarbonylContact O-C 3.58Å; L310-K313 PolarHBondContact O-N 2.98Å; L310-G314 PolarHBondContact O-N 2.85Å; L310-L315 HydrophobicContact CD2-CB 3.94Å; L310-L315 PolarHBondContact O-N 2.83Å; L310-V316 HydrophobicContact CB-CG2 4.07Å; L310-F319 HydrophobicContact CD1-CB 3.82Å; L310-F319 HydrophobicContact CD1-CD2 3.68Å; L310-F319 HydrophobicContact CD1-CG 3.93Å; L310-F319 HydrophobicContact CD2-CD2 3.33Å; L310-F319 HydrophobicContact CD2-CE2 3.42Å; L310-F319 VanDerWaalsContact CD2-CE2 3.42Å; L310-F319 HydrophobicContact CD2-CG 4.29Å; L310-F319 HydrophobicContact CD2-CZ 4.44Å; L310-F319 HydrophobicContact CG-CD2 4.16Å; L310-M323 HydrophobicContact CD1-CE 3.6Å; L310-M323 HydrophobicContact CD1-CG 4.38Å; L310-M323 HydrophobicContact CD1-SD 3.91Å
311	Q	94	Very high	94	Very high	115 Å²	115	49.5 Å²	49.5	54%	0.537	25%	0.252	S	S	.	.	H	α-helix	trans	-63	-47.5	176	-173.5	175.8	27.4	0	0	110.9	H307 S308 K313 G314 V316	H307-Q311 PolarHBondContact CE1-OE1 3.2Å; H307-Q311 WeakPolarHBondContact O-CB 3.1Å; H307-Q311 PolarHBondContact O-N 3.21Å; S308-Q311 PolarHBondContact O-N 3.43Å; Q311-K313 PolarHBondContact O-N 2.9Å; Q311-G314 PolarHBondContact O-N 3.29Å; Q311-G314 VanDerWaalsContact O-N 3.07Å; Q311-V316 HydrophobicContact CB-CG2 4.12Å
312	H	90.4	Very high	94.3	Very high	134 Å²	134	47.4 Å²	47.4	62%	0.62	24%	0.242	S	C	*	.	H	α-helix	trans	-60.8	-28.2	176.8	-71.3	139.9	0	0	0	113.6	E124 S308	E124-H312 IonicContact OE1-CE1 3.09Å; E124-H312 IonicContact OE1-ND1 2.64Å; S308-H312 PolarHBondContact O-N 2.83Å; S308-H312 PolarHBondContact O-ND1 3.2Å; S308-H312 VanDerWaalsContact O-ND1 3.1Å; S308-H312 PolarHBondContact OG-CE1 2.71Å
313	K	90.5	Very high	94.6	Very high	114 Å²	114	47.6 Å²	47.6	50%	0.496	24%	0.243	S	C	.	.	H	α-helix	trans	-93.3	-5.5	176.6	-63.6	-63.9	-175	178	0	114.3	F242 I309 L310 Q311 L315	F242-K313 HydrophobicContact CE1-CG 3.81Å; F242-K313 HydrophobicContact CZ-CG 4.15Å; I309-K313 WeakPolarHBondContact O-CG 3.42Å; I309-K313 PolarHBondContact O-N 3.34Å; L310-K313 CarbonylContact O-C 3.58Å; L310-K313 PolarHBondContact O-N 2.98Å; Q311-K313 PolarHBondContact O-N 2.9Å; K313-L315 VanDerWaalsContact C-N 3.32Å; K313-L315 HydrophobicContact CB-CB 4.39Å; K313-L315 HydrophobicContact CB-CD1 3.82Å; K313-L315 HydrophobicContact CB-CG 3.85Å
314	G	94.5	Very high	94.7	Very high	65 Å²	65	47.9 Å²	47.9	67%	0.67	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	34.7	-173.1	0	0	0	0	0	113.3	L310 Q311	L310-G314 PolarHBondContact O-N 2.85Å; Q311-G314 PolarHBondContact O-N 3.29Å; Q311-G314 VanDerWaalsContact O-N 3.07Å
315	L	95.4	Very high	95	Very high	35 Å²	35	41.8 Å²	41.8	18%	0.183	22%	0.222	C	C	.	.			trans	-117.4	11.9	-174.8	-61.5	178.6	0	0	0	113.8	L241 F242 L310 K313 D317 K318	L241-L315 HydrophobicContact CD1-CD1 4.33Å; F242-L315 HydrophobicContact CZ-CD1 4.1Å; L310-L315 HydrophobicContact CD2-CB 3.94Å; L310-L315 PolarHBondContact O-N 2.83Å; K313-L315 VanDerWaalsContact C-N 3.32Å; K313-L315 HydrophobicContact CB-CB 4.39Å; K313-L315 HydrophobicContact CB-CD1 3.82Å; K313-L315 HydrophobicContact CB-CG 3.85Å; L315-D317 PolarHBondContact O-N 3.36Å; L315-K318 HydrophobicContact CD2-CD 3.86Å; L315-K318 HydrophobicContact CD2-CG 4.43Å; L315-K318 WeakPolarHBondContact O-CB 3.35Å; L315-K318 PolarHBondContact O-N 2.87Å
316	V	95.5	Very high	95.3	Very high	29 Å²	29	41.8 Å²	41.8	18%	0.176	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-51	-43.9	-178.6	176	0	0	0	0	111.8	L310 Q311 K318 F319 M323	L310-V316 HydrophobicContact CB-CG2 4.07Å; Q311-V316 HydrophobicContact CB-CG2 4.12Å; V316-K318 PolarHBondContact O-N 3.16Å; V316-F319 PolarHBondContact O-N 3.42Å; V316-M323 HydrophobicContact CG1-CB 4.47Å; V316-M323 HydrophobicContact CG1-CG 3.76Å; V316-M323 HydrophobicContact CG1-SD 3.92Å; V316-M323 WeakPolarHBondContact O-CG 3.39Å
317	D	93.3	Very high	95.5	Very high	146 Å²	146	45 Å²	45	78%	0.781	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-71.8	-11.1	-176.1	-58.9	-35.9	0	0	0	114.1	L315 F319	L315-D317 PolarHBondContact O-N 3.36Å; D317-F319 VanDerWaalsContact C-N 3.33Å
318	K	94.5	Very high	95.6	Very high	123 Å²	123	44 Å²	44	54%	0.535	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-80.8	-12.5	177.3	-63.3	-161.1	-178.3	179.1	0	113.7	L315 V316 P320	L315-K318 HydrophobicContact CD2-CD 3.86Å; L315-K318 HydrophobicContact CD2-CG 4.43Å; L315-K318 WeakPolarHBondContact O-CB 3.35Å; L315-K318 PolarHBondContact O-N 2.87Å; V316-K318 PolarHBondContact O-N 3.16Å; K318-P320 VanDerWaalsContact C-CD 3.47Å
319	F	97.5	Very high	95.8	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	23%	0.23	C	C	.	.			trans	-129.1	61.4	-173.8	-62.2	-85.7	0	0	0	111.6	E234 A237 F238 L241 L310 V316 D317 L321 F322 M323	E234-F319 HydrophobicContact CB-CD1 3.99Å; E234-F319 HydrophobicContact CG-CD1 4.05Å; E234-F319 WeakPolarHBondContact O-CE1 3.5Å; A237-F319 HydrophobicContact CB-CE1 3.99Å; A237-F319 HydrophobicContact CB-CZ 4.37Å; F238-F319 HydrophobicContact CB-CD1 4.45Å; F238-F319 HydrophobicContact CB-CE1 3.64Å; F238-F319 HydrophobicContact CB-CZ 4.02Å; F238-F319 HydrophobicContact CD2-CD1 4.46Å; F238-F319 HydrophobicContact CD2-CE1 4.04Å; F238-F319 HydrophobicContact CD2-CE2 4.37Å; F238-F319 AromaticContact CD2-CZ 3.98Å; F238-F319 HydrophobicContact CD2-CZ 3.98Å; F238-F319 HydrophobicContact CG-CE1 4.36Å; F238-F319 HydrophobicContact CG-CZ 4.48Å; L241-F319 HydrophobicContact CD1-CE2 4.21Å; L241-F319 HydrophobicContact CD1-CZ 3.94Å; L310-F319 HydrophobicContact CD1-CB 3.82Å; L310-F319 HydrophobicContact CD1-CD2 3.68Å; L310-F319 HydrophobicContact CD1-CG 3.93Å; L310-F319 HydrophobicContact CD2-CD2 3.33Å; L310-F319 HydrophobicContact CD2-CE2 3.42Å; L310-F319 VanDerWaalsContact CD2-CE2 3.42Å; L310-F319 HydrophobicContact CD2-CG 4.29Å; L310-F319 HydrophobicContact CD2-CZ 4.44Å; L310-F319 HydrophobicContact CG-CD2 4.16Å; V316-F319 PolarHBondContact O-N 3.42Å; D317-F319 VanDerWaalsContact C-N 3.33Å; F319-L321 VanDerWaalsContact C-N 3.3Å; F319-L321 PolarHBondContact O-N 3.49Å; F319-F322 HydrophobicContact CB-CB 4.21Å; F319-F322 HydrophobicContact CB-CD2 4.1Å; F319-F322 HydrophobicContact CB-CG 4.5Å; F319-F322 AromaticContact CD1-CD2 3.85Å; F319-F322 HydrophobicContact CD1-CD2 3.85Å; F319-F322 HydrophobicContact CD1-CE2 4.04Å; F319-F322 HydrophobicContact CG-CD2 4.26Å; F319-F322 PolarHBondContact O-N 2.83Å; F319-M323 WeakPolarHBondContact O-CB 3.42Å; F319-M323 VanDerWaalsContact O-CG 3.23Å; F319-M323 WeakPolarHBondContact O-CG 3.36Å; F319-M323 PolarHBondContact O-N 3.44Å
320	P	97.6	Very high	96.1	Very high	28 Å²	28	48.2 Å²	48.2	18%	0.182	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-34.3	-173.1	26.2	-37.8	0	0	0	114.2	E234 K318 A324 C341 P346	E234-P320 WeakPolarHBondContact OE1-CD 3.4Å; E234-P320 WeakPolarHBondContact OE1-CG 3.2Å; K318-P320 VanDerWaalsContact C-CD 3.47Å; P320-A324 WeakPolarHBondContact O-CB 3.3Å; P320-A324 PolarHBondContact O-N 3.45Å; P320-C341 HydrophobicContact CB-CB 4.24Å; P320-P346 HydrophobicContact CG-CG 4.46Å
321	L	98.3	Very high	96.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.3	-50.5	179.1	-172.6	157.9	0	0	0	110.7	V207 V227 L230 E234 F319 M323 A324 V325 F338 L342	V207-L321 HydrophobicContact CG2-CD2 4.46Å; V227-L321 HydrophobicContact CG1-CD1 4.29Å; L230-L321 HydrophobicContact CB-CD1 4.04Å; E234-L321 VanDerWaalsContact OE1-CB 3.27Å; E234-L321 WeakPolarHBondContact OE1-CB 3.46Å; E234-L321 PolarHBondContact OE1-N 2.86Å; F319-L321 VanDerWaalsContact C-N 3.3Å; F319-L321 PolarHBondContact O-N 3.49Å; L321-M323 VanDerWaalsContact C-N 3.27Å; L321-M323 PolarHBondContact O-N 3.5Å; L321-A324 PolarHBondContact O-N 3.25Å; L321-V325 HydrophobicContact CD2-CG2 4.48Å; L321-V325 WeakPolarHBondContact O-CG2 3.48Å; L321-V325 PolarHBondContact O-N 3.18Å; L321-F338 HydrophobicContact CG-CZ 4.39Å; L321-L342 HydrophobicContact CD1-CD2 3.75Å; L321-L342 HydrophobicContact CG-CD2 4.34Å
322	F	98.1	Very high	96.2	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.7	-42.5	175.4	-66.6	-15.2	0	0	0	111.7	L203 V206 V207 E234 M235 F238 L306 F319 V325 Y326	L203-F322 HydrophobicContact CB-CZ 4.3Å; L203-F322 HydrophobicContact CD1-CE2 4.49Å; L203-F322 HydrophobicContact CD1-CZ 4.39Å; L203-F322 HydrophobicContact CD2-CE2 4.28Å; L203-F322 HydrophobicContact CD2-CZ 4.43Å; V206-F322 HydrophobicContact CB-CD1 4.27Å; V206-F322 HydrophobicContact CG1-CB 4.32Å; V206-F322 HydrophobicContact CG1-CD1 3.75Å; V206-F322 HydrophobicContact CG1-CE1 4.49Å; V206-F322 HydrophobicContact CG1-CG 4.3Å; V207-F322 HydrophobicContact CG2-CE1 3.79Å; E234-F322 HydrophobicContact CB-CD1 4.43Å; E234-F322 HydrophobicContact CB-CD2 4.26Å; E234-F322 HydrophobicContact CB-CE1 3.99Å; E234-F322 HydrophobicContact CB-CE2 3.81Å; E234-F322 HydrophobicContact CB-CZ 3.66Å; E234-F322 WeakPolarHBondContact OE2-CD1 3.44Å; E234-F322 WeakPolarHBondContact OE2-CD2 3.44Å; E234-F322 WeakPolarHBondContact OE2-CG 3.21Å; E234-F322 PolarHBondContact OE2-N 3.47Å; M235-F322 HydrophobicContact CG-CE1 4.42Å; M235-F322 HydrophobicContact CG-CZ 3.9Å; F238-F322 HydrophobicContact CB-CE2 4.17Å; F238-F322 HydrophobicContact CG-CE2 4.48Å; L306-F322 HydrophobicContact CD1-CB 4.3Å; L306-F322 HydrophobicContact CD1-CD2 3.81Å; L306-F322 HydrophobicContact CD1-CE2 4.23Å; L306-F322 HydrophobicContact CD1-CG 4Å; F319-F322 HydrophobicContact CB-CB 4.21Å; F319-F322 HydrophobicContact CB-CD2 4.1Å; F319-F322 HydrophobicContact CB-CG 4.5Å; F319-F322 AromaticContact CD1-CD2 3.85Å; F319-F322 HydrophobicContact CD1-CD2 3.85Å; F319-F322 HydrophobicContact CD1-CE2 4.04Å; F319-F322 HydrophobicContact CG-CD2 4.26Å; F319-F322 PolarHBondContact O-N 2.83Å; F322-V325 PolarHBondContact O-N 2.9Å; F322-Y326 PolarHBondContact O-N 2.75Å; F322-Y326 VanDerWaalsContact O-N 3.08Å
323	M	98.2	Very high	96.6	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.02	26%	0.259	C	S	.	.	H	α-helix	trans	-73	-33.7	-179.2	-63.8	-58.1	89.9	0	0	112.8	L306 H307 L310 V316 F319 L321 V325 Y326 K327	L306-M323 HydrophobicContact CB-CE 4.19Å; H307-M323 HydrophobicContact CB-CE 4.11Å; H307-M323 HydrophobicContact CB-SD 4.03Å; L310-M323 HydrophobicContact CD1-CE 3.6Å; L310-M323 HydrophobicContact CD1-CG 4.38Å; L310-M323 HydrophobicContact CD1-SD 3.91Å; V316-M323 HydrophobicContact CG1-CB 4.47Å; V316-M323 HydrophobicContact CG1-CG 3.76Å; V316-M323 HydrophobicContact CG1-SD 3.92Å; V316-M323 WeakPolarHBondContact O-CG 3.39Å; F319-M323 WeakPolarHBondContact O-CB 3.42Å; F319-M323 VanDerWaalsContact O-CG 3.23Å; F319-M323 WeakPolarHBondContact O-CG 3.36Å; F319-M323 PolarHBondContact O-N 3.44Å; L321-M323 VanDerWaalsContact C-N 3.27Å; L321-M323 PolarHBondContact O-N 3.5Å; M323-V325 VanDerWaalsContact C-N 3.32Å; M323-Y326 PolarHBondContact O-N 3.36Å; M323-K327 WeakPolarHBondContact O-CB 3.27Å; M323-K327 VanDerWaalsContact O-CG 3.23Å; M323-K327 WeakPolarHBondContact O-CG 3.15Å; M323-K327 PolarHBondContact O-N 3.31Å
324	A	98.3	Very high	96.9	Very high	6 Å²	6	45.6 Å²	45.6	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-40.7	171.6	0	0	0	0	0	111.3	P320 L321 K327 V328 F338 C341	P320-A324 WeakPolarHBondContact O-CB 3.3Å; P320-A324 PolarHBondContact O-N 3.45Å; L321-A324 PolarHBondContact O-N 3.25Å; A324-K327 PolarHBondContact O-N 3.34Å; A324-V328 WeakPolarHBondContact O-CB 3.33Å; A324-V328 VanDerWaalsContact O-CG2 3.23Å; A324-V328 WeakPolarHBondContact O-CG2 3.47Å; A324-V328 PolarHBondContact O-N 3.48Å; A324-F338 HydrophobicContact CB-CD2 3.88Å; A324-F338 HydrophobicContact CB-CE2 4.07Å; A324-C341 HydrophobicContact CB-CB 3.77Å
325	V	98.5	Very high	97.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-48.8	174.3	171.7	0	0	0	0	111.1	V206 V209 F213 A303 L321 F322 M323 C329 F338	V206-V325 HydrophobicContact CG1-CB 3.88Å; V206-V325 HydrophobicContact CG1-CG1 3.83Å; V206-V325 HydrophobicContact CG1-CG2 4.18Å; V209-V325 HydrophobicContact CB-CG1 3.82Å; V209-V325 HydrophobicContact CG1-CG1 3.59Å; F213-V325 HydrophobicContact CE2-CG2 4.42Å; A303-V325 HydrophobicContact CB-CG1 4.02Å; L321-V325 HydrophobicContact CD2-CG2 4.48Å; L321-V325 WeakPolarHBondContact O-CG2 3.48Å; L321-V325 PolarHBondContact O-N 3.18Å; F322-V325 PolarHBondContact O-N 2.9Å; M323-V325 VanDerWaalsContact C-N 3.32Å; V325-C329 WeakPolarHBondContact O-CB 3.37Å; V325-C329 PolarHBondContact O-N 3.49Å; V325-C329 PolarHBondContact O-SG 3.27Å; V325-C329 VanDerWaalsContact O-SG 3.38Å; V325-F338 HydrophobicContact CG2-CE2 3.95Å
326	Y	98.3	Very high	97.1	Very high	28 Å²	28	44.3 Å²	44.3	11%	0.11	25%	0.25	C	S	.	.	H	α-helix	trans	-57.6	-51.1	176.9	164.2	-101.8	0	0	0	112.3	R304 H307 F322 M323 V328 C329 Y330 E331	R304-Y326 HydrophobicContact CB-CD2 4.18Å; R304-Y326 HydrophobicContact CB-CE2 4.23Å; R304-Y326 HydrophobicContact CG-CE2 4.17Å; H307-Y326 HydrophobicContact CB-CD1 3.79Å; H307-Y326 HydrophobicContact CB-CD2 3.79Å; H307-Y326 HydrophobicContact CB-CE1 3.94Å; H307-Y326 HydrophobicContact CB-CE2 3.94Å; H307-Y326 HydrophobicContact CB-CG 3.71Å; H307-Y326 AromaticContact CD2-CD1 3.47Å; H307-Y326 VanDerWaalsContact CD2-CD1 3.47Å; H307-Y326 WeakPolarHBondContact CD2-CD1 3.35Å; H307-Y326 AromaticContact CD2-CE1 3.27Å; H307-Y326 WeakPolarHBondContact CD2-CE1 3.46Å; H307-Y326 AromaticContact CD2-CZ 3.97Å; H307-Y326 AromaticContact CE1-CE1 3.75Å; H307-Y326 AromaticContact CE1-CZ 3.89Å; H307-Y326 AromaticContact CG-CD1 3.58Å; H307-Y326 AromaticContact CG-CE1 3.31Å; H307-Y326 AromaticContact CG-CE2 3.99Å; H307-Y326 AromaticContact CG-CZ 3.55Å; H307-Y326 AromaticContact ND1-CE1 3.63Å; H307-Y326 AromaticContact ND1-CZ 3.5Å; H307-Y326 AromaticContact NE2-CE1 3.57Å; F322-Y326 PolarHBondContact O-N 2.75Å; F322-Y326 VanDerWaalsContact O-N 3.08Å; M323-Y326 PolarHBondContact O-N 3.36Å; Y326-V328 PolarHBondContact O-N 3.05Å; Y326-C329 PolarHBondContact O-N 3.43Å; Y326-C329 VanDerWaalsContact O-N 3.15Å; Y326-Y330 AromaticContact CD2-CD2 3.56Å; Y326-Y330 HydrophobicContact CD2-CD2 3.56Å; Y326-Y330 HydrophobicContact CD2-CE2 4.23Å; Y326-Y330 HydrophobicContact CD2-CG 4.35Å; Y326-Y330 AromaticContact CE2-CD2 3.83Å; Y326-Y330 HydrophobicContact CE2-CD2 3.83Å; Y326-Y330 HydrophobicContact CE2-CG 4.19Å; Y326-Y330 WeakPolarHBondContact O-CD2 3.48Å; Y326-Y330 PolarHBondContact O-N 2.94Å; Y326-E331 HydrophobicContact CE1-CG 3.98Å; Y326-E331 WeakPolarHBondContact CE1-OE1 3.1Å; Y326-E331 PolarHBondContact OH-OE1 3.13Å; Y326-E331 VanDerWaalsContact OH-OE1 3.13Å
327	K	98.3	Very high	97.2	Very high	69 Å²	69	46.1 Å²	46.1	30%	0.3	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-39.8	-177.3	-72.3	177.8	177.9	176.6	0	112.8	M323 A324 E331 G332 Q333	M323-K327 WeakPolarHBondContact O-CB 3.27Å; M323-K327 VanDerWaalsContact O-CG 3.23Å; M323-K327 WeakPolarHBondContact O-CG 3.15Å; M323-K327 PolarHBondContact O-N 3.31Å; A324-K327 PolarHBondContact O-N 3.34Å; K327-E331 HydrophobicContact CB-CB 4.47Å; K327-E331 WeakPolarHBondContact CG-OE2 3.48Å; K327-E331 CarbonylContact O-C 3.57Å; K327-E331 WeakPolarHBondContact O-CA 3.38Å; K327-E331 WeakPolarHBondContact O-CB 3.49Å; K327-E331 PolarHBondContact O-N 2.87Å; K327-G332 PolarHBondContact O-N 3.32Å; K327-Q333 HydrophobicContact CB-CB 3.93Å; K327-Q333 PolarHBondContact O-N 3.06Å
328	V	98.1	Very high	97.3	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-66.6	-40	175.4	172.2	0	0	0	0	111.1	F213 F277 A324 Y326 Q333 V335	F213-V328 HydrophobicContact CD2-CG1 4.33Å; F213-V328 HydrophobicContact CE1-CG1 4.1Å; F213-V328 HydrophobicContact CE2-CB 3.86Å; F213-V328 HydrophobicContact CE2-CG1 3.62Å; F213-V328 HydrophobicContact CE2-CG2 4.46Å; F213-V328 HydrophobicContact CZ-CB 4.07Å; F213-V328 HydrophobicContact CZ-CG1 3.49Å; F213-V328 VanDerWaalsContact CZ-CG1 3.49Å; F277-V328 HydrophobicContact CD1-CG1 4.49Å; F277-V328 HydrophobicContact CE1-CG1 3.58Å; F277-V328 HydrophobicContact CZ-CG1 4.2Å; A324-V328 WeakPolarHBondContact O-CB 3.33Å; A324-V328 VanDerWaalsContact O-CG2 3.23Å; A324-V328 WeakPolarHBondContact O-CG2 3.47Å; A324-V328 PolarHBondContact O-N 3.48Å; Y326-V328 PolarHBondContact O-N 3.05Å; V328-Q333 HydrophobicContact CG2-CB 4.08Å; V328-Q333 HydrophobicContact CG2-CG 4.24Å; V328-V335 HydrophobicContact CG1-CB 3.94Å; V328-V335 HydrophobicContact CG1-CG2 4.1Å
329	C	97.1	Very high	97.3	Very high	20 Å²	20	35.3 Å²	35.3	14%	0.135	21%	0.205	C	C	.	.	H	α-helix	trans	-73.7	-33.6	-179.4	-74.2	0	0	0	0	114.2	P300 V325 Y326	P300-C329 HydrophobicContact CB-CB 4.28Å; V325-C329 WeakPolarHBondContact O-CB 3.37Å; V325-C329 PolarHBondContact O-N 3.49Å; V325-C329 PolarHBondContact O-SG 3.27Å; V325-C329 VanDerWaalsContact O-SG 3.38Å; Y326-C329 PolarHBondContact O-N 3.43Å; Y326-C329 VanDerWaalsContact O-N 3.15Å
330	Y	96.9	Very high	97.1	Very high	92 Å²	92	41.7 Å²	41.7	36%	0.361	23%	0.229	S	C	.	.	H	α-helix	trans	-126.3	-26.1	-168	-63.4	-76.7	0	0	0	115.8	P300 E301 R304 Y326	P300-Y330 HydrophobicContact CB-CE2 4.05Å; P300-Y330 WeakPolarHBondContact CB-OH 3.32Å; P300-Y330 WeakPolarHBondContact O-CE2 3.39Å; P300-Y330 PolarHBondContact O-OH 3.31Å; E301-Y330 PolarHBondContact N-OH 2.93Å; R304-Y330 HydrophobicContact CB-CD2 4.42Å; R304-Y330 HydrophobicContact CB-CE2 3.87Å; Y326-Y330 AromaticContact CD2-CD2 3.56Å; Y326-Y330 HydrophobicContact CD2-CD2 3.56Å; Y326-Y330 HydrophobicContact CD2-CE2 4.23Å; Y326-Y330 HydrophobicContact CD2-CG 4.35Å; Y326-Y330 AromaticContact CE2-CD2 3.83Å; Y326-Y330 HydrophobicContact CE2-CD2 3.83Å; Y326-Y330 HydrophobicContact CE2-CG 4.19Å; Y326-Y330 WeakPolarHBondContact O-CD2 3.48Å; Y326-Y330 PolarHBondContact O-N 2.94Å
331	E	96.9	Very high	96.8	Very high	108 Å²	108	41.2 Å²	41.2	51%	0.505	23%	0.226	S	C	.	.	S	Bend	trans	-104.4	5.1	-175.5	-59	-167.8	166.1	0	0	112.9	Y326 K327 Q333	Y326-E331 HydrophobicContact CE1-CG 3.98Å; Y326-E331 WeakPolarHBondContact CE1-OE1 3.1Å; Y326-E331 PolarHBondContact OH-OE1 3.13Å; Y326-E331 VanDerWaalsContact OH-OE1 3.13Å; K327-E331 HydrophobicContact CB-CB 4.47Å; K327-E331 WeakPolarHBondContact CG-OE2 3.48Å; K327-E331 CarbonylContact O-C 3.57Å; K327-E331 WeakPolarHBondContact O-CA 3.38Å; K327-E331 WeakPolarHBondContact O-CB 3.49Å; K327-E331 PolarHBondContact O-N 2.87Å; E331-Q333 PolarHBondContact O-N 3.42Å
332	G	94.9	Very high	96.4	Very high	64 Å²	64	42 Å²	42	66%	0.66	23%	0.23	S	C	*	.			trans	70	19.2	178.6	0	0	0	0	0	113.6	K327	K327-G332 PolarHBondContact O-N 3.32Å
333	Q	97.4	Very high	96.1	Very high	55 Å²	55	48.1 Å²	48.1	26%	0.257	26%	0.258	S	S	.	.			trans	-58.4	129.5	172.1	-176.6	175.8	25.4	0	0	109.1	K327 V328 E331 V335	K327-Q333 HydrophobicContact CB-CB 3.93Å; K327-Q333 PolarHBondContact O-N 3.06Å; V328-Q333 HydrophobicContact CG2-CB 4.08Å; V328-Q333 HydrophobicContact CG2-CG 4.24Å; E331-Q333 PolarHBondContact O-N 3.42Å; Q333-V335 PolarHBondContact O-N 2.85Å
334	P	97.8	Very high	95.7	Very high	81 Å²	81	53.2 Å²	53.2	53%	0.526	29%	0.286	S	S	.	.			trans	-59.9	126.6	178.9	-22.8	32.7	0	0	0	110.8	G336 E337	P334-G336 PolarHBondContact O-N 3.48Å; P334-G336 VanDerWaalsContact O-N 3.09Å; P334-E337 HydrophobicContact CB-CG 4.32Å; P334-E337 WeakPolarHBondContact O-CB 3.33Å; P334-E337 PolarHBondContact O-N 2.9Å
335	V	97.5	Very high	95.4	Very high	27 Å²	27	53.1 Å²	53.1	16%	0.164	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-57.5	-29.2	-178.6	65	0	0	0	0	112.9	F213 L217 F277 A278 V328 Q333 E337 F338	F213-V335 HydrophobicContact CB-CG2 3.81Å; F213-V335 HydrophobicContact CD1-CG2 3.87Å; F213-V335 HydrophobicContact CD2-CG2 4.27Å; F213-V335 HydrophobicContact CG-CG2 3.75Å; L217-V335 HydrophobicContact CD1-CG2 4.37Å; L217-V335 HydrophobicContact CD2-CG1 4.21Å; F277-V335 HydrophobicContact CE1-CB 4.43Å; A278-V335 HydrophobicContact CB-CG1 4.24Å; A278-V335 HydrophobicContact CB-CG2 3.84Å; V328-V335 HydrophobicContact CG1-CB 3.94Å; V328-V335 HydrophobicContact CG1-CG2 4.1Å; Q333-V335 PolarHBondContact O-N 2.85Å; V335-E337 PolarHBondContact O-N 3.35Å; V335-E337 VanDerWaalsContact O-N 3.15Å; V335-F338 WeakPolarHBondContact O-CB 3.46Å; V335-F338 PolarHBondContact O-N 3.09Å
336	G	96.8	Very high	94.9	Very high	46 Å²	46	55.4 Å²	55.4	47%	0.474	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-62	-18	174.9	0	0	0	0	0	114.4	P334	P334-G336 PolarHBondContact O-N 3.48Å; P334-G336 VanDerWaalsContact O-N 3.09Å
337	E	96.1	Very high	94.2	Very high	66 Å²	66	58.1 Å²	58.1	31%	0.308	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-84.9	-8.6	174.5	-60.9	-161.6	148.8	0	0	113.7	P334 V335 I339 R340	P334-E337 HydrophobicContact CB-CG 4.32Å; P334-E337 WeakPolarHBondContact O-CB 3.33Å; P334-E337 PolarHBondContact O-N 2.9Å; V335-E337 PolarHBondContact O-N 3.35Å; V335-E337 VanDerWaalsContact O-N 3.15Å; E337-I339 PolarHBondContact O-N 3.23Å; E337-I339 VanDerWaalsContact O-N 3.12Å; E337-R340 VanDerWaalsContact CD-NH1 3.34Å; E337-R340 WeakPolarHBondContact O-CB 3.47Å; E337-R340 PolarHBondContact O-N 2.95Å; E337-R340 IonicContact OE1-CZ 2.73Å; E337-R340 IonicContact OE1-NH1 3.88Å; E337-R340 PolarHBondContact OE1-NH1 3Å; E337-R340 IonicContact OE2-NH1 2.69Å
338	F	97.1	Very high	93.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-52.7	-38.6	-177.7	179	-105.6	0	0	0	112.4	G210 F213 V227 L321 A324 V325 V335 R340 C341 L342	G210-F338 VanDerWaalsContact CA-CZ 3.45Å; G210-F338 WeakPolarHBondContact O-CE1 3.49Å; F213-F338 HydrophobicContact CB-CD1 4.38Å; F213-F338 HydrophobicContact CD2-CD2 4.01Å; F213-F338 HydrophobicContact CD2-CE2 4.28Å; F213-F338 HydrophobicContact CD2-CG 4.24Å; V227-F338 HydrophobicContact CG2-CE1 3.97Å; V227-F338 HydrophobicContact CG2-CZ 4.5Å; L321-F338 HydrophobicContact CG-CZ 4.39Å; A324-F338 HydrophobicContact CB-CD2 3.88Å; A324-F338 HydrophobicContact CB-CE2 4.07Å; V325-F338 HydrophobicContact CG2-CE2 3.95Å; V335-F338 WeakPolarHBondContact O-CB 3.46Å; V335-F338 PolarHBondContact O-N 3.09Å; F338-R340 PolarHBondContact O-N 2.83Å; F338-R340 VanDerWaalsContact O-N 3.09Å; F338-C341 PolarHBondContact O-N 3.2Å; F338-C341 VanDerWaalsContact O-N 3.14Å; F338-C341 PolarHBondContact O-SG 3.3Å; F338-L342 HydrophobicContact CE1-CD1 4.29Å
339	I	93.8	Very high	91.6	Very high	43 Å²	43	69.8 Å²	69.8	22%	0.221	37%	0.37	C	S	.	.	H	α-helix	trans	-57.9	-27.4	179.5	-165.1	58.4	0	0	0	113.5	F219 T223 E337 C341 L342 Q343	F219-I339 HydrophobicContact CE2-CB 4.33Å; F219-I339 HydrophobicContact CE2-CD1 4.35Å; F219-I339 HydrophobicContact CZ-CB 4.27Å; F219-I339 HydrophobicContact CZ-CD1 4.44Å; F219-I339 HydrophobicContact CZ-CG1 4.28Å; T223-I339 HydrophobicContact CG2-CD1 3.98Å; E337-I339 PolarHBondContact O-N 3.23Å; E337-I339 VanDerWaalsContact O-N 3.12Å; I339-C341 VanDerWaalsContact C-N 3.31Å; I339-C341 PolarHBondContact O-N 3.35Å; I339-L342 HydrophobicContact CD1-CD1 3.88Å; I339-L342 WeakPolarHBondContact O-CB 3.28Å; I339-L342 PolarHBondContact O-N 2.95Å; I339-Q343 WeakPolarHBondContact O-CG 3.36Å; I339-Q343 PolarHBondContact O-N 2.85Å
340	R	92.6	Very high	91.3	Very high	136 Å²	136	72.3 Å²	72.3	51%	0.513	38%	0.382	S	S	.	.	H	α-helix	trans	-67.3	-30.4	-179.1	-67.5	-178.8	173.8	160.2	2.4	112.6	E337 F338 L342 Q343 N344	E337-R340 VanDerWaalsContact CD-NH1 3.34Å; E337-R340 WeakPolarHBondContact O-CB 3.47Å; E337-R340 PolarHBondContact O-N 2.95Å; E337-R340 IonicContact OE1-CZ 2.73Å; E337-R340 IonicContact OE1-NH1 3.88Å; E337-R340 PolarHBondContact OE1-NH1 3Å; E337-R340 IonicContact OE2-NH1 2.69Å; F338-R340 PolarHBondContact O-N 2.83Å; F338-R340 VanDerWaalsContact O-N 3.09Å; R340-L342 PolarHBondContact O-N 2.85Å; R340-Q343 PolarHBondContact O-N 2.79Å; R340-N344 PolarHBondContact O-N 3.04Å; R340-N344 PolarHBondContact O-ND2 2.98Å
341	C	91.4	Very high	91	Very high	18 Å²	18	71.2 Å²	71.2	12%	0.122	38%	0.383	C	S	.	.	H	α-helix	trans	-66.8	-28.7	176.9	79.9	0	0	0	0	111.6	P320 A324 F338 I339 H345	P320-C341 HydrophobicContact CB-CB 4.24Å; A324-C341 HydrophobicContact CB-CB 3.77Å; F338-C341 PolarHBondContact O-N 3.2Å; F338-C341 VanDerWaalsContact O-N 3.14Å; F338-C341 PolarHBondContact O-SG 3.3Å; I339-C341 VanDerWaalsContact C-N 3.31Å; I339-C341 PolarHBondContact O-N 3.35Å; C341-H345 PolarHBondContact O-N 2.93Å
342	L	90.4	Very high	90.7	Very high	15 Å²	15	69.2 Å²	69.2	8%	0.079	38%	0.376	C	S	.	.	H	α-helix	trans	-78.3	-37.8	177.2	-48.7	178.6	0	0	0	111.4	V227 L230 L321 F338 I339 R340 N344 H345	V227-L342 HydrophobicContact CG2-CD1 3.42Å; V227-L342 VanDerWaalsContact CG2-CD1 3.42Å; V227-L342 HydrophobicContact CG2-CD2 4.15Å; V227-L342 HydrophobicContact CG2-CG 4.45Å; L230-L342 HydrophobicContact CD1-CB 4.14Å; L230-L342 HydrophobicContact CD1-CD2 3.91Å; L321-L342 HydrophobicContact CD1-CD2 3.75Å; L321-L342 HydrophobicContact CG-CD2 4.34Å; F338-L342 HydrophobicContact CE1-CD1 4.29Å; I339-L342 HydrophobicContact CD1-CD1 3.88Å; I339-L342 WeakPolarHBondContact O-CB 3.28Å; I339-L342 PolarHBondContact O-N 2.95Å; R340-L342 PolarHBondContact O-N 2.85Å; L342-N344 VanDerWaalsContact C-N 3.3Å; L342-N344 PolarHBondContact O-N 3.41Å; L342-H345 WeakPolarHBondContact O-CB 3.38Å; L342-H345 PolarHBondContact O-N 3.03Å
343	Q	91.1	Very high	90.4	Very high	129 Å²	129	69.5 Å²	69.5	60%	0.603	36%	0.36	S	S	*	.	H	α-helix	trans	-64.8	-32.7	179.8	-71	172.9	-28.9	0	0	113	I339 R340	I339-Q343 WeakPolarHBondContact O-CG 3.36Å; I339-Q343 PolarHBondContact O-N 2.85Å; R340-Q343 PolarHBondContact O-N 2.79Å
344	N	89.6	Confident	90	Very high	112 Å²	112	70.4 Å²	70.4	60%	0.599	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	25.2	-177.3	-58.6	-43.9	0	0	0	112.3	R340 L342	R340-N344 PolarHBondContact O-N 3.04Å; R340-N344 PolarHBondContact O-ND2 2.98Å; L342-N344 VanDerWaalsContact C-N 3.3Å; L342-N344 PolarHBondContact O-N 3.41Å
345	H	93.5	Very high	89.5	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.019	36%	0.355	C	S	.	.			trans	-71.2	135	-173.7	-164.8	-74.5	0	0	0	111.7	L230 E234 C341 L342 E347 H348	L230-H345 HydrophobicContact CD1-CB 4.18Å; L230-H345 HydrophobicContact CD2-CB 4.27Å; E234-H345 IonicContact OE1-CD2 2.82Å; E234-H345 IonicContact OE1-NE2 2.62Å; E234-H345 PolarHBondContact OE1-NE2 3.45Å; E234-H345 VanDerWaalsContact OE1-NE2 3.1Å; C341-H345 PolarHBondContact O-N 2.93Å; L342-H345 WeakPolarHBondContact O-CB 3.38Å; L342-H345 PolarHBondContact O-N 3.03Å; H345-E347 VanDerWaalsContact C-N 3.26Å; H345-E347 VanDerWaalsContact CE1-CG 3.47Å; H345-E347 WeakPolarHBondContact CE1-CG 3.44Å; H345-E347 WeakPolarHBondContact ND1-CG 3.27Å; H345-E347 PolarHBondContact ND1-N 2.91Å; H345-E347 PolarHBondContact O-N 2.77Å; H345-E347 VanDerWaalsContact O-N 3.13Å; H345-H348 PolarHBondContact O-N 2.95Å
346	P	87.1	Confident	88.9	Confident	48 Å²	48	72.7 Å²	72.7	31%	0.312	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-54.3	-32.3	-177.3	-29.4	33.9	0	0	0	116	P320 H348 M349	P320-P346 HydrophobicContact CG-CG 4.46Å; P346-H348 PolarHBondContact O-N 3.48Å; P346-M349 HydrophobicContact CB-CE 4.18Å; P346-M349 HydrophobicContact CG-CE 4.08Å; P346-M349 PolarHBondContact O-N 3.08Å
347	E	82.9	Confident	88.3	Confident	84 Å²	84	74.8 Å²	74.8	39%	0.393	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-58.7	-7.8	173.6	-66.1	-66	153.7	0	0	115.2	L230 M233 H345	L230-E347 HydrophobicContact CD2-CB 4.06Å; L230-E347 HydrophobicContact CD2-CG 4.41Å; M233-E347 HydrophobicContact CB-CG 3.88Å; M233-E347 VanDerWaalsContact CE-CD 3.46Å; M233-E347 HydrophobicContact CE-CG 4.47Å; M233-E347 WeakPolarHBondContact CE-OE2 3.39Å; M233-E347 HydrophobicContact CG-CG 4.13Å; H345-E347 VanDerWaalsContact C-N 3.26Å; H345-E347 VanDerWaalsContact CE1-CG 3.47Å; H345-E347 WeakPolarHBondContact CE1-CG 3.44Å; H345-E347 WeakPolarHBondContact ND1-CG 3.27Å; H345-E347 PolarHBondContact ND1-N 2.91Å; H345-E347 PolarHBondContact O-N 2.77Å; H345-E347 VanDerWaalsContact O-N 3.13Å
348	H	77.6	Confident	87.6	Confident	122 Å²	122	75.5 Å²	75.5	57%	0.565	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-116	0.4	176.7	-62.9	-51.5	0	0	0	113.5	R229 H345 P346	R229-H348 PolarHBondContact NH2-CE1 2.87Å; R229-H348 PolarHBondContact NH2-NE2 3.04Å; H345-H348 PolarHBondContact O-N 2.95Å; P346-H348 PolarHBondContact O-N 3.48Å
349	M	64.5	Low	86.8	Confident	195 Å²	195	82.4 Å²	82.4	96%	0.961	40%	0.399	S	S	*	.			trans	-104.6	0	177.6	-65.1	-168.9	-74.8	0	0	110.6	P346	P346-M349 HydrophobicContact CB-CE 4.18Å; P346-M349 HydrophobicContact CG-CE 4.08Å; P346-M349 PolarHBondContact O-N 3.08Å

Retrieved 349 of 349 residues in 72.5 ms (Link to these results)

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