A0A5K4EZL1_SCHMA Loading...

UPF0160 protein MYG1, mitochondrial

AlphaFold DB , UniProt , Accession A0A5K4EZL1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 346 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	76.1	Confident	242 Å²	242	91.5 Å²	91.5	100%	1.192	49%	0.49	S	S	*	.				0	98	0	-70.8	-172.6	-77.8	0	0	106.7	A3	M1-A3 PolarHBondContact O-N 2.88Å; M1-A3 VanDerWaalsContact O-N 3.16Å
2	V	43.6	Very low	78	Confident	136 Å²	136	84.6 Å²	84.6	82%	0.824	45%	0.453	S	S	*	.			trans	-70	110.2	168.6	-176.7	0	0	0	0	104	N4	V2-N4 PolarHBondContact O-N 2.86Å
3	A	47.9	Very low	79.5	Confident	85 Å²	85	82.9 Å²	82.9	70%	0.702	44%	0.444	S	S	*	.			trans	-50.8	126.2	167.8	0	0	0	0	0	106	M1 S5	M1-A3 PolarHBondContact O-N 2.88Å; M1-A3 VanDerWaalsContact O-N 3.16Å; A3-S5 VanDerWaalsContact C-N 3.25Å; A3-S5 PolarHBondContact O-N 3.22Å
4	N	55.9	Low	80.6	Confident	174 Å²	174	78.6 Å²	78.6	93%	0.93	43%	0.428	S	S	*	.			trans	-55.1	92.5	-175.1	-147.6	15	0	0	0	107.8	V2 R6	V2-N4 PolarHBondContact O-N 2.86Å; N4-R6 PolarHBondContact O-N 3.05Å
5	S	74.1	Confident	81.6	Confident	86 Å²	86	83.3 Å²	83.3	60%	0.601	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-71.8	127.9	-169.9	53.2	0	0	0	0	106.5	A3 L7	A3-S5 VanDerWaalsContact C-N 3.25Å; A3-S5 PolarHBondContact O-N 3.22Å; S5-L7 PolarHBondContact O-N 3.11Å; S5-L7 VanDerWaalsContact O-N 3.14Å
6	R	87.9	Confident	82.7	Confident	139 Å²	139	78.1 Å²	78.1	53%	0.525	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-50.6	120.3	174.1	-177.9	173.2	-178.5	-178.8	9.3	108.8	N4 N35 A36 E37	N4-R6 PolarHBondContact O-N 3.05Å; R6-N35 WeakPolarHBondContact CD-O 3.43Å; R6-N35 WeakPolarHBondContact CG-O 3.16Å; R6-N35 VanDerWaalsContact CZ-O 3.3Å; R6-N35 PolarHBondContact NE-O 3.49Å; R6-N35 PolarHBondContact NH2-O 3.29Å; R6-A36 PolarHBondContact NE-O 2.86Å; R6-A36 PolarHBondContact NH2-O 2.97Å; R6-E37 HydrophobicContact CG-CB 4.11Å; R6-E37 VanDerWaalsContact CZ-CA 3.5Å; R6-E37 VanDerWaalsContact NE-CA 3.3Å
7	L	97.1	Very high	83.6	Confident	48 Å²	48	77.9 Å²	77.9	25%	0.251	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-59.6	156.9	173.1	-61.8	-167.6	0	0	0	110.1	S5 E32 Y33 A36 E37 D51	S5-L7 PolarHBondContact O-N 3.11Å; S5-L7 VanDerWaalsContact O-N 3.14Å; L7-E32 HydrophobicContact CD1-CB 3.98Å; L7-E32 WeakPolarHBondContact CD1-O 3.5Å; L7-Y33 HydrophobicContact CB-CD1 3.96Å; L7-Y33 HydrophobicContact CB-CE1 4.14Å; L7-Y33 HydrophobicContact CD1-CD1 3.87Å; L7-Y33 HydrophobicContact CD1-CE1 3.66Å; L7-A36 HydrophobicContact CB-CB 4.29Å; L7-A36 CarbonylContact O-C 3.46Å; L7-A36 WeakPolarHBondContact O-CA 3.31Å; L7-A36 WeakPolarHBondContact O-CB 3.33Å; L7-E37 PolarHBondContact O-N 3.24Å; L7-D51 WeakPolarHBondContact CA-OD2 3.31Å; L7-D51 HydrophobicContact CB-CB 4.32Å; L7-D51 WeakPolarHBondContact CB-OD2 3.4Å; L7-D51 HydrophobicContact CD2-CB 4.37Å
8	R	98.4	Very high	84.4	Confident	96 Å²	96	73.8 Å²	73.8	36%	0.362	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.7	-176	-72.1	174.4	174.7	173.6	2.8	111.2	E37 I39 T49 C50 D51 I52	R8-E37 CarbonylContact C-O 3.31Å; R8-E37 VanDerWaalsContact CA-O 3.32Å; R8-E37 WeakPolarHBondContact CA-O 3.37Å; R8-E37 HydrophobicContact CG-CB 4.31Å; R8-E37 IonicContact NE-OE2 3.23Å; R8-I39 HydrophobicContact CB-CG1 4.21Å; R8-I39 HydrophobicContact CG-CG1 4.12Å; R8-T49 PolarHBondContact NH1-OG1 3.44Å; R8-C50 HydrophobicContact CB-CB 4.15Å; R8-D51 PolarHBondContact N-OD2 2.9Å; R8-D51 PolarHBondContact O-N 3.32Å; R8-I52 PolarHBondContact O-N 2.91Å
9	I	98.7	Very high	85.2	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114.6	170.1	-57.5	167.2	0	0	0	107.2	L27 K28 Y33 A36 E37 I38 I39 I52 V54	I9-L27 HydrophobicContact CD1-CB 3.92Å; I9-L27 HydrophobicContact CD1-CD1 4.37Å; I9-L27 HydrophobicContact CG1-CD1 4.44Å; I9-L27 HydrophobicContact CG2-CD1 4.08Å; I9-K28 HydrophobicContact CD1-CG 4.03Å; I9-Y33 HydrophobicContact CG1-CD1 4.11Å; I9-A36 HydrophobicContact CD1-CB 3.92Å; I9-A36 HydrophobicContact CG1-CB 3.93Å; I9-E37 PolarHBondContact N-O 3.11Å; I9-I38 HydrophobicContact CB-CG1 4.37Å; I9-I38 HydrophobicContact CD1-CG1 4.44Å; I9-I38 CarbonylContact O-C 3.57Å; I9-I38 WeakPolarHBondContact O-CA 3.49Å; I9-I39 PolarHBondContact O-N 2.87Å; I9-I52 CarbonylContact C-O 3.17Å; I9-I52 WeakPolarHBondContact CA-O 3.35Å; I9-I52 HydrophobicContact CB-CG2 4.16Å; I9-I52 HydrophobicContact CG1-CG2 3.74Å; I9-I52 HydrophobicContact CG2-CG2 4.22Å; I9-V54 HydrophobicContact CG2-CG2 4.43Å
10	G	98.7	Very high	85.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.3	174.6	0	0	0	0	0	111.5	I39 I52 V53 V54	G10-I39 WeakPolarHBondContact CA-O 3.41Å; G10-I52 PolarHBondContact N-O 3.13Å; G10-V53 CarbonylContact O-C 3.51Å; G10-V53 WeakPolarHBondContact O-CA 3.26Å; G10-V54 PolarHBondContact O-N 3.23Å
11	T	98.7	Very high	86.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	176.8	167.5	-169.3	0	0	0	0	109.7	I38 I39 R40 T41 V54 F180	T11-I38 HydrophobicContact CG2-CG2 4.04Å; T11-I39 PolarHBondContact N-O 3.33Å; T11-R40 HydrophobicContact CG2-CG 3.87Å; T11-R40 CarbonylContact O-C 3.42Å; T11-R40 VanDerWaalsContact O-CA 3.29Å; T11-R40 WeakPolarHBondContact O-CA 3.23Å; T11-T41 PolarHBondContact O-N 3.18Å; T11-T41 VanDerWaalsContact O-O 3.05Å; T11-V54 WeakPolarHBondContact CA-O 3.42Å; T11-V54 PolarHBondContact OG1-O 2.71Å; T11-V54 VanDerWaalsContact OG1-O 3.13Å; T11-F180 HydrophobicContact CG2-CE2 4.32Å; T11-F180 HydrophobicContact CG2-CZ 4.14Å
12	H	98.3	Very high	89.5	Confident	9 Å²	9	51.9 Å²	51.9	4%	0.042	27%	0.274	C	S	.	.			trans	-76.6	153.8	-177.5	73.7	68.4	0	0	0	113.2	R15 E20 R40 R42 D55 V56	H12-R15 PolarHBondContact CE1-O 3.26Å; H12-E20 IonicContact CE1-OE1 3.35Å; H12-E20 IonicContact NE2-OE1 2.94Å; H12-E20 PolarHBondContact NE2-OE1 2.96Å; H12-R40 PolarHBondContact O-NE 3.47Å; H12-R40 PolarHBondContact O-NH2 2.96Å; H12-R42 HydrophobicContact CB-CG 4.14Å; H12-R42 PolarHBondContact ND1-NH2 2.86Å; H12-D55 IonicContact CD2-OD2 3.08Å; H12-D55 PolarHBondContact CD2-OD2 2.76Å; H12-D55 VanDerWaalsContact CD2-OD2 3.23Å; H12-D55 IonicContact NE2-OD2 2.75Å; H12-D55 PolarHBondContact NE2-OD2 3.48Å; H12-V56 HydrophobicContact CB-CB 3.98Å; H12-V56 HydrophobicContact CB-CG2 3.81Å
13	D	97.3	Very high	92.1	Very high	63 Å²	63	45.4 Å²	45.4	34%	0.337	24%	0.235	S	C	.	.			trans	-83.4	176.8	168.5	59.7	-32.7	0	0	0	112.1	R40 R42	D13-R40 HydrophobicContact CB-CB 4.41Å; D13-R42 PolarHBondContact O-NH1 2.87Å; D13-R42 PolarHBondContact O-NH2 3.25Å; D13-R42 WeakPolarHBondContact OD1-CG 3.34Å; D13-R42 IonicContact OD1-CZ 3.91Å; D13-R42 PolarHBondContact OD1-N 3.45Å; D13-R42 IonicContact OD1-NH1 2.77Å; D13-R42 PolarHBondContact OD1-NH1 3.42Å
14	G	95	Very high	94.5	Very high	22 Å²	22	41.3 Å²	41.3	23%	0.227	20%	0.202	C	C	.	.	S	Bend	trans	78.2	-149.2	179.1	0	0	0	0	0	113.3	F16 R40 E176	G14-F16 PolarHBondContact O-N 3.47Å; G14-R40 PolarHBondContact O-NH2 3.43Å; G14-E176 VanDerWaalsContact CA-OE1 3.31Å; G14-E176 WeakPolarHBondContact CA-OE1 3.28Å; G14-E176 WeakPolarHBondContact CA-OE2 3.47Å; G14-E176 PolarHBondContact N-OE1 2.62Å
15	R	96.3	Very high	96.6	Very high	149 Å²	149	33.1 Å²	33.1	56%	0.562	16%	0.158	S	C	*	.	S	Bend	trans	-62.7	121.8	-177.6	-175.4	-180	-170.9	169.4	-3.7	110.6	H12 N163 N166	H12-R15 PolarHBondContact CE1-O 3.26Å; R15-N163 PolarHBondContact NE-OD1 3.45Å; R15-N163 PolarHBondContact NH2-OD1 3.49Å; R15-N166 VanDerWaalsContact CA-OD1 3.32Å; R15-N166 WeakPolarHBondContact CA-OD1 3.41Å
16	F	98.3	Very high	97.8	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.129	C	C	.	.			trans	-98.6	153.1	177.9	55.7	-100.7	0	0	0	112.9	G14 E20 I21 V162 M165 N166 C179 F180 A183	G14-F16 PolarHBondContact O-N 3.47Å; F16-E20 VanDerWaalsContact C-OE1 3.3Å; F16-E20 WeakPolarHBondContact CA-OE1 3.48Å; F16-E20 WeakPolarHBondContact CB-OE1 3.37Å; F16-I21 HydrophobicContact CB-CD1 4.26Å; F16-I21 HydrophobicContact CB-CG1 4.46Å; F16-I21 HydrophobicContact CD2-CD1 4Å; F16-I21 HydrophobicContact CD2-CG1 4.14Å; F16-I21 HydrophobicContact CG-CD1 4.2Å; F16-V162 HydrophobicContact CD2-CG1 3.77Å; F16-V162 HydrophobicContact CE2-CG1 3.89Å; F16-M165 HydrophobicContact CE2-CB 4.26Å; F16-M165 HydrophobicContact CZ-CB 4.2Å; F16-N166 VanDerWaalsContact CD1-OD1 3.27Å; F16-N166 WeakPolarHBondContact CD1-OD1 3.49Å; F16-N166 WeakPolarHBondContact CE1-OD1 3.39Å; F16-N166 WeakPolarHBondContact CG-OD1 3.45Å; F16-N166 HydrophobicContact CZ-CB 4.42Å; F16-N166 PolarHBondContact N-OD1 3.49Å; F16-N166 PolarHBondContact O-ND2 2.89Å; F16-C179 HydrophobicContact CE1-CB 3.9Å; F16-C179 HydrophobicContact CZ-CB 4.01Å; F16-F180 HydrophobicContact CB-CD2 4.01Å; F16-F180 HydrophobicContact CB-CE2 4.29Å; F16-F180 HydrophobicContact CD1-CB 4.18Å; F16-F180 AromaticContact CD1-CD2 3.87Å; F16-F180 HydrophobicContact CD1-CD2 3.87Å; F16-F180 HydrophobicContact CE1-CB 4.07Å; F16-F180 AromaticContact CG-CD2 3.96Å; F16-F180 HydrophobicContact CG-CD2 3.96Å; F16-A183 HydrophobicContact CD2-CB 4.21Å; F16-A183 HydrophobicContact CE2-CB 3.53Å; F16-A183 HydrophobicContact CZ-CB 4.06Å
17	H	98.6	Very high	98.3	Very high	76 Å²	76	22.4 Å²	22.4	35%	0.352	10%	0.104	S	C	.	.			trans	-115.6	-172	179.3	-54	104.4	0	0	0	109.9	D19 E20 I21 V162	H17-D19 WeakPolarHBondContact CB-OD1 3.48Å; H17-E20 VanDerWaalsContact CA-OE2 3.27Å; H17-E20 WeakPolarHBondContact CA-OE2 3.35Å; H17-E20 WeakPolarHBondContact CB-OE2 3.45Å; H17-E20 VanDerWaalsContact N-CD 3.29Å; H17-E20 PolarHBondContact N-OE1 3.23Å; H17-E20 PolarHBondContact N-OE2 3.14Å; H17-E20 VanDerWaalsContact N-OE2 3.11Å; H17-I21 WeakPolarHBondContact O-CG1 3.42Å; H17-V162 VanDerWaalsContact O-CG1 3.29Å; H17-V162 WeakPolarHBondContact O-CG1 3.4Å
18	A	98.7	Very high	98.3	Very high	4 Å²	4	22.7 Å²	22.7	3%	0.033	10%	0.104	C	C	.	.	S	Bend	trans	-89.2	-25.7	-174.9	0	0	0	0	0	113	L22 I136 S159 V162	A18-L22 WeakPolarHBondContact O-CB 3.21Å; A18-L22 PolarHBondContact O-N 3.2Å; A18-I136 HydrophobicContact CB-CD1 4.17Å; A18-I136 HydrophobicContact CB-CG2 4.47Å; A18-S159 WeakPolarHBondContact CB-OG 3.42Å; A18-V162 HydrophobicContact CB-CB 4.39Å; A18-V162 HydrophobicContact CB-CG2 4.28Å
19	D	98.8	Very high	98.3	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.011	10%	0.097	C	C	.	.	H	α-helix	trans	-72.1	-47.1	-174.8	65.1	-63.4	0	0	0	111.7	H17 I21 L22 A23 S92 S93 A94 I136 D140	H17-D19 WeakPolarHBondContact CB-OD1 3.48Å; D19-I21 VanDerWaalsContact C-N 3.33Å; D19-I21 PolarHBondContact O-N 3.33Å; D19-L22 PolarHBondContact O-N 3.35Å; D19-A23 WeakPolarHBondContact O-CB 3.45Å; D19-A23 PolarHBondContact O-N 2.87Å; D19-S92 VanDerWaalsContact CB-OG 3.24Å; D19-S92 WeakPolarHBondContact CB-OG 3.45Å; D19-S93 VanDerWaalsContact C-OG 3.24Å; D19-S93 PolarHBondContact O-OG 3.47Å; D19-S93 PolarHBondContact OD2-OG 3.16Å; D19-A94 HydrophobicContact CB-CB 4.02Å; D19-A94 WeakPolarHBondContact O-CB 3.5Å; D19-I136 VanDerWaalsContact CA-CG2 3.47Å; D19-I136 HydrophobicContact CB-CG2 3.62Å; D19-D140 HydrophobicContact CB-CB 4.28Å
20	E	98.7	Very high	98.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-73.5	-30.8	179.9	85.1	-76.2	-159.7	0	0	111.6	H12 F16 H17 C24 D55 S93	H12-E20 IonicContact CE1-OE1 3.35Å; H12-E20 IonicContact NE2-OE1 2.94Å; H12-E20 PolarHBondContact NE2-OE1 2.96Å; F16-E20 VanDerWaalsContact C-OE1 3.3Å; F16-E20 WeakPolarHBondContact CA-OE1 3.48Å; F16-E20 WeakPolarHBondContact CB-OE1 3.37Å; H17-E20 VanDerWaalsContact CA-OE2 3.27Å; H17-E20 WeakPolarHBondContact CA-OE2 3.35Å; H17-E20 WeakPolarHBondContact CB-OE2 3.45Å; H17-E20 VanDerWaalsContact N-CD 3.29Å; H17-E20 PolarHBondContact N-OE1 3.23Å; H17-E20 PolarHBondContact N-OE2 3.14Å; H17-E20 VanDerWaalsContact N-OE2 3.11Å; E20-C24 WeakPolarHBondContact O-CB 3.12Å; E20-C24 PolarHBondContact O-N 2.9Å; E20-C24 PolarHBondContact O-SG 2.86Å; E20-D55 HydrophobicContact CB-CB 3.51Å; E20-D55 HydrophobicContact CG-CB 4.47Å; E20-S93 VanDerWaalsContact CA-OG 3.29Å; E20-S93 WeakPolarHBondContact CA-OG 3.16Å; E20-S93 PolarHBondContact N-OG 3.12Å
21	I	98.8	Very high	98.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-45.4	170.1	-60	-75.7	0	0	0	110.2	F16 H17 D19 C24 A25 V162 F180 A183 L184 V187	F16-I21 HydrophobicContact CB-CD1 4.26Å; F16-I21 HydrophobicContact CB-CG1 4.46Å; F16-I21 HydrophobicContact CD2-CD1 4Å; F16-I21 HydrophobicContact CD2-CG1 4.14Å; F16-I21 HydrophobicContact CG-CD1 4.2Å; H17-I21 WeakPolarHBondContact O-CG1 3.42Å; D19-I21 VanDerWaalsContact C-N 3.33Å; D19-I21 PolarHBondContact O-N 3.33Å; I21-C24 PolarHBondContact O-N 3.29Å; I21-A25 WeakPolarHBondContact O-CB 3.4Å; I21-A25 PolarHBondContact O-N 3.3Å; I21-V162 HydrophobicContact CG1-CG1 4.29Å; I21-F180 HydrophobicContact CD1-CD1 4.23Å; I21-F180 HydrophobicContact CD1-CD2 3.32Å; I21-F180 HydrophobicContact CD1-CE1 4.05Å; I21-F180 HydrophobicContact CD1-CE2 3.14Å; I21-F180 HydrophobicContact CD1-CG 3.9Å; I21-F180 HydrophobicContact CD1-CZ 3.53Å; I21-F180 HydrophobicContact CG1-CE2 4.3Å; I21-A183 HydrophobicContact CD1-CB 4.08Å; I21-A183 HydrophobicContact CG1-CB 4.47Å; I21-A183 HydrophobicContact CG2-CB 4.44Å; I21-L184 HydrophobicContact CG2-CB 4.34Å; I21-L184 HydrophobicContact CG2-CD1 4.15Å; I21-L184 WeakPolarHBondContact O-CD1 3.47Å; I21-V187 HydrophobicContact CB-CG2 4.27Å; I21-V187 HydrophobicContact CG2-CB 3.71Å; I21-V187 HydrophobicContact CG2-CG1 4.15Å; I21-V187 HydrophobicContact CG2-CG2 3.54Å
22	L	98.9	Very high	98	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.2	-40.8	177.9	179.1	57.1	0	0	0	111.6	A18 D19 C24 A25 M26 A94 F132 I133 I136 V187 F191	A18-L22 WeakPolarHBondContact O-CB 3.21Å; A18-L22 PolarHBondContact O-N 3.2Å; D19-L22 PolarHBondContact O-N 3.35Å; L22-C24 VanDerWaalsContact C-N 3.33Å; L22-C24 PolarHBondContact O-N 3.45Å; L22-A25 PolarHBondContact O-N 2.92Å; L22-M26 HydrophobicContact CD1-CG 3.97Å; L22-M26 HydrophobicContact CD1-SD 4.35Å; L22-M26 HydrophobicContact CG-CE 3.95Å; L22-M26 HydrophobicContact CG-CG 4.38Å; L22-M26 HydrophobicContact CG-SD 4.33Å; L22-M26 VanDerWaalsContact O-CB 3.29Å; L22-M26 WeakPolarHBondContact O-CB 3.29Å; L22-M26 VanDerWaalsContact O-CG 3.31Å; L22-M26 WeakPolarHBondContact O-CG 3.29Å; L22-M26 PolarHBondContact O-N 2.73Å; L22-A94 HydrophobicContact CB-CB 4.15Å; L22-A94 HydrophobicContact CD2-CB 3.96Å; L22-A94 HydrophobicContact CG-CB 4.14Å; L22-F132 HydrophobicContact CD1-CE1 3.95Å; L22-F132 HydrophobicContact CD2-CD1 4.37Å; L22-F132 HydrophobicContact CD2-CE1 3.73Å; L22-F132 HydrophobicContact CD2-CZ 4.42Å; L22-I133 HydrophobicContact CD2-CD1 3.86Å; L22-I136 HydrophobicContact CD2-CB 4.37Å; L22-I136 HydrophobicContact CD2-CG1 3.91Å; L22-I136 HydrophobicContact CD2-CG2 4.32Å; L22-V187 HydrophobicContact CB-CG1 3.69Å; L22-V187 HydrophobicContact CD1-CG1 3.69Å; L22-V187 HydrophobicContact CG-CG1 4.26Å; L22-F191 HydrophobicContact CD1-CB 4.04Å; L22-F191 HydrophobicContact CD1-CD2 4.07Å; L22-F191 HydrophobicContact CD1-CG 4.05Å
23	A	98.9	Very high	98	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-55.9	-48.8	173.1	0	0	0	0	0	110.9	D19 M26 L27 V54 I97	D19-A23 WeakPolarHBondContact O-CB 3.45Å; D19-A23 PolarHBondContact O-N 2.87Å; A23-M26 PolarHBondContact O-N 3.09Å; A23-L27 VanDerWaalsContact O-CG 3.31Å; A23-L27 WeakPolarHBondContact O-CG 3.13Å; A23-L27 PolarHBondContact O-N 3.48Å; A23-V54 HydrophobicContact CB-CB 4.21Å; A23-V54 HydrophobicContact CB-CG1 4.31Å; A23-V54 HydrophobicContact CB-CG2 4.14Å; A23-I97 HydrophobicContact CB-CB 4.38Å; A23-I97 HydrophobicContact CB-CG1 3.79Å
24	C	98.9	Very high	98	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-47	175.3	-75	0	0	0	0	112.3	E20 I21 L22 M26 L27 K28 I38 L184	E20-C24 WeakPolarHBondContact O-CB 3.12Å; E20-C24 PolarHBondContact O-N 2.9Å; E20-C24 PolarHBondContact O-SG 2.86Å; I21-C24 PolarHBondContact O-N 3.29Å; L22-C24 VanDerWaalsContact C-N 3.33Å; L22-C24 PolarHBondContact O-N 3.45Å; C24-M26 PolarHBondContact O-N 3.38Å; C24-L27 PolarHBondContact O-N 3.33Å; C24-K28 VanDerWaalsContact O-CG 3.32Å; C24-K28 WeakPolarHBondContact O-CG 3.43Å; C24-K28 PolarHBondContact O-N 2.86Å; C24-K28 VanDerWaalsContact O-N 3.13Å; C24-I38 HydrophobicContact CB-CD1 3.92Å; C24-L184 HydrophobicContact CB-CD1 3.89Å
25	A	98.8	Very high	98	Very high	2 Å²	2	32.3 Å²	32.3	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-59.5	-46.8	178.7	0	0	0	0	0	111.5	I21 L22 K28 H29 L184 V187 D188	I21-A25 WeakPolarHBondContact O-CB 3.4Å; I21-A25 PolarHBondContact O-N 3.3Å; L22-A25 PolarHBondContact O-N 2.92Å; A25-K28 PolarHBondContact O-N 3.14Å; A25-H29 PolarHBondContact O-CD2 3.36Å; A25-H29 VanDerWaalsContact O-CD2 3.25Å; A25-L184 HydrophobicContact CB-CD1 3.9Å; A25-V187 HydrophobicContact CB-CG1 4.34Å; A25-D188 HydrophobicContact CB-CB 4.07Å
26	M	98.9	Very high	98.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-49	177.2	-80.7	-167.8	-58	0	0	112.4	L22 A23 C24 K28 H29 A94 I97 Y98 I105 I133 F191	L22-M26 HydrophobicContact CD1-CG 3.97Å; L22-M26 HydrophobicContact CD1-SD 4.35Å; L22-M26 HydrophobicContact CG-CE 3.95Å; L22-M26 HydrophobicContact CG-CG 4.38Å; L22-M26 HydrophobicContact CG-SD 4.33Å; L22-M26 VanDerWaalsContact O-CB 3.29Å; L22-M26 WeakPolarHBondContact O-CB 3.29Å; L22-M26 VanDerWaalsContact O-CG 3.31Å; L22-M26 WeakPolarHBondContact O-CG 3.29Å; L22-M26 PolarHBondContact O-N 2.73Å; A23-M26 PolarHBondContact O-N 3.09Å; C24-M26 PolarHBondContact O-N 3.38Å; M26-K28 PolarHBondContact O-N 3.03Å; M26-H29 PolarHBondContact O-N 3.13Å; M26-H29 VanDerWaalsContact O-N 3.08Å; M26-A94 HydrophobicContact CE-CB 4.28Å; M26-A94 VanDerWaalsContact CE-O 3.27Å; M26-A94 WeakPolarHBondContact CE-O 3.35Å; M26-I97 HydrophobicContact CB-CG2 4.05Å; M26-I97 HydrophobicContact CE-CB 3.99Å; M26-I97 HydrophobicContact CE-CG2 3.85Å; M26-Y98 HydrophobicContact SD-CD2 3.74Å; M26-I105 HydrophobicContact CB-CD1 3.74Å; M26-I105 HydrophobicContact CG-CD1 4.38Å; M26-I105 HydrophobicContact SD-CD1 4.47Å; M26-I133 HydrophobicContact SD-CD1 4.21Å; M26-F191 HydrophobicContact CG-CD1 4.28Å; M26-F191 HydrophobicContact CG-CE1 3.83Å; M26-F191 HydrophobicContact CG-CE2 4.31Å; M26-F191 HydrophobicContact CG-CZ 3.84Å; M26-F191 HydrophobicContact SD-CE2 4.17Å; M26-F191 HydrophobicContact SD-CZ 4.02Å
27	L	98.8	Very high	98	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.4	-38.6	178	-74.2	170.9	0	0	0	111.7	I9 A23 C24 H29 L30 Y33 I52 V54 I97 F101	I9-L27 HydrophobicContact CD1-CB 3.92Å; I9-L27 HydrophobicContact CD1-CD1 4.37Å; I9-L27 HydrophobicContact CG1-CD1 4.44Å; I9-L27 HydrophobicContact CG2-CD1 4.08Å; A23-L27 VanDerWaalsContact O-CG 3.31Å; A23-L27 WeakPolarHBondContact O-CG 3.13Å; A23-L27 PolarHBondContact O-N 3.48Å; C24-L27 PolarHBondContact O-N 3.33Å; L27-H29 PolarHBondContact O-N 3.43Å; L27-H29 VanDerWaalsContact O-N 3.09Å; L27-L30 HydrophobicContact CD2-CD1 4.03Å; L27-L30 VanDerWaalsContact O-CB 3.29Å; L27-L30 WeakPolarHBondContact O-CB 3.48Å; L27-L30 PolarHBondContact O-N 2.91Å; L27-Y33 HydrophobicContact CD2-CD2 4.21Å; L27-Y33 HydrophobicContact CD2-CE2 4.31Å; L27-Y33 WeakPolarHBondContact O-CB 3.44Å; L27-I52 HydrophobicContact CD1-CD1 3.72Å; L27-I52 HydrophobicContact CD1-CG1 4.11Å; L27-I52 HydrophobicContact CD1-CG2 4.05Å; L27-I52 HydrophobicContact CD2-CD1 3.58Å; L27-I52 HydrophobicContact CG-CD1 4.31Å; L27-V54 HydrophobicContact CD1-CG1 3.96Å; L27-I97 HydrophobicContact CD1-CD1 4.08Å; L27-I97 HydrophobicContact CD1-CG1 4.32Å; L27-I97 HydrophobicContact CD2-CD1 4.15Å; L27-I97 HydrophobicContact CD2-CG2 4.04Å; L27-I97 HydrophobicContact CG-CD1 4.29Å; L27-I97 HydrophobicContact CG-CG1 4.39Å; L27-I97 HydrophobicContact CG-CG2 3.98Å; L27-F101 HydrophobicContact CD2-CD2 4.3Å; L27-F101 HydrophobicContact CD2-CE2 4.44Å
28	K	98.6	Very high	98	Very high	54 Å²	54	26.9 Å²	26.9	24%	0.235	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-5.3	179.1	-67.8	-172.5	68.8	56.9	0	114.8	I9 C24 A25 M26 S34 A36 I38 L184	I9-K28 HydrophobicContact CD1-CG 4.03Å; C24-K28 VanDerWaalsContact O-CG 3.32Å; C24-K28 WeakPolarHBondContact O-CG 3.43Å; C24-K28 PolarHBondContact O-N 2.86Å; C24-K28 VanDerWaalsContact O-N 3.13Å; A25-K28 PolarHBondContact O-N 3.14Å; M26-K28 PolarHBondContact O-N 3.03Å; K28-S34 PolarHBondContact NZ-O 3.04Å; K28-S34 WeakPolarHBondContact O-CA 3.34Å; K28-A36 PolarHBondContact NZ-O 3.3Å; K28-I38 HydrophobicContact CD-CD1 4.14Å; K28-L184 HydrophobicContact CD-CD2 4.27Å
29	H	98.3	Very high	98	Very high	48 Å²	48	28.1 Å²	28.1	22%	0.222	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.8	167.1	-74.2	-70.5	0	0	0	113.5	A25 M26 L27 I105 C108 I109 D188 T192	A25-H29 PolarHBondContact O-CD2 3.36Å; A25-H29 VanDerWaalsContact O-CD2 3.25Å; M26-H29 PolarHBondContact O-N 3.13Å; M26-H29 VanDerWaalsContact O-N 3.08Å; L27-H29 PolarHBondContact O-N 3.43Å; L27-H29 VanDerWaalsContact O-N 3.09Å; H29-I105 HydrophobicContact CB-CG2 4.16Å; H29-C108 WeakPolarHBondContact O-CB 3.47Å; H29-I109 HydrophobicContact CB-CD1 4.29Å; H29-I109 HydrophobicContact CB-CG1 3.99Å; H29-I109 WeakPolarHBondContact ND1-CG1 3.38Å; H29-D188 IonicContact CD2-OD1 3.76Å; H29-D188 IonicContact CE1-OD1 3.23Å; H29-D188 PolarHBondContact CE1-OD1 3.39Å; H29-D188 IonicContact NE2-OD1 3.3Å; H29-D188 PolarHBondContact NE2-OD1 2.94Å; H29-T192 VanDerWaalsContact CE1-CG2 3.5Å; H29-T192 WeakPolarHBondContact CE1-CG2 3.4Å; H29-T192 WeakPolarHBondContact NE2-CG2 3.34Å
30	L	97.9	Very high	98	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	-78.2	138.1	174.7	-61.4	178.8	0	0	0	110.5	L27 E32 Y33 S34 F101 K104 I105	L27-L30 HydrophobicContact CD2-CD1 4.03Å; L27-L30 VanDerWaalsContact O-CB 3.29Å; L27-L30 WeakPolarHBondContact O-CB 3.48Å; L27-L30 PolarHBondContact O-N 2.91Å; L30-E32 VanDerWaalsContact C-N 3.27Å; L30-E32 HydrophobicContact CB-CG 4.26Å; L30-E32 PolarHBondContact O-N 2.92Å; L30-Y33 HydrophobicContact CB-CD2 4.19Å; L30-Y33 HydrophobicContact CD1-CD2 4.07Å; L30-Y33 HydrophobicContact CD1-CE2 4.41Å; L30-Y33 CarbonylContact O-C 3.51Å; L30-Y33 PolarHBondContact O-N 2.77Å; L30-S34 PolarHBondContact O-N 3.11Å; L30-F101 HydrophobicContact CD1-CB 4.2Å; L30-F101 HydrophobicContact CD1-CD1 3.94Å; L30-F101 HydrophobicContact CD1-CG 4.18Å; L30-K104 HydrophobicContact CD2-CB 4Å; L30-K104 HydrophobicContact CD2-CD 3.62Å; L30-K104 HydrophobicContact CD2-CG 3.58Å; L30-I105 HydrophobicContact CD1-CG1 4.47Å; L30-I105 HydrophobicContact CD2-CG1 3.74Å; L30-I105 HydrophobicContact CG-CG1 3.98Å
31	P	95.8	Very high	98	Very high	78 Å²	78	31.1 Å²	31.1	51%	0.506	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-43.5	-178.1	-29	35.4	0	0	0	113.6	Y33 S34	P31-Y33 VanDerWaalsContact C-N 3.34Å; P31-Y33 PolarHBondContact O-N 3.36Å; P31-S34 PolarHBondContact O-OG 3.41Å
32	E	95.7	Very high	97.9	Very high	74 Å²	74	37.7 Å²	37.7	35%	0.346	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-33.8	179.7	57.5	-93.3	-146.2	0	0	113.7	L7 L30 K104	L7-E32 HydrophobicContact CD1-CB 3.98Å; L7-E32 WeakPolarHBondContact CD1-O 3.5Å; L30-E32 VanDerWaalsContact C-N 3.27Å; L30-E32 HydrophobicContact CB-CG 4.26Å; L30-E32 PolarHBondContact O-N 2.92Å; E32-K104 VanDerWaalsContact CD-NZ 3.25Å; E32-K104 IonicContact OE1-NZ 3.63Å; E32-K104 PolarHBondContact OE1-NZ 2.85Å; E32-K104 IonicContact OE2-NZ 2.68Å; E32-K104 PolarHBondContact OE2-NZ 2.89Å
33	Y	97.8	Very high	97.9	Very high	10 Å²	10	41.2 Å²	41.2	4%	0.039	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	2.6	-177.5	-58.4	-71.2	0	0	0	113.8	L7 I9 L27 L30 P31 N35 A36 D51 I52	L7-Y33 HydrophobicContact CB-CD1 3.96Å; L7-Y33 HydrophobicContact CB-CE1 4.14Å; L7-Y33 HydrophobicContact CD1-CD1 3.87Å; L7-Y33 HydrophobicContact CD1-CE1 3.66Å; I9-Y33 HydrophobicContact CG1-CD1 4.11Å; L27-Y33 HydrophobicContact CD2-CD2 4.21Å; L27-Y33 HydrophobicContact CD2-CE2 4.31Å; L27-Y33 WeakPolarHBondContact O-CB 3.44Å; L30-Y33 HydrophobicContact CB-CD2 4.19Å; L30-Y33 HydrophobicContact CD1-CD2 4.07Å; L30-Y33 HydrophobicContact CD1-CE2 4.41Å; L30-Y33 CarbonylContact O-C 3.51Å; L30-Y33 PolarHBondContact O-N 2.77Å; P31-Y33 VanDerWaalsContact C-N 3.34Å; P31-Y33 PolarHBondContact O-N 3.36Å; Y33-N35 PolarHBondContact O-N 2.97Å; Y33-A36 HydrophobicContact CD1-CB 4.02Å; Y33-A36 HydrophobicContact CG-CB 4.47Å; Y33-A36 WeakPolarHBondContact O-CB 3.39Å; Y33-A36 PolarHBondContact O-N 3.48Å; Y33-D51 HydrophobicContact CE1-CB 4.22Å; Y33-I52 HydrophobicContact CD1-CG2 4.02Å; Y33-I52 HydrophobicContact CE1-CB 4.15Å; Y33-I52 HydrophobicContact CE1-CG2 3.41Å; Y33-I52 VanDerWaalsContact CE1-CG2 3.41Å; Y33-I52 HydrophobicContact CE2-CG2 4.47Å
34	S	96.6	Very high	97.8	Very high	52 Å²	52	45.8 Å²	45.8	36%	0.364	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-49.5	179.7	57.9	0	0	0	0	112	K28 L30 P31	K28-S34 PolarHBondContact NZ-O 3.04Å; K28-S34 WeakPolarHBondContact O-CA 3.34Å; L30-S34 PolarHBondContact O-N 3.11Å; P31-S34 PolarHBondContact O-OG 3.41Å
35	N	95.9	Very high	97.8	Very high	129 Å²	129	49 Å²	49	69%	0.69	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	10.3	175.1	-72.2	-33.7	0	0	0	113.1	R6 Y33	R6-N35 WeakPolarHBondContact CD-O 3.43Å; R6-N35 WeakPolarHBondContact CG-O 3.16Å; R6-N35 VanDerWaalsContact CZ-O 3.3Å; R6-N35 PolarHBondContact NE-O 3.49Å; R6-N35 PolarHBondContact NH2-O 3.29Å; Y33-N35 PolarHBondContact O-N 2.97Å
36	A	97.7	Very high	97.7	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	28%	0.276	C	S	.	.			trans	-62.4	147.9	-175.5	0	0	0	0	0	114.2	R6 L7 I9 K28 Y33	R6-A36 PolarHBondContact NE-O 2.86Å; R6-A36 PolarHBondContact NH2-O 2.97Å; L7-A36 HydrophobicContact CB-CB 4.29Å; L7-A36 CarbonylContact O-C 3.46Å; L7-A36 WeakPolarHBondContact O-CA 3.31Å; L7-A36 WeakPolarHBondContact O-CB 3.33Å; I9-A36 HydrophobicContact CD1-CB 3.92Å; I9-A36 HydrophobicContact CG1-CB 3.93Å; K28-A36 PolarHBondContact NZ-O 3.3Å; Y33-A36 HydrophobicContact CD1-CB 4.02Å; Y33-A36 HydrophobicContact CG-CB 4.47Å; Y33-A36 WeakPolarHBondContact O-CB 3.39Å; Y33-A36 PolarHBondContact O-N 3.48Å
37	E	97.8	Very high	97.7	Very high	71 Å²	71	52.7 Å²	52.7	33%	0.332	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	132.8	174.6	-173.2	177.6	-161.5	0	0	108.8	R6 L7 R8 I9 I39	R6-E37 HydrophobicContact CG-CB 4.11Å; R6-E37 VanDerWaalsContact CZ-CA 3.5Å; R6-E37 VanDerWaalsContact NE-CA 3.3Å; L7-E37 PolarHBondContact O-N 3.24Å; R8-E37 CarbonylContact C-O 3.31Å; R8-E37 VanDerWaalsContact CA-O 3.32Å; R8-E37 WeakPolarHBondContact CA-O 3.37Å; R8-E37 HydrophobicContact CG-CB 4.31Å; R8-E37 IonicContact NE-OE2 3.23Å; I9-E37 PolarHBondContact N-O 3.11Å; E37-I39 VanDerWaalsContact CD-CD1 3.43Å; E37-I39 HydrophobicContact CG-CD1 3.69Å; E37-I39 HydrophobicContact CG-CG1 4.47Å
38	I	98.4	Very high	97.7	Very high	40 Å²	40	57.3 Å²	57.3	21%	0.205	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.6	174.5	-59.8	173.2	0	0	0	107.5	I9 T11 C24 K28 R40 F180 L184	I9-I38 HydrophobicContact CB-CG1 4.37Å; I9-I38 HydrophobicContact CD1-CG1 4.44Å; I9-I38 CarbonylContact O-C 3.57Å; I9-I38 WeakPolarHBondContact O-CA 3.49Å; T11-I38 HydrophobicContact CG2-CG2 4.04Å; C24-I38 HydrophobicContact CB-CD1 3.92Å; K28-I38 HydrophobicContact CD-CD1 4.14Å; I38-R40 HydrophobicContact CG2-CG 4.02Å; I38-F180 HydrophobicContact CD1-CE1 3.94Å; I38-F180 HydrophobicContact CG2-CE1 3.91Å; I38-F180 HydrophobicContact CG2-CZ 4.05Å; I38-L184 HydrophobicContact CD1-CD1 4.41Å; I38-L184 HydrophobicContact CD1-CD2 3.68Å
39	I	98.3	Very high	97.6	Very high	30 Å²	30	58 Å²	58	15%	0.154	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	115.1	176.8	-54.5	-61.3	0	0	0	108	R8 I9 G10 T11 E37 T41 I46	R8-I39 HydrophobicContact CB-CG1 4.21Å; R8-I39 HydrophobicContact CG-CG1 4.12Å; I9-I39 PolarHBondContact O-N 2.87Å; G10-I39 WeakPolarHBondContact CA-O 3.41Å; T11-I39 PolarHBondContact N-O 3.33Å; E37-I39 VanDerWaalsContact CD-CD1 3.43Å; E37-I39 HydrophobicContact CG-CD1 3.69Å; E37-I39 HydrophobicContact CG-CG1 4.47Å; I39-T41 HydrophobicContact CG2-CG2 4Å; I39-I46 HydrophobicContact CG2-CG2 3.73Å
40	R	98.3	Very high	97.6	Very high	46 Å²	46	56.6 Å²	56.6	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	110.1	-179.8	-60.5	-171.8	62.9	-139.6	-6	110.1	T11 H12 D13 G14 I38 E176 F180	T11-R40 HydrophobicContact CG2-CG 3.87Å; T11-R40 CarbonylContact O-C 3.42Å; T11-R40 VanDerWaalsContact O-CA 3.29Å; T11-R40 WeakPolarHBondContact O-CA 3.23Å; H12-R40 PolarHBondContact O-NE 3.47Å; H12-R40 PolarHBondContact O-NH2 2.96Å; D13-R40 HydrophobicContact CB-CB 4.41Å; G14-R40 PolarHBondContact O-NH2 3.43Å; I38-R40 HydrophobicContact CG2-CG 4.02Å; R40-E176 IonicContact CZ-OE1 2.9Å; R40-E176 IonicContact NH1-OE1 3.03Å; R40-E176 PolarHBondContact NH1-OE1 3.46Å; R40-E176 IonicContact NH2-OE1 2.68Å; R40-E176 PolarHBondContact NH2-OE1 3.29Å; R40-F180 VanDerWaalsContact CD-CD2 3.42Å; R40-F180 HydrophobicContact CG-CE2 4.45Å; R40-F180 HydrophobicContact CG-CZ 4.49Å; R40-F180 VanDerWaalsContact NE-CE2 3.27Å
41	T	98.3	Very high	97.6	Very high	18 Å²	18	60 Å²	60	11%	0.11	33%	0.334	C	S	.	.			trans	-167.2	156.9	-176.3	-174.3	0	0	0	0	111.7	T11 I39 D43 I46 L47	T11-T41 PolarHBondContact O-N 3.18Å; T11-T41 VanDerWaalsContact O-O 3.05Å; I39-T41 HydrophobicContact CG2-CG2 4Å; T41-D43 WeakPolarHBondContact OG1-CB 3.46Å; T41-D43 PolarHBondContact OG1-N 2.7Å; T41-I46 HydrophobicContact CG2-CB 3.94Å; T41-I46 HydrophobicContact CG2-CG2 3.8Å; T41-L47 HydrophobicContact CG2-CD2 3.79Å; T41-L47 HydrophobicContact CG2-CG 3.96Å
42	R	98	Very high	97.8	Very high	139 Å²	139	56.3 Å²	56.3	53%	0.525	31%	0.31	S	S	.	.			trans	-104.3	0.7	165.5	-75	177.6	-178.4	82.2	3.1	113.6	H12 D13 S44 V56	H12-R42 HydrophobicContact CB-CG 4.14Å; H12-R42 PolarHBondContact ND1-NH2 2.86Å; D13-R42 PolarHBondContact O-NH1 2.87Å; D13-R42 PolarHBondContact O-NH2 3.25Å; D13-R42 WeakPolarHBondContact OD1-CG 3.34Å; D13-R42 IonicContact OD1-CZ 3.91Å; D13-R42 PolarHBondContact OD1-N 3.45Å; D13-R42 IonicContact OD1-NH1 2.77Å; D13-R42 PolarHBondContact OD1-NH1 3.42Å; R42-S44 PolarHBondContact O-N 3.35Å; R42-V56 HydrophobicContact CG-CG2 3.99Å
43	D	98.2	Very high	97.9	Very high	73 Å²	73	53 Å²	53	39%	0.39	30%	0.295	S	S	.	.			trans	-72	110.4	177.7	-173.5	-26.9	0	0	0	110.3	T41 S45 I46 L47	T41-D43 WeakPolarHBondContact OG1-CB 3.46Å; T41-D43 PolarHBondContact OG1-N 2.7Å; D43-S45 VanDerWaalsContact CG-OG 3.26Å; D43-S45 PolarHBondContact O-N 2.83Å; D43-S45 WeakPolarHBondContact OD1-CA 3.47Å; D43-S45 VanDerWaalsContact OD1-CB 3.29Å; D43-S45 WeakPolarHBondContact OD1-CB 3.38Å; D43-S45 PolarHBondContact OD1-N 3.11Å; D43-S45 PolarHBondContact OD1-OG 2.92Å; D43-S45 PolarHBondContact OD2-OG 3.5Å; D43-I46 HydrophobicContact CB-CB 4.26Å; D43-I46 HydrophobicContact CB-CD1 3.95Å; D43-I46 HydrophobicContact CB-CG1 4Å; D43-I46 PolarHBondContact O-N 2.83Å; D43-L47 WeakPolarHBondContact O-CG 3.28Å; D43-L47 PolarHBondContact O-N 3.39Å
44	S	97.4	Very high	98	Very high	96 Å²	96	52.6 Å²	52.6	67%	0.671	29%	0.293	S	S	*	.	H	α-helix	trans	-57.4	-31	-179.7	57.8	0	0	0	0	113.4	R42 S48	R42-S44 PolarHBondContact O-N 3.35Å; S44-S48 WeakPolarHBondContact O-CB 3.37Å; S44-S48 PolarHBondContact O-N 2.88Å
45	S	98	Very high	98.1	Very high	68 Å²	68	50.3 Å²	50.3	48%	0.476	28%	0.277	S	S	.	.	H	α-helix	trans	-68.1	-38.2	177.6	72.9	0	0	0	0	111.4	D43 S48	D43-S45 VanDerWaalsContact CG-OG 3.26Å; D43-S45 PolarHBondContact O-N 2.83Å; D43-S45 WeakPolarHBondContact OD1-CA 3.47Å; D43-S45 VanDerWaalsContact OD1-CB 3.29Å; D43-S45 WeakPolarHBondContact OD1-CB 3.38Å; D43-S45 PolarHBondContact OD1-N 3.11Å; D43-S45 PolarHBondContact OD1-OG 2.92Å; D43-S45 PolarHBondContact OD2-OG 3.5Å; S45-S48 PolarHBondContact O-OG 3.14Å
46	I	98.3	Very high	98.2	Very high	68 Å²	68	44.9 Å²	44.9	35%	0.349	25%	0.248	S	C	.	.	H	α-helix	trans	-74.1	-44.5	176.1	-58.1	178.4	0	0	0	110.4	I39 T41 D43 S48 T49	I39-I46 HydrophobicContact CG2-CG2 3.73Å; T41-I46 HydrophobicContact CG2-CB 3.94Å; T41-I46 HydrophobicContact CG2-CG2 3.8Å; D43-I46 HydrophobicContact CB-CB 4.26Å; D43-I46 HydrophobicContact CB-CD1 3.95Å; D43-I46 HydrophobicContact CB-CG1 4Å; D43-I46 PolarHBondContact O-N 2.83Å; I46-S48 PolarHBondContact O-N 3.09Å; I46-T49 WeakPolarHBondContact O-CB 3.35Å; I46-T49 PolarHBondContact O-N 3.43Å; I46-T49 PolarHBondContact O-OG1 3.15Å
47	L	98.3	Very high	98.2	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.058	27%	0.274	C	S	.	.	H	α-helix	trans	-57.3	-36.5	176.8	-69	173.9	0	0	0	112	T41 D43 T49 C50 V53 V56	T41-L47 HydrophobicContact CG2-CD2 3.79Å; T41-L47 HydrophobicContact CG2-CG 3.96Å; D43-L47 WeakPolarHBondContact O-CG 3.28Å; D43-L47 PolarHBondContact O-N 3.39Å; L47-T49 PolarHBondContact O-N 3.22Å; L47-T49 VanDerWaalsContact O-N 3.09Å; L47-C50 WeakPolarHBondContact O-CB 3.45Å; L47-C50 PolarHBondContact O-N 3.22Å; L47-V53 HydrophobicContact CB-CG2 4.5Å; L47-V53 HydrophobicContact CD2-CG1 4.06Å; L47-V56 HydrophobicContact CD1-CB 4.49Å; L47-V56 HydrophobicContact CD1-CG1 3.76Å; L47-V56 HydrophobicContact CD1-CG2 3.99Å; L47-V56 HydrophobicContact CD2-CG1 3.72Å; L47-V56 HydrophobicContact CG-CG1 4.41Å
48	S	97.4	Very high	98.2	Very high	98 Å²	98	46 Å²	46	69%	0.685	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.8	175.9	78.3	0	0	0	0	114.5	S44 S45 I46	S44-S48 WeakPolarHBondContact O-CB 3.37Å; S44-S48 PolarHBondContact O-N 2.88Å; S45-S48 PolarHBondContact O-OG 3.14Å; I46-S48 PolarHBondContact O-N 3.09Å
49	T	97.4	Very high	98.1	Very high	69 Å²	69	47.2 Å²	47.2	42%	0.423	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-2.4	174	76.6	0	0	0	0	113.6	R8 I46 L47	R8-T49 PolarHBondContact NH1-OG1 3.44Å; I46-T49 WeakPolarHBondContact O-CB 3.35Å; I46-T49 PolarHBondContact O-N 3.43Å; I46-T49 PolarHBondContact O-OG1 3.15Å; L47-T49 PolarHBondContact O-N 3.22Å; L47-T49 VanDerWaalsContact O-N 3.09Å
50	C	98.4	Very high	98.1	Very high	18 Å²	18	48.1 Å²	48.1	12%	0.122	29%	0.291	C	S	.	.	S	Bend	trans	-86.9	148.9	177.4	-60	0	0	0	0	110.7	R8 L47 V53	R8-C50 HydrophobicContact CB-CB 4.15Å; L47-C50 WeakPolarHBondContact O-CB 3.45Å; L47-C50 PolarHBondContact O-N 3.22Å; C50-V53 HydrophobicContact CB-CG2 3.97Å
51	D	98.4	Very high	98.1	Very high	71 Å²	71	48.1 Å²	48.1	38%	0.38	29%	0.294	S	S	.	.	S	Bend	trans	-84	-18.4	-178.9	-56.9	-82.3	0	0	0	112.6	L7 R8 Y33	L7-D51 WeakPolarHBondContact CA-OD2 3.31Å; L7-D51 HydrophobicContact CB-CB 4.32Å; L7-D51 WeakPolarHBondContact CB-OD2 3.4Å; L7-D51 HydrophobicContact CD2-CB 4.37Å; R8-D51 PolarHBondContact N-OD2 2.9Å; R8-D51 PolarHBondContact O-N 3.32Å; Y33-D51 HydrophobicContact CE1-CB 4.22Å
52	I	98.8	Very high	98.1	Very high	1 Å²	1	49 Å²	49	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	140.2	172.7	-177.5	156.4	0	0	0	108.5	R8 I9 G10 L27 Y33 V54 H65 Y67 I97 F101	R8-I52 PolarHBondContact O-N 2.91Å; I9-I52 CarbonylContact C-O 3.17Å; I9-I52 WeakPolarHBondContact CA-O 3.35Å; I9-I52 HydrophobicContact CB-CG2 4.16Å; I9-I52 HydrophobicContact CG1-CG2 3.74Å; I9-I52 HydrophobicContact CG2-CG2 4.22Å; G10-I52 PolarHBondContact N-O 3.13Å; L27-I52 HydrophobicContact CD1-CD1 3.72Å; L27-I52 HydrophobicContact CD1-CG1 4.11Å; L27-I52 HydrophobicContact CD1-CG2 4.05Å; L27-I52 HydrophobicContact CD2-CD1 3.58Å; L27-I52 HydrophobicContact CG-CD1 4.31Å; Y33-I52 HydrophobicContact CD1-CG2 4.02Å; Y33-I52 HydrophobicContact CE1-CB 4.15Å; Y33-I52 HydrophobicContact CE1-CG2 3.41Å; Y33-I52 VanDerWaalsContact CE1-CG2 3.41Å; Y33-I52 HydrophobicContact CE2-CG2 4.47Å; I52-V54 HydrophobicContact CG1-CG1 4.42Å; I52-H65 WeakPolarHBondContact CA-O 3.45Å; I52-H65 HydrophobicContact CB-CB 4.07Å; I52-H65 HydrophobicContact CD1-CB 4.3Å; I52-H65 HydrophobicContact CG1-CB 3.99Å; I52-Y67 HydrophobicContact CD1-CD2 3.92Å; I52-Y67 HydrophobicContact CD1-CE2 3.55Å; I52-Y67 HydrophobicContact CG1-CD2 3.88Å; I52-Y67 HydrophobicContact CG1-CE2 3.87Å; I52-I97 HydrophobicContact CD1-CD1 4.06Å; I52-F101 HydrophobicContact CD1-CE2 4.11Å; I52-F101 HydrophobicContact CD1-CZ 4.26Å
53	V	98.9	Very high	98.1	Very high	5 Å²	5	50.8 Å²	50.8	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.8	-179.8	-177	0	0	0	0	109.7	G10 L47 C50 V56 H65 L66 Y67	G10-V53 CarbonylContact O-C 3.51Å; G10-V53 WeakPolarHBondContact O-CA 3.26Å; L47-V53 HydrophobicContact CB-CG2 4.5Å; L47-V53 HydrophobicContact CD2-CG1 4.06Å; C50-V53 HydrophobicContact CB-CG2 3.97Å; V53-V56 HydrophobicContact CG1-CG1 3.48Å; V53-V56 VanDerWaalsContact CG1-CG1 3.48Å; V53-V56 VanDerWaalsContact CG1-O 3.3Å; V53-V56 WeakPolarHBondContact CG1-O 3.48Å; V53-H65 PolarHBondContact N-O 3.48Å; V53-L66 HydrophobicContact CB-CD2 3.83Å; V53-L66 HydrophobicContact CG2-CD2 3.91Å; V53-Y67 PolarHBondContact O-N 3.21Å
54	V	98.9	Very high	98.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.1	-177.7	-56	0	0	0	0	110.9	I9 G10 T11 A23 L27 I52 V56 I97	I9-V54 HydrophobicContact CG2-CG2 4.43Å; G10-V54 PolarHBondContact O-N 3.23Å; T11-V54 WeakPolarHBondContact CA-O 3.42Å; T11-V54 PolarHBondContact OG1-O 2.71Å; T11-V54 VanDerWaalsContact OG1-O 3.13Å; A23-V54 HydrophobicContact CB-CB 4.21Å; A23-V54 HydrophobicContact CB-CG1 4.31Å; A23-V54 HydrophobicContact CB-CG2 4.14Å; L27-V54 HydrophobicContact CD1-CG1 3.96Å; I52-V54 HydrophobicContact CG1-CG1 4.42Å; V54-V56 PolarHBondContact O-N 2.85Å; V54-I97 HydrophobicContact CG1-CD1 3.78Å; V54-I97 HydrophobicContact CG1-CG1 3.91Å
55	D	98.7	Very high	98.1	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	31%	0.305	C	S	.	.	S	Bend	trans	60.7	13.2	174.3	-153.1	49.9	0	0	0	116.3	H12 E20 Y67 H69 H70	H12-D55 IonicContact CD2-OD2 3.08Å; H12-D55 PolarHBondContact CD2-OD2 2.76Å; H12-D55 VanDerWaalsContact CD2-OD2 3.23Å; H12-D55 IonicContact NE2-OD2 2.75Å; H12-D55 PolarHBondContact NE2-OD2 3.48Å; E20-D55 HydrophobicContact CB-CB 3.51Å; E20-D55 HydrophobicContact CG-CB 4.47Å; D55-Y67 PolarHBondContact N-O 2.88Å; D55-H69 IonicContact OD1-CD2 3.79Å; D55-H69 PolarHBondContact OD1-CD2 3Å; D55-H69 IonicContact OD1-NE2 2.72Å; D55-H69 PolarHBondContact OD1-NE2 3.32Å; D55-H70 IonicContact OD1-CE1 2.71Å; D55-H70 PolarHBondContact OD1-CE1 2.93Å; D55-H70 IonicContact OD1-ND1 3.78Å; D55-H70 IonicContact OD2-CE1 3.9Å
56	V	98.6	Very high	98.2	Very high	16 Å²	16	50.1 Å²	50.1	10%	0.097	30%	0.295	C	S	.	.			trans	-154	158.6	-178.8	73.5	0	0	0	0	111.5	H12 R42 L47 V53 V54 D68	H12-V56 HydrophobicContact CB-CB 3.98Å; H12-V56 HydrophobicContact CB-CG2 3.81Å; R42-V56 HydrophobicContact CG-CG2 3.99Å; L47-V56 HydrophobicContact CD1-CB 4.49Å; L47-V56 HydrophobicContact CD1-CG1 3.76Å; L47-V56 HydrophobicContact CD1-CG2 3.99Å; L47-V56 HydrophobicContact CD2-CG1 3.72Å; L47-V56 HydrophobicContact CG-CG1 4.41Å; V53-V56 HydrophobicContact CG1-CG1 3.48Å; V53-V56 VanDerWaalsContact CG1-CG1 3.48Å; V53-V56 VanDerWaalsContact CG1-O 3.3Å; V53-V56 WeakPolarHBondContact CG1-O 3.48Å; V54-V56 PolarHBondContact O-N 2.85Å; V56-D68 WeakPolarHBondContact CA-OD2 3.14Å
57	G	97.7	Very high	98.2	Very high	53 Å²	53	47 Å²	47	55%	0.546	28%	0.279	S	S	.	.	S	Bend	trans	103.5	-7.9	173.1	0	0	0	0	0	114.3	V59 D68	G57-V59 VanDerWaalsContact C-N 3.29Å; G57-V59 PolarHBondContact O-N 3.48Å; G57-D68 PolarHBondContact N-OD2 3.46Å
58	G	97.3	Very high	98.2	Very high	41 Å²	41	46.8 Å²	46.8	42%	0.423	28%	0.278	S	S	.	.	S	Bend	trans	70.9	20	174.1	0	0	0	0	0	114	D68 Q71	G58-D68 VanDerWaalsContact CA-OD2 3.22Å; G58-D68 WeakPolarHBondContact CA-OD2 3.42Å; G58-D68 PolarHBondContact N-OD2 3.11Å; G58-Q71 WeakPolarHBondContact O-CG 3.46Å; G58-Q71 PolarHBondContact O-NE2 2.84Å
59	V	97.7	Very high	98.2	Very high	66 Å²	66	42.4 Å²	42.4	40%	0.4	25%	0.247	S	C	.	.			trans	-137.6	129.2	-178.8	-176.9	0	0	0	0	112.4	G57 N61 L66 D68 Q71	G57-V59 VanDerWaalsContact C-N 3.29Å; G57-V59 PolarHBondContact O-N 3.48Å; V59-N61 HydrophobicContact CG1-CB 3.97Å; V59-L66 HydrophobicContact CB-CB 4.5Å; V59-L66 HydrophobicContact CB-CD1 4.09Å; V59-L66 HydrophobicContact CG1-CB 4.42Å; V59-L66 HydrophobicContact CG1-CD1 3.87Å; V59-L66 CarbonylContact O-C 3.59Å; V59-L66 WeakPolarHBondContact O-CB 3.32Å; V59-D68 PolarHBondContact O-N 3.4Å; V59-Q71 VanDerWaalsContact C-NE2 3.28Å; V59-Q71 VanDerWaalsContact CA-NE2 3.31Å
60	F	98.2	Very high	98.2	Very high	50 Å²	50	44.4 Å²	44.4	22%	0.219	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	113.6	161.2	177.9	-120.6	0	0	0	109.5	P62 L66 Y67 D68 F74 L76 F81 L96 H100	F60-P62 HydrophobicContact CD2-CG 4.4Å; F60-P62 HydrophobicContact CE1-CG 3.97Å; F60-P62 HydrophobicContact CE2-CG 3.55Å; F60-P62 HydrophobicContact CZ-CG 3.31Å; F60-L66 CarbonylContact C-O 3.55Å; F60-L66 WeakPolarHBondContact CA-O 3.37Å; F60-Y67 HydrophobicContact CD2-CD1 4.36Å; F60-Y67 AromaticContact CE2-CD1 3.94Å; F60-Y67 HydrophobicContact CE2-CD1 3.94Å; F60-Y67 HydrophobicContact CE2-CE1 4.35Å; F60-D68 WeakPolarHBondContact CB-O 3.19Å; F60-F74 HydrophobicContact CB-CD2 3.84Å; F60-F74 HydrophobicContact CB-CE2 3.95Å; F60-F74 HydrophobicContact CD1-CD2 4.2Å; F60-F74 AromaticContact CD1-CE2 3.85Å; F60-F74 HydrophobicContact CD1-CE2 3.85Å; F60-F74 HydrophobicContact CD2-CE2 4.12Å; F60-F74 HydrophobicContact CE1-CE2 4.39Å; F60-F74 HydrophobicContact CG-CD2 4.06Å; F60-F74 AromaticContact CG-CE2 3.7Å; F60-F74 HydrophobicContact CG-CE2 3.7Å; F60-L76 HydrophobicContact CD1-CD1 3.79Å; F60-L76 HydrophobicContact CE1-CD1 3.28Å; F60-L76 HydrophobicContact CZ-CD1 4.08Å; F60-F81 HydrophobicContact CZ-CZ 4.07Å; F60-L96 HydrophobicContact CD2-CD1 3.81Å; F60-L96 HydrophobicContact CD2-CD2 3.95Å; F60-L96 HydrophobicContact CD2-CG 4.5Å; F60-L96 HydrophobicContact CE2-CD1 4.04Å; F60-L96 HydrophobicContact CE2-CD2 3.37Å; F60-L96 HydrophobicContact CE2-CG 4.24Å; F60-L96 HydrophobicContact CZ-CD2 3.78Å; F60-H100 AromaticContact CE2-NE2 3.99Å; F60-H100 AromaticContact CZ-NE2 3.68Å
61	N	98.1	Very high	98.1	Very high	46 Å²	46	45.2 Å²	45.2	25%	0.246	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	94.9	175.9	-173.8	-25	0	0	0	110.1	V59 E63 N64 H65 L66	V59-N61 HydrophobicContact CG1-CB 3.97Å; N61-E63 VanDerWaalsContact C-N 3.29Å; N61-E63 PolarHBondContact O-N 2.86Å; N61-E63 WeakPolarHBondContact OD1-CB 3.34Å; N61-E63 PolarHBondContact OD1-N 3.19Å; N61-E63 VanDerWaalsContact OD1-N 3.14Å; N61-N64 PolarHBondContact ND2-ND2 3.31Å; N61-N64 CarbonylContact O-C 3.56Å; N61-N64 PolarHBondContact O-N 3Å; N61-N64 PolarHBondContact OD1-N 3.17Å; N61-H65 PolarHBondContact O-N 2.84Å; N61-H65 VanDerWaalsContact O-N 3.11Å; N61-L66 CarbonylContact C-O 3.59Å; N61-L66 HydrophobicContact CB-CB 4.28Å; N61-L66 HydrophobicContact CB-CD1 4.43Å; N61-L66 PolarHBondContact N-O 2.77Å; N61-L66 PolarHBondContact O-N 3.23Å
62	P	97.9	Very high	98	Very high	37 Å²	37	52.5 Å²	52.5	24%	0.24	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-60.3	-33.1	179.9	-27.4	36.1	0	0	0	114.6	F60 N64 H65 Y67 H100	F60-P62 HydrophobicContact CD2-CG 4.4Å; F60-P62 HydrophobicContact CE1-CG 3.97Å; F60-P62 HydrophobicContact CE2-CG 3.55Å; F60-P62 HydrophobicContact CZ-CG 3.31Å; P62-N64 PolarHBondContact O-N 3.42Å; P62-H65 PolarHBondContact O-N 3.49Å; P62-H65 VanDerWaalsContact O-N 3.14Å; P62-H65 PolarHBondContact O-ND1 2.88Å; P62-Y67 HydrophobicContact CB-CE1 4.17Å; P62-Y67 HydrophobicContact CG-CE1 4.33Å; P62-H100 VanDerWaalsContact CG-CE1 3.47Å; P62-H100 WeakPolarHBondContact CG-CE1 3.17Å; P62-H100 WeakPolarHBondContact CG-NE2 3.46Å
63	E	97.8	Very high	97.8	Very high	175 Å²	175	59.4 Å²	59.4	82%	0.818	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-63.5	-31.2	179.3	-60.7	-177	163.8	0	0	111.9	N61	N61-E63 VanDerWaalsContact C-N 3.29Å; N61-E63 PolarHBondContact O-N 2.86Å; N61-E63 WeakPolarHBondContact OD1-CB 3.34Å; N61-E63 PolarHBondContact OD1-N 3.19Å; N61-E63 VanDerWaalsContact OD1-N 3.14Å
64	N	97.8	Very high	97.8	Very high	105 Å²	105	59.8 Å²	59.8	56%	0.561	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-105.7	13.3	177	-65.7	-52.3	0	0	0	113	N61 P62 L66	N61-N64 PolarHBondContact ND2-ND2 3.31Å; N61-N64 CarbonylContact O-C 3.56Å; N61-N64 PolarHBondContact O-N 3Å; N61-N64 PolarHBondContact OD1-N 3.17Å; P62-N64 PolarHBondContact O-N 3.42Å; N64-L66 VanDerWaalsContact C-N 3.33Å; N64-L66 HydrophobicContact CB-CD1 4.42Å; N64-L66 HydrophobicContact CB-CG 4.32Å; N64-L66 PolarHBondContact O-N 3.5Å
65	H	98.4	Very high	97.7	Very high	67 Å²	67	65.1 Å²	65.1	31%	0.31	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	42.5	-179.7	-60.1	-35.4	0	0	0	114.8	I52 V53 N61 P62 Y67	I52-H65 WeakPolarHBondContact CA-O 3.45Å; I52-H65 HydrophobicContact CB-CB 4.07Å; I52-H65 HydrophobicContact CD1-CB 4.3Å; I52-H65 HydrophobicContact CG1-CB 3.99Å; V53-H65 PolarHBondContact N-O 3.48Å; N61-H65 PolarHBondContact O-N 2.84Å; N61-H65 VanDerWaalsContact O-N 3.11Å; P62-H65 PolarHBondContact O-N 3.49Å; P62-H65 VanDerWaalsContact O-N 3.14Å; P62-H65 PolarHBondContact O-ND1 2.88Å; H65-Y67 VanDerWaalsContact CA-CE2 3.49Å; H65-Y67 HydrophobicContact CB-CE2 3.98Å; H65-Y67 PolarHBondContact ND1-OH 2.56Å
66	L	98.6	Very high	97.7	Very high	51 Å²	51	67.5 Å²	67.5	27%	0.267	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.9	173.5	-54.2	177.2	0	0	0	109.4	V53 V59 F60 N61 N64	V53-L66 HydrophobicContact CB-CD2 3.83Å; V53-L66 HydrophobicContact CG2-CD2 3.91Å; V59-L66 HydrophobicContact CB-CB 4.5Å; V59-L66 HydrophobicContact CB-CD1 4.09Å; V59-L66 HydrophobicContact CG1-CB 4.42Å; V59-L66 HydrophobicContact CG1-CD1 3.87Å; V59-L66 CarbonylContact O-C 3.59Å; V59-L66 WeakPolarHBondContact O-CB 3.32Å; F60-L66 CarbonylContact C-O 3.55Å; F60-L66 WeakPolarHBondContact CA-O 3.37Å; N61-L66 CarbonylContact C-O 3.59Å; N61-L66 HydrophobicContact CB-CB 4.28Å; N61-L66 HydrophobicContact CB-CD1 4.43Å; N61-L66 PolarHBondContact N-O 2.77Å; N61-L66 PolarHBondContact O-N 3.23Å; N64-L66 VanDerWaalsContact C-N 3.33Å; N64-L66 HydrophobicContact CB-CD1 4.42Å; N64-L66 HydrophobicContact CB-CG 4.32Å; N64-L66 PolarHBondContact O-N 3.5Å
67	Y	98.7	Very high	97.7	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.016	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	56.8	-170.7	-59.2	-81.1	0	0	0	111.7	I52 V53 D55 F60 P62 H65 L96 I97 H100 F101	I52-Y67 HydrophobicContact CD1-CD2 3.92Å; I52-Y67 HydrophobicContact CD1-CE2 3.55Å; I52-Y67 HydrophobicContact CG1-CD2 3.88Å; I52-Y67 HydrophobicContact CG1-CE2 3.87Å; V53-Y67 PolarHBondContact O-N 3.21Å; D55-Y67 PolarHBondContact N-O 2.88Å; F60-Y67 HydrophobicContact CD2-CD1 4.36Å; F60-Y67 AromaticContact CE2-CD1 3.94Å; F60-Y67 HydrophobicContact CE2-CD1 3.94Å; F60-Y67 HydrophobicContact CE2-CE1 4.35Å; P62-Y67 HydrophobicContact CB-CE1 4.17Å; P62-Y67 HydrophobicContact CG-CE1 4.33Å; H65-Y67 VanDerWaalsContact CA-CE2 3.49Å; H65-Y67 HydrophobicContact CB-CE2 3.98Å; H65-Y67 PolarHBondContact ND1-OH 2.56Å; Y67-L96 HydrophobicContact CD1-CB 4.1Å; Y67-I97 HydrophobicContact CD1-CD1 4.27Å; Y67-I97 HydrophobicContact CD2-CD1 3.57Å; Y67-I97 HydrophobicContact CE2-CD1 3.95Å; Y67-I97 HydrophobicContact CG-CD1 3.74Å; Y67-H100 HydrophobicContact CE1-CB 4.3Å; Y67-H100 AromaticContact CE1-CD2 3.51Å; Y67-H100 AromaticContact CE1-CG 3.91Å; Y67-F101 HydrophobicContact CE1-CE2 4.34Å; Y67-F101 AromaticContact CE2-CE2 3.84Å; Y67-F101 HydrophobicContact CE2-CE2 3.84Å; Y67-F101 HydrophobicContact CE2-CZ 4.28Å; Y67-F101 AromaticContact CZ-CE2 3.56Å; Y67-F101 VanDerWaalsContact OH-CE2 3.22Å; Y67-F101 WeakPolarHBondContact OH-CE2 3.47Å; Y67-F101 VanDerWaalsContact OH-CZ 3.26Å; Y67-F101 WeakPolarHBondContact OH-CZ 3.28Å
68	D	98.6	Very high	97.7	Very high	6 Å²	6	65.4 Å²	65.4	3%	0.032	33%	0.326	C	S	.	.			trans	-101.5	142.5	170.7	-170.4	-0.1	0	0	0	110.6	V56 G57 G58 V59 F60 H70 Q71	V56-D68 WeakPolarHBondContact CA-OD2 3.14Å; G57-D68 PolarHBondContact N-OD2 3.46Å; G58-D68 VanDerWaalsContact CA-OD2 3.22Å; G58-D68 WeakPolarHBondContact CA-OD2 3.42Å; G58-D68 PolarHBondContact N-OD2 3.11Å; V59-D68 PolarHBondContact O-N 3.4Å; F60-D68 WeakPolarHBondContact CB-O 3.19Å; D68-H70 IonicContact OD1-CE1 3.27Å; D68-H70 IonicContact OD1-CG 3.92Å; D68-H70 PolarHBondContact OD1-N 3.09Å; D68-H70 VanDerWaalsContact OD1-N 3.09Å; D68-H70 IonicContact OD1-ND1 3.56Å; D68-H70 PolarHBondContact OD1-ND1 3.1Å; D68-Q71 PolarHBondContact O-NE2 3.16Å; D68-Q71 PolarHBondContact O-OE1 2.89Å
69	H	98	Very high	97.7	Very high	5 Å²	5	68.2 Å²	68.2	2%	0.023	33%	0.327	C	S	.	.			trans	-118	0.1	-176.3	68.5	96.9	0	0	0	113.8	D55 Q71 F74 K90 S93 L96 D140	D55-H69 IonicContact OD1-CD2 3.79Å; D55-H69 PolarHBondContact OD1-CD2 3Å; D55-H69 IonicContact OD1-NE2 2.72Å; D55-H69 PolarHBondContact OD1-NE2 3.32Å; H69-Q71 VanDerWaalsContact C-OE1 3.29Å; H69-Q71 PolarHBondContact O-N 2.81Å; H69-F74 HydrophobicContact CB-CD1 3.7Å; H69-F74 HydrophobicContact CB-CD2 4.38Å; H69-F74 HydrophobicContact CB-CE1 3.53Å; H69-F74 HydrophobicContact CB-CE2 4.24Å; H69-F74 HydrophobicContact CB-CG 4.12Å; H69-F74 HydrophobicContact CB-CZ 3.81Å; H69-K90 WeakPolarHBondContact O-CE 3.37Å; H69-K90 PolarHBondContact O-NZ 2.81Å; H69-S93 PolarHBondContact CD2-N 3.22Å; H69-L96 HydrophobicContact CB-CD1 4.22Å; H69-D140 IonicContact CE1-OD2 3.89Å; H69-D140 PolarHBondContact CE1-OD2 3.02Å; H69-D140 IonicContact ND1-OD2 3.44Å; H69-D140 IonicContact NE2-OD2 2.7Å; H69-D140 PolarHBondContact NE2-OD2 3.22Å; H69-D140 VanDerWaalsContact NE2-OD2 3.11Å
70	H	96.9	Very high	97.7	Very high	112 Å²	112	69.6 Å²	69.6	52%	0.519	33%	0.332	S	S	.	.			trans	-72.2	-7.1	-173.9	-69.6	101.2	0	0	0	115.6	D55 D68	D55-H70 IonicContact OD1-CE1 2.71Å; D55-H70 PolarHBondContact OD1-CE1 2.93Å; D55-H70 IonicContact OD1-ND1 3.78Å; D55-H70 IonicContact OD2-CE1 3.9Å; D68-H70 IonicContact OD1-CE1 3.27Å; D68-H70 IonicContact OD1-CG 3.92Å; D68-H70 PolarHBondContact OD1-N 3.09Å; D68-H70 VanDerWaalsContact OD1-N 3.09Å; D68-H70 IonicContact OD1-ND1 3.56Å; D68-H70 PolarHBondContact OD1-ND1 3.1Å
71	Q	96.8	Very high	97.6	Very high	35 Å²	35	70.2 Å²	70.2	16%	0.164	33%	0.334	C	S	.	.	S	Bend	trans	-69.4	146	-176.9	-43.1	78.9	6.7	0	0	110.2	G58 V59 D68 H69 E73 F74	G58-Q71 WeakPolarHBondContact O-CG 3.46Å; G58-Q71 PolarHBondContact O-NE2 2.84Å; V59-Q71 VanDerWaalsContact C-NE2 3.28Å; V59-Q71 VanDerWaalsContact CA-NE2 3.31Å; D68-Q71 PolarHBondContact O-NE2 3.16Å; D68-Q71 PolarHBondContact O-OE1 2.89Å; H69-Q71 VanDerWaalsContact C-OE1 3.29Å; H69-Q71 PolarHBondContact O-N 2.81Å; Q71-E73 PolarHBondContact O-N 3.25Å; Q71-E73 VanDerWaalsContact O-N 3.16Å; Q71-F74 HydrophobicContact CB-CB 4.36Å; Q71-F74 PolarHBondContact O-N 3.48Å; Q71-F74 VanDerWaalsContact O-N 3.08Å; Q71-F74 VanDerWaalsContact OE1-CB 3.25Å
72	R	95.5	Very high	97.6	Very high	224 Å²	224	70.9 Å²	70.9	85%	0.845	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.9	-180	175.3	179.2	-178.8	156.9	2	112.2
73	E	95.7	Very high	97.4	Very high	146 Å²	146	73.3 Å²	73.3	68%	0.682	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-17.9	-175.6	-62.8	68.7	-155.3	0	0	112	Q71 N75	Q71-E73 PolarHBondContact O-N 3.25Å; Q71-E73 VanDerWaalsContact O-N 3.16Å; E73-N75 PolarHBondContact O-N 2.96Å; E73-N75 PolarHBondContact O-ND2 2.93Å
74	F	97.9	Very high	97.1	Very high	12 Å²	12	73 Å²	73	5%	0.053	35%	0.354	C	S	.	.			trans	-74.6	115.3	-179.4	-175.1	-76.5	0	0	0	110.7	F60 H69 Q71 L76 K90 L91 L96	F60-F74 HydrophobicContact CB-CD2 3.84Å; F60-F74 HydrophobicContact CB-CE2 3.95Å; F60-F74 HydrophobicContact CD1-CD2 4.2Å; F60-F74 AromaticContact CD1-CE2 3.85Å; F60-F74 HydrophobicContact CD1-CE2 3.85Å; F60-F74 HydrophobicContact CD2-CE2 4.12Å; F60-F74 HydrophobicContact CE1-CE2 4.39Å; F60-F74 HydrophobicContact CG-CD2 4.06Å; F60-F74 AromaticContact CG-CE2 3.7Å; F60-F74 HydrophobicContact CG-CE2 3.7Å; H69-F74 HydrophobicContact CB-CD1 3.7Å; H69-F74 HydrophobicContact CB-CD2 4.38Å; H69-F74 HydrophobicContact CB-CE1 3.53Å; H69-F74 HydrophobicContact CB-CE2 4.24Å; H69-F74 HydrophobicContact CB-CG 4.12Å; H69-F74 HydrophobicContact CB-CZ 3.81Å; Q71-F74 HydrophobicContact CB-CB 4.36Å; Q71-F74 PolarHBondContact O-N 3.48Å; Q71-F74 VanDerWaalsContact O-N 3.08Å; Q71-F74 VanDerWaalsContact OE1-CB 3.25Å; F74-L76 HydrophobicContact CE1-CB 4.25Å; F74-L76 HydrophobicContact CE2-CB 4.24Å; F74-L76 HydrophobicContact CE2-CD1 4.11Å; F74-L76 HydrophobicContact CE2-CG 4.35Å; F74-L76 HydrophobicContact CZ-CB 3.9Å; F74-K90 HydrophobicContact CD1-CD 3.94Å; F74-K90 HydrophobicContact CD1-CG 4.01Å; F74-K90 HydrophobicContact CE1-CD 4.26Å; F74-K90 HydrophobicContact CE1-CG 3.82Å; F74-K90 PolarHBondContact O-NZ 3.13Å; F74-K90 VanDerWaalsContact O-NZ 3.09Å; F74-L91 WeakPolarHBondContact CE1-O 3.46Å; F74-L91 HydrophobicContact CZ-CB 4.48Å; F74-L96 HydrophobicContact CE2-CD1 4.02Å; F74-L96 HydrophobicContact CE2-CD2 4.05Å; F74-L96 HydrophobicContact CZ-CD1 3.92Å; F74-L96 HydrophobicContact CZ-CD2 3.77Å; F74-L96 HydrophobicContact CZ-CG 4.08Å
75	N	97.3	Very high	96.9	Very high	112 Å²	112	68.8 Å²	68.8	60%	0.599	33%	0.333	S	S	*	.			trans	-138.6	21.1	-179.6	-65.2	-73.9	0	0	0	112.1	E73	E73-N75 PolarHBondContact O-N 2.96Å; E73-N75 PolarHBondContact O-ND2 2.93Å
76	L	98.3	Very high	96.5	Very high	54 Å²	54	72.5 Å²	72.5	28%	0.283	36%	0.355	S	S	.	.			trans	-72.9	136.7	-178.7	-61.7	178.5	0	0	0	110.7	F60 F74 D80 F81 K90 L91	F60-L76 HydrophobicContact CD1-CD1 3.79Å; F60-L76 HydrophobicContact CE1-CD1 3.28Å; F60-L76 HydrophobicContact CZ-CD1 4.08Å; F74-L76 HydrophobicContact CE1-CB 4.25Å; F74-L76 HydrophobicContact CE2-CB 4.24Å; F74-L76 HydrophobicContact CE2-CD1 4.11Å; F74-L76 HydrophobicContact CE2-CG 4.35Å; F74-L76 HydrophobicContact CZ-CB 3.9Å; L76-D80 HydrophobicContact CD2-CB 4.13Å; L76-F81 HydrophobicContact CB-CE2 4.14Å; L76-F81 HydrophobicContact CD1-CE2 4.23Å; L76-F81 HydrophobicContact CD1-CZ 4.03Å; L76-K90 WeakPolarHBondContact O-CA 3.11Å; L76-L91 PolarHBondContact O-N 3.27Å
77	T	98.3	Very high	96.4	Very high	21 Å²	21	74.6 Å²	74.6	13%	0.129	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-116.6	169.2	178.6	67.8	0	0	0	0	109.5	K79 D80 F81 D88 I89	T77-K79 PolarHBondContact O-N 3.12Å; T77-K79 PolarHBondContact OG1-N 3.01Å; T77-D80 PolarHBondContact N-OD2 3.09Å; T77-D80 WeakPolarHBondContact O-CB 3.23Å; T77-D80 PolarHBondContact O-N 3.2Å; T77-D80 VanDerWaalsContact O-N 3.12Å; T77-D80 PolarHBondContact OG1-OD2 3.36Å; T77-F81 WeakPolarHBondContact O-CD2 3.33Å; T77-D88 WeakPolarHBondContact CG2-O 3.45Å; T77-I89 WeakPolarHBondContact CA-O 3.44Å; T77-I89 WeakPolarHBondContact CB-O 3.27Å
78	Y	98	Very high	96.2	Very high	5 Å²	5	80.4 Å²	80.4	2%	0.02	39%	0.391	C	S	.	.	H	α-helix	trans	-57.4	-33.5	174.1	-171.5	-94.9	0	0	0	113	D80 F81 Y82 S85 V99 F125 Y129	Y78-D80 VanDerWaalsContact C-N 3.27Å; Y78-D80 PolarHBondContact O-N 3.35Å; Y78-F81 PolarHBondContact O-N 3Å; Y78-F81 VanDerWaalsContact O-N 3.14Å; Y78-Y82 HydrophobicContact CD1-CD2 4Å; Y78-Y82 HydrophobicContact CD1-CG 4.43Å; Y78-Y82 AromaticContact CD2-CD2 3.97Å; Y78-Y82 HydrophobicContact CD2-CD2 3.97Å; Y78-Y82 HydrophobicContact CD2-CE2 4.43Å; Y78-Y82 AromaticContact CE1-CD2 3.62Å; Y78-Y82 HydrophobicContact CE1-CD2 3.62Å; Y78-Y82 AromaticContact CE1-CG 3.88Å; Y78-Y82 HydrophobicContact CE1-CG 3.88Å; Y78-Y82 AromaticContact CE2-CD2 3.56Å; Y78-Y82 HydrophobicContact CE2-CD2 3.56Å; Y78-Y82 AromaticContact CE2-CE2 3.85Å; Y78-Y82 HydrophobicContact CE2-CE2 3.85Å; Y78-Y82 HydrophobicContact CG-CD2 4.21Å; Y78-Y82 AromaticContact CZ-CD2 3.4Å; Y78-Y82 AromaticContact CZ-CE2 3.98Å; Y78-Y82 AromaticContact CZ-CG 3.97Å; Y78-Y82 PolarHBondContact O-N 2.53Å; Y78-S85 VanDerWaalsContact CD1-OG 3.31Å; Y78-S85 WeakPolarHBondContact CD1-OG 3.32Å; Y78-V99 HydrophobicContact CD2-CG1 3.59Å; Y78-V99 HydrophobicContact CE2-CG1 3.96Å; Y78-F125 HydrophobicContact CE2-CE1 4.21Å; Y78-F125 HydrophobicContact CE2-CZ 4.34Å; Y78-F125 AromaticContact CZ-CE1 3.95Å; Y78-F125 WeakPolarHBondContact OH-CD1 3.4Å; Y78-F125 WeakPolarHBondContact OH-CE1 3.09Å; Y78-Y129 VanDerWaalsContact CB-CZ 3.45Å; Y78-Y129 WeakPolarHBondContact CB-OH 3.29Å; Y78-Y129 AromaticContact CD1-CD1 3.99Å; Y78-Y129 HydrophobicContact CD1-CD1 3.99Å; Y78-Y129 AromaticContact CD1-CE1 3.95Å; Y78-Y129 HydrophobicContact CD1-CE1 3.95Å; Y78-Y129 AromaticContact CD2-CD1 3.59Å; Y78-Y129 HydrophobicContact CD2-CD1 3.59Å; Y78-Y129 AromaticContact CD2-CD2 3.31Å; Y78-Y129 HydrophobicContact CD2-CD2 3.31Å; Y78-Y129 AromaticContact CD2-CE1 3.5Å; Y78-Y129 HydrophobicContact CD2-CE1 3.5Å; Y78-Y129 AromaticContact CD2-CE2 3.23Å; Y78-Y129 HydrophobicContact CD2-CE2 3.23Å; Y78-Y129 AromaticContact CD2-CG 3.51Å; Y78-Y129 HydrophobicContact CD2-CG 3.51Å; Y78-Y129 AromaticContact CD2-CZ 3.35Å; Y78-Y129 HydrophobicContact CE1-CD1 4.03Å; Y78-Y129 HydrophobicContact CE1-CE1 4.46Å; Y78-Y129 HydrophobicContact CE1-CG 4.35Å; Y78-Y129 AromaticContact CE2-CD1 3.66Å; Y78-Y129 HydrophobicContact CE2-CD1 3.66Å; Y78-Y129 AromaticContact CE2-CD2 3.3Å; Y78-Y129 HydrophobicContact CE2-CD2 3.3Å; Y78-Y129 HydrophobicContact CE2-CE1 4.09Å; Y78-Y129 AromaticContact CE2-CE2 3.78Å; Y78-Y129 HydrophobicContact CE2-CE2 3.78Å; Y78-Y129 AromaticContact CE2-CG 3.25Å; Y78-Y129 HydrophobicContact CE2-CG 3.25Å; Y78-Y129 AromaticContact CG-CD1 3.73Å; Y78-Y129 HydrophobicContact CG-CD1 3.73Å; Y78-Y129 HydrophobicContact CG-CD2 4.23Å; Y78-Y129 AromaticContact CG-CE1 3.39Å; Y78-Y129 HydrophobicContact CG-CE1 3.39Å; Y78-Y129 AromaticContact CG-CE2 3.95Å; Y78-Y129 HydrophobicContact CG-CE2 3.95Å; Y78-Y129 HydrophobicContact CG-CG 4.15Å; Y78-Y129 AromaticContact CG-CZ 3.54Å; Y78-Y129 AromaticContact CZ-CD1 3.85Å; Y78-Y129 AromaticContact CZ-CG 3.69Å
79	K	96.7	Very high	96.1	Very high	100 Å²	100	81.4 Å²	81.4	44%	0.435	40%	0.395	S	S	.	.	H	α-helix	trans	-64.2	-28.2	178.6	-170.6	173.7	-175.3	167.3	0	113.6	T77 F81 Y82 P83 W87	T77-K79 PolarHBondContact O-N 3.12Å; T77-K79 PolarHBondContact OG1-N 3.01Å; K79-F81 PolarHBondContact O-N 2.85Å; K79-Y82 CarbonylContact O-C 3.49Å; K79-Y82 VanDerWaalsContact O-C 3.31Å; K79-Y82 PolarHBondContact O-N 3.12Å; K79-P83 VanDerWaalsContact O-CA 3.26Å; K79-P83 WeakPolarHBondContact O-CA 3.24Å; K79-W87 PolarHBondContact N-O 2.83Å
80	D	97.8	Very high	96.1	Very high	95 Å²	95	83.3 Å²	83.3	51%	0.508	40%	0.404	S	S	.	.	H	α-helix	trans	-66.2	-25.5	176.4	-63.5	-68.1	0	0	0	112.1	L76 T77 Y78	L76-D80 HydrophobicContact CD2-CB 4.13Å; T77-D80 PolarHBondContact N-OD2 3.09Å; T77-D80 WeakPolarHBondContact O-CB 3.23Å; T77-D80 PolarHBondContact O-N 3.2Å; T77-D80 VanDerWaalsContact O-N 3.12Å; T77-D80 PolarHBondContact OG1-OD2 3.36Å; Y78-D80 VanDerWaalsContact C-N 3.27Å; Y78-D80 PolarHBondContact O-N 3.35Å
81	F	97.6	Very high	96.2	Very high	62 Å²	62	78 Å²	78	27%	0.272	38%	0.379	S	S	.	.	H	α-helix	trans	-97.2	-32.8	175.1	-60.7	-94.1	0	0	0	112.4	F60 L76 T77 Y78 K79 L91 V99 H100	F60-F81 HydrophobicContact CZ-CZ 4.07Å; L76-F81 HydrophobicContact CB-CE2 4.14Å; L76-F81 HydrophobicContact CD1-CE2 4.23Å; L76-F81 HydrophobicContact CD1-CZ 4.03Å; T77-F81 WeakPolarHBondContact O-CD2 3.33Å; Y78-F81 PolarHBondContact O-N 3Å; Y78-F81 VanDerWaalsContact O-N 3.14Å; K79-F81 PolarHBondContact O-N 2.85Å; F81-L91 HydrophobicContact CD2-CD1 3.87Å; F81-L91 HydrophobicContact CE2-CD1 3.55Å; F81-L91 HydrophobicContact CZ-CD1 4.48Å; F81-V99 HydrophobicContact CB-CB 4.27Å; F81-V99 HydrophobicContact CB-CG1 4.42Å; F81-V99 HydrophobicContact CD1-CB 4.28Å; F81-V99 HydrophobicContact CD1-CG2 3.96Å; F81-V99 HydrophobicContact CD2-CB 4.33Å; F81-V99 HydrophobicContact CD2-CG1 4.32Å; F81-V99 HydrophobicContact CD2-CG2 4.03Å; F81-V99 HydrophobicContact CE1-CG2 3.98Å; F81-V99 HydrophobicContact CE2-CG2 4.07Å; F81-V99 HydrophobicContact CG-CB 4.04Å; F81-V99 HydrophobicContact CG-CG1 4.37Å; F81-V99 HydrophobicContact CG-CG2 3.99Å; F81-V99 HydrophobicContact CZ-CG2 4.04Å; F81-H100 AromaticContact CE1-CE1 3.75Å; F81-H100 AromaticContact CE1-NE2 3.49Å; F81-H100 WeakPolarHBondContact CE1-NE2 3.47Å; F81-H100 AromaticContact CZ-NE2 3.95Å
82	Y	96	Very high	96.3	Very high	60 Å²	60	76.3 Å²	76.3	24%	0.235	37%	0.371	C	S	.	.			trans	-130.1	82.5	-178	-57.9	-75.6	0	0	0	110.9	Y78 K79 N84 S85 V99 F125	Y78-Y82 HydrophobicContact CD1-CD2 4Å; Y78-Y82 HydrophobicContact CD1-CG 4.43Å; Y78-Y82 AromaticContact CD2-CD2 3.97Å; Y78-Y82 HydrophobicContact CD2-CD2 3.97Å; Y78-Y82 HydrophobicContact CD2-CE2 4.43Å; Y78-Y82 AromaticContact CE1-CD2 3.62Å; Y78-Y82 HydrophobicContact CE1-CD2 3.62Å; Y78-Y82 AromaticContact CE1-CG 3.88Å; Y78-Y82 HydrophobicContact CE1-CG 3.88Å; Y78-Y82 AromaticContact CE2-CD2 3.56Å; Y78-Y82 HydrophobicContact CE2-CD2 3.56Å; Y78-Y82 AromaticContact CE2-CE2 3.85Å; Y78-Y82 HydrophobicContact CE2-CE2 3.85Å; Y78-Y82 HydrophobicContact CG-CD2 4.21Å; Y78-Y82 AromaticContact CZ-CD2 3.4Å; Y78-Y82 AromaticContact CZ-CE2 3.98Å; Y78-Y82 AromaticContact CZ-CG 3.97Å; Y78-Y82 PolarHBondContact O-N 2.53Å; K79-Y82 CarbonylContact O-C 3.49Å; K79-Y82 VanDerWaalsContact O-C 3.31Å; K79-Y82 PolarHBondContact O-N 3.12Å; Y82-N84 PolarHBondContact O-N 2.99Å; Y82-S85 WeakPolarHBondContact O-CB 3.33Å; Y82-S85 PolarHBondContact O-N 2.85Å; Y82-V99 HydrophobicContact CD2-CG1 4.43Å; Y82-V99 HydrophobicContact CE2-CB 3.99Å; Y82-V99 HydrophobicContact CE2-CG1 3.95Å; Y82-V99 PolarHBondContact OH-O 2.9Å; Y82-V99 VanDerWaalsContact OH-O 3.1Å; Y82-F125 HydrophobicContact CD1-CE1 4.34Å; Y82-F125 HydrophobicContact CD2-CE1 4.13Å; Y82-F125 HydrophobicContact CD2-CZ 4.49Å; Y82-F125 AromaticContact CE1-CE1 3.76Å; Y82-F125 HydrophobicContact CE1-CE1 3.76Å; Y82-F125 HydrophobicContact CE1-CZ 4.28Å; Y82-F125 AromaticContact CE2-CE1 3.5Å; Y82-F125 HydrophobicContact CE2-CE1 3.5Å; Y82-F125 AromaticContact CE2-CZ 3.52Å; Y82-F125 HydrophobicContact CE2-CZ 3.52Å; Y82-F125 AromaticContact CZ-CE1 3.3Å; Y82-F125 AromaticContact CZ-CZ 3.39Å; Y82-F125 WeakPolarHBondContact OH-CE1 3.45Å; Y82-F125 WeakPolarHBondContact OH-CZ 3.23Å
83	P	95.1	Very high	96.5	Very high	89 Å²	89	65.7 Å²	65.7	58%	0.578	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.5	-168	-28.2	36.4	0	0	0	116.7	K79 S85	K79-P83 VanDerWaalsContact O-CA 3.26Å; K79-P83 WeakPolarHBondContact O-CA 3.24Å; P83-S85 VanDerWaalsContact C-N 3.27Å
84	N	91.7	Very high	96.6	Very high	168 Å²	168	58.7 Å²	58.7	90%	0.898	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-3	177	-64.7	-30	0	0	0	113.2	Y82	Y82-N84 PolarHBondContact O-N 2.99Å
85	S	92.9	Very high	96.7	Very high	17 Å²	17	58.1 Å²	58.1	12%	0.119	30%	0.296	C	S	.	.			trans	-81.6	149	175.9	-176.3	0	0	0	0	111.8	Y78 Y82 P83 W87	Y78-S85 VanDerWaalsContact CD1-OG 3.31Å; Y78-S85 WeakPolarHBondContact CD1-OG 3.32Å; Y82-S85 WeakPolarHBondContact O-CB 3.33Å; Y82-S85 PolarHBondContact O-N 2.85Å; P83-S85 VanDerWaalsContact C-N 3.27Å; S85-W87 PolarHBondContact OG-N 2.8Å
86	D	91	Very high	96.7	Very high	145 Å²	145	52.8 Å²	52.8	78%	0.775	27%	0.268	S	S	*	.			trans	-89.8	-3.3	173.4	-66	-41.4	0	0	0	112.8	D88	D86-D88 PolarHBondContact O-N 2.93Å
87	W	94.5	Very high	96.8	Very high	94 Å²	94	50.2 Å²	50.2	36%	0.356	25%	0.254	S	S	.	.			trans	-80.6	104	-176.2	-57.6	119.5	0	0	0	112.3	K79 S85 Y129 V134	K79-W87 PolarHBondContact N-O 2.83Å; S85-W87 PolarHBondContact OG-N 2.8Å; W87-Y129 HydrophobicContact CB-CE1 3.73Å; W87-Y129 AromaticContact CD1-CD1 3.49Å; W87-Y129 VanDerWaalsContact CD1-CD1 3.49Å; W87-Y129 AromaticContact CD1-CE1 3.58Å; W87-Y129 HydrophobicContact CD2-CE1 4.5Å; W87-Y129 HydrophobicContact CG-CD1 4.06Å; W87-Y129 AromaticContact CG-CE1 3.67Å; W87-Y129 HydrophobicContact CG-CE1 3.67Å; W87-V134 HydrophobicContact CD2-CG2 4.07Å; W87-V134 HydrophobicContact CE3-CG2 3.77Å; W87-V134 HydrophobicContact CG-CG2 4.46Å; W87-V134 HydrophobicContact CH2-CG1 4.48Å; W87-V134 HydrophobicContact CZ3-CG1 4.46Å; W87-V134 HydrophobicContact CZ3-CG2 4.25Å
88	D	95.6	Very high	96.8	Very high	127 Å²	127	49.2 Å²	49.2	68%	0.679	25%	0.248	S	C	*	.			trans	-102	22.4	180	67.2	-17.6	0	0	0	113.5	T77 D86	T77-D88 WeakPolarHBondContact CG2-O 3.45Å; D86-D88 PolarHBondContact O-N 2.93Å
89	I	97.3	Very high	96.8	Very high	26 Å²	26	49.4 Å²	49.4	13%	0.133	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-86.1	132.9	177.4	-60	-172.9	0	0	0	109.1	T77 L91 V134 D137 A138 V143	T77-I89 WeakPolarHBondContact CA-O 3.44Å; T77-I89 WeakPolarHBondContact CB-O 3.27Å; I89-L91 PolarHBondContact O-N 2.75Å; I89-V134 HydrophobicContact CB-CG2 4.47Å; I89-V134 HydrophobicContact CD1-CG2 3.86Å; I89-V134 HydrophobicContact CG1-CG2 4.49Å; I89-D137 HydrophobicContact CG2-CB 4.16Å; I89-A138 HydrophobicContact CD1-CB 3.85Å; I89-A138 HydrophobicContact CG2-CB 4.08Å; I89-V143 HydrophobicContact CD1-CG1 4.2Å; I89-V143 HydrophobicContact CG2-CG2 4.26Å
90	K	98	Very high	96.9	Very high	46 Å²	46	47.9 Å²	47.9	20%	0.2	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-57.7	135.6	174.4	176	176.3	149.7	159.4	0	109.5	H69 F74 L76 N141	H69-K90 WeakPolarHBondContact O-CE 3.37Å; H69-K90 PolarHBondContact O-NZ 2.81Å; F74-K90 HydrophobicContact CD1-CD 3.94Å; F74-K90 HydrophobicContact CD1-CG 4.01Å; F74-K90 HydrophobicContact CE1-CD 4.26Å; F74-K90 HydrophobicContact CE1-CG 3.82Å; F74-K90 PolarHBondContact O-NZ 3.13Å; F74-K90 VanDerWaalsContact O-NZ 3.09Å; L76-K90 WeakPolarHBondContact O-CA 3.11Å; K90-N141 WeakPolarHBondContact CD-OD1 3.44Å; K90-N141 WeakPolarHBondContact CE-OD1 3.3Å; K90-N141 WeakPolarHBondContact CG-OD1 3.41Å; K90-N141 PolarHBondContact O-ND2 3.16Å
91	L	98.8	Very high	96.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-73.6	137.1	178.8	-60.2	175	0	0	0	110.4	F74 L76 F81 I89 L96 V99 Y129 D137	F74-L91 WeakPolarHBondContact CE1-O 3.46Å; F74-L91 HydrophobicContact CZ-CB 4.48Å; L76-L91 PolarHBondContact O-N 3.27Å; F81-L91 HydrophobicContact CD2-CD1 3.87Å; F81-L91 HydrophobicContact CE2-CD1 3.55Å; F81-L91 HydrophobicContact CZ-CD1 4.48Å; I89-L91 PolarHBondContact O-N 2.75Å; L91-L96 HydrophobicContact CB-CD2 4.26Å; L91-L96 HydrophobicContact CB-CG 4.16Å; L91-L96 HydrophobicContact CD1-CD2 3.99Å; L91-V99 HydrophobicContact CD1-CG1 3.95Å; L91-V99 HydrophobicContact CD1-CG2 4Å; L91-V99 HydrophobicContact CD2-CG1 4.39Å; L91-Y129 HydrophobicContact CD2-CE2 4.16Å; L91-Y129 WeakPolarHBondContact CD2-OH 3.46Å; L91-D137 WeakPolarHBondContact CD2-OD2 3.38Å
92	S	98.7	Very high	96.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.			trans	-87	-173.5	162.2	67.6	0	0	0	0	110.2	D19 A94 G95 L96 D137 D140	D19-S92 VanDerWaalsContact CB-OG 3.24Å; D19-S92 WeakPolarHBondContact CB-OG 3.45Å; S92-A94 PolarHBondContact O-N 3.13Å; S92-A94 PolarHBondContact OG-N 3.19Å; S92-G95 PolarHBondContact O-N 3.39Å; S92-L96 WeakPolarHBondContact O-CG 3.38Å; S92-L96 PolarHBondContact O-N 3Å; S92-D137 PolarHBondContact N-OD1 3.23Å; S92-D137 PolarHBondContact OG-OD1 3.37Å; S92-D140 WeakPolarHBondContact CB-OD2 3.2Å
93	S	98.5	Very high	97	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.1	-36	175.4	69.4	0	0	0	0	112.6	D19 E20 H69 L96 I97	D19-S93 VanDerWaalsContact C-OG 3.24Å; D19-S93 PolarHBondContact O-OG 3.47Å; D19-S93 PolarHBondContact OD2-OG 3.16Å; E20-S93 VanDerWaalsContact CA-OG 3.29Å; E20-S93 WeakPolarHBondContact CA-OG 3.16Å; E20-S93 PolarHBondContact N-OG 3.12Å; H69-S93 PolarHBondContact CD2-N 3.22Å; S93-L96 PolarHBondContact O-N 3.3Å; S93-I97 WeakPolarHBondContact O-CG1 3.4Å; S93-I97 PolarHBondContact O-N 3.47Å
94	A	98.9	Very high	97.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-52.3	173.8	0	0	0	0	0	111.7	D19 L22 M26 S92 L96 I97 Y98 I136	D19-A94 HydrophobicContact CB-CB 4.02Å; D19-A94 WeakPolarHBondContact O-CB 3.5Å; L22-A94 HydrophobicContact CB-CB 4.15Å; L22-A94 HydrophobicContact CD2-CB 3.96Å; L22-A94 HydrophobicContact CG-CB 4.14Å; M26-A94 HydrophobicContact CE-CB 4.28Å; M26-A94 VanDerWaalsContact CE-O 3.27Å; M26-A94 WeakPolarHBondContact CE-O 3.35Å; S92-A94 PolarHBondContact O-N 3.13Å; S92-A94 PolarHBondContact OG-N 3.19Å; A94-L96 VanDerWaalsContact C-N 3.29Å; A94-L96 PolarHBondContact O-N 3.2Å; A94-I97 PolarHBondContact O-N 2.96Å; A94-Y98 WeakPolarHBondContact O-CB 3.46Å; A94-Y98 PolarHBondContact O-N 3.07Å; A94-I136 HydrophobicContact CB-CG2 3.95Å
95	G	98.8	Very high	97.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.4	-42.5	177.4	0	0	0	0	0	112.4	S92 Y98 V99 D137	S92-G95 PolarHBondContact O-N 3.39Å; G95-Y98 WeakPolarHBondContact O-CB 3.5Å; G95-Y98 PolarHBondContact O-N 2.66Å; G95-V99 WeakPolarHBondContact O-CG1 3.49Å; G95-V99 WeakPolarHBondContact O-CG2 3.2Å; G95-V99 PolarHBondContact O-N 3.26Å; G95-D137 WeakPolarHBondContact CA-OD1 3.49Å; G95-D137 PolarHBondContact N-OD1 3.3Å
96	L	98.8	Very high	97.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-50.5	176	-77	179.5	0	0	0	112.6	F60 Y67 H69 F74 L91 S92 S93 A94 Y98 V99 H100	F60-L96 HydrophobicContact CD2-CD1 3.81Å; F60-L96 HydrophobicContact CD2-CD2 3.95Å; F60-L96 HydrophobicContact CD2-CG 4.5Å; F60-L96 HydrophobicContact CE2-CD1 4.04Å; F60-L96 HydrophobicContact CE2-CD2 3.37Å; F60-L96 HydrophobicContact CE2-CG 4.24Å; F60-L96 HydrophobicContact CZ-CD2 3.78Å; Y67-L96 HydrophobicContact CD1-CB 4.1Å; H69-L96 HydrophobicContact CB-CD1 4.22Å; F74-L96 HydrophobicContact CE2-CD1 4.02Å; F74-L96 HydrophobicContact CE2-CD2 4.05Å; F74-L96 HydrophobicContact CZ-CD1 3.92Å; F74-L96 HydrophobicContact CZ-CD2 3.77Å; F74-L96 HydrophobicContact CZ-CG 4.08Å; L91-L96 HydrophobicContact CB-CD2 4.26Å; L91-L96 HydrophobicContact CB-CG 4.16Å; L91-L96 HydrophobicContact CD1-CD2 3.99Å; S92-L96 WeakPolarHBondContact O-CG 3.38Å; S92-L96 PolarHBondContact O-N 3Å; S93-L96 PolarHBondContact O-N 3.3Å; A94-L96 VanDerWaalsContact C-N 3.29Å; A94-L96 PolarHBondContact O-N 3.2Å; L96-Y98 PolarHBondContact O-N 2.98Å; L96-V99 VanDerWaalsContact O-CG2 3.3Å; L96-V99 WeakPolarHBondContact O-CG2 3.31Å; L96-V99 PolarHBondContact O-N 3.39Å; L96-H100 PolarHBondContact O-CD2 3.14Å; L96-H100 PolarHBondContact O-N 3.31Å
97	I	98.9	Very high	98.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.5	-39.1	174.8	-68.2	-49.7	0	0	0	110.8	A23 M26 L27 I52 V54 Y67 S93 A94 H100 F101 I105	A23-I97 HydrophobicContact CB-CB 4.38Å; A23-I97 HydrophobicContact CB-CG1 3.79Å; M26-I97 HydrophobicContact CB-CG2 4.05Å; M26-I97 HydrophobicContact CE-CB 3.99Å; M26-I97 HydrophobicContact CE-CG2 3.85Å; L27-I97 HydrophobicContact CD1-CD1 4.08Å; L27-I97 HydrophobicContact CD1-CG1 4.32Å; L27-I97 HydrophobicContact CD2-CD1 4.15Å; L27-I97 HydrophobicContact CD2-CG2 4.04Å; L27-I97 HydrophobicContact CG-CD1 4.29Å; L27-I97 HydrophobicContact CG-CG1 4.39Å; L27-I97 HydrophobicContact CG-CG2 3.98Å; I52-I97 HydrophobicContact CD1-CD1 4.06Å; V54-I97 HydrophobicContact CG1-CD1 3.78Å; V54-I97 HydrophobicContact CG1-CG1 3.91Å; Y67-I97 HydrophobicContact CD1-CD1 4.27Å; Y67-I97 HydrophobicContact CD2-CD1 3.57Å; Y67-I97 HydrophobicContact CE2-CD1 3.95Å; Y67-I97 HydrophobicContact CG-CD1 3.74Å; S93-I97 WeakPolarHBondContact O-CG1 3.4Å; S93-I97 PolarHBondContact O-N 3.47Å; A94-I97 PolarHBondContact O-N 2.96Å; I97-H100 PolarHBondContact O-N 3.26Å; I97-F101 HydrophobicContact CD1-CD2 4.12Å; I97-F101 HydrophobicContact CD1-CE2 4.02Å; I97-F101 HydrophobicContact CG2-CD2 4.16Å; I97-F101 WeakPolarHBondContact O-CB 3.38Å; I97-F101 WeakPolarHBondContact O-CD2 3.25Å; I97-F101 PolarHBondContact O-N 3.03Å; I97-I105 HydrophobicContact CG2-CD1 4.09Å
98	Y	98.8	Very high	98.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66	-45.4	-178.8	-166.3	-98.4	0	0	0	113	M26 A94 G95 L96 H100 G102 F125 M128 Y129 I133	M26-Y98 HydrophobicContact SD-CD2 3.74Å; A94-Y98 WeakPolarHBondContact O-CB 3.46Å; A94-Y98 PolarHBondContact O-N 3.07Å; G95-Y98 WeakPolarHBondContact O-CB 3.5Å; G95-Y98 PolarHBondContact O-N 2.66Å; L96-Y98 PolarHBondContact O-N 2.98Å; Y98-H100 VanDerWaalsContact C-N 3.27Å; Y98-H100 PolarHBondContact O-N 3.18Å; Y98-G102 WeakPolarHBondContact O-CA 3.2Å; Y98-G102 PolarHBondContact O-N 2.71Å; Y98-F125 HydrophobicContact CD1-CD2 4.5Å; Y98-F125 AromaticContact CD1-CE2 3.83Å; Y98-F125 HydrophobicContact CD1-CE2 3.83Å; Y98-F125 HydrophobicContact CD1-CZ 4.1Å; Y98-F125 AromaticContact CE1-CD2 3.64Å; Y98-F125 HydrophobicContact CE1-CD2 3.64Å; Y98-F125 HydrophobicContact CE1-CE1 4.43Å; Y98-F125 AromaticContact CE1-CE2 3.37Å; Y98-F125 HydrophobicContact CE1-CE2 3.37Å; Y98-F125 HydrophobicContact CE1-CG 4.27Å; Y98-F125 AromaticContact CE1-CZ 3.81Å; Y98-F125 HydrophobicContact CE1-CZ 3.81Å; Y98-F125 AromaticContact CZ-CD2 3.71Å; Y98-F125 AromaticContact CZ-CE2 3.84Å; Y98-F125 WeakPolarHBondContact O-CE2 3.29Å; Y98-F125 VanDerWaalsContact OH-CA 3.27Å; Y98-F125 WeakPolarHBondContact OH-CA 3.45Å; Y98-F125 PolarHBondContact OH-O 3.41Å; Y98-M128 HydrophobicContact CE2-CB 4.39Å; Y98-M128 VanDerWaalsContact OH-CB 3.24Å; Y98-M128 WeakPolarHBondContact OH-CB 3.48Å; Y98-Y129 AromaticContact CD1-CD2 3.79Å; Y98-Y129 HydrophobicContact CD1-CD2 3.79Å; Y98-Y129 HydrophobicContact CE1-CD2 4.15Å; Y98-Y129 HydrophobicContact CE1-CG 4.47Å; Y98-I133 HydrophobicContact CD1-CG1 4.07Å; Y98-I133 HydrophobicContact CD2-CD1 3.83Å; Y98-I133 HydrophobicContact CD2-CG1 3.77Å; Y98-I133 HydrophobicContact CE1-CG1 4.29Å; Y98-I133 HydrophobicContact CE2-CD1 4.24Å; Y98-I133 HydrophobicContact CE2-CG1 4.01Å; Y98-I133 HydrophobicContact CG-CD1 4.19Å; Y98-I133 HydrophobicContact CG-CG1 3.8Å; Y98-I133 HydrophobicContact CG-CG2 4.26Å
99	V	98.5	Very high	98.4	Very high	9 Å²	9	17.3 Å²	17.3	6%	0.055	8%	0.082	C	C	.	.	H	α-helix	trans	-67	-28.4	179.5	-61.4	0	0	0	0	112.7	Y78 F81 Y82 L91 G95 L96	Y78-V99 HydrophobicContact CD2-CG1 3.59Å; Y78-V99 HydrophobicContact CE2-CG1 3.96Å; F81-V99 HydrophobicContact CB-CB 4.27Å; F81-V99 HydrophobicContact CB-CG1 4.42Å; F81-V99 HydrophobicContact CD1-CB 4.28Å; F81-V99 HydrophobicContact CD1-CG2 3.96Å; F81-V99 HydrophobicContact CD2-CB 4.33Å; F81-V99 HydrophobicContact CD2-CG1 4.32Å; F81-V99 HydrophobicContact CD2-CG2 4.03Å; F81-V99 HydrophobicContact CE1-CG2 3.98Å; F81-V99 HydrophobicContact CE2-CG2 4.07Å; F81-V99 HydrophobicContact CG-CB 4.04Å; F81-V99 HydrophobicContact CG-CG1 4.37Å; F81-V99 HydrophobicContact CG-CG2 3.99Å; F81-V99 HydrophobicContact CZ-CG2 4.04Å; Y82-V99 HydrophobicContact CD2-CG1 4.43Å; Y82-V99 HydrophobicContact CE2-CB 3.99Å; Y82-V99 HydrophobicContact CE2-CG1 3.95Å; Y82-V99 PolarHBondContact OH-O 2.9Å; Y82-V99 VanDerWaalsContact OH-O 3.1Å; L91-V99 HydrophobicContact CD1-CG1 3.95Å; L91-V99 HydrophobicContact CD1-CG2 4Å; L91-V99 HydrophobicContact CD2-CG1 4.39Å; G95-V99 WeakPolarHBondContact O-CG1 3.49Å; G95-V99 WeakPolarHBondContact O-CG2 3.2Å; G95-V99 PolarHBondContact O-N 3.26Å; L96-V99 VanDerWaalsContact O-CG2 3.3Å; L96-V99 WeakPolarHBondContact O-CG2 3.31Å; L96-V99 PolarHBondContact O-N 3.39Å
100	H	98.3	Very high	98.4	Very high	68 Å²	68	17.8 Å²	17.8	32%	0.315	9%	0.085	S	C	.	.	H	α-helix	trans	-89.5	-37.2	-179.6	-76.3	-72.6	0	0	0	113.8	F60 P62 Y67 F81 L96 I97 Y98	F60-H100 AromaticContact CE2-NE2 3.99Å; F60-H100 AromaticContact CZ-NE2 3.68Å; P62-H100 VanDerWaalsContact CG-CE1 3.47Å; P62-H100 WeakPolarHBondContact CG-CE1 3.17Å; P62-H100 WeakPolarHBondContact CG-NE2 3.46Å; Y67-H100 HydrophobicContact CE1-CB 4.3Å; Y67-H100 AromaticContact CE1-CD2 3.51Å; Y67-H100 AromaticContact CE1-CG 3.91Å; F81-H100 AromaticContact CE1-CE1 3.75Å; F81-H100 AromaticContact CE1-NE2 3.49Å; F81-H100 WeakPolarHBondContact CE1-NE2 3.47Å; F81-H100 AromaticContact CZ-NE2 3.95Å; L96-H100 PolarHBondContact O-CD2 3.14Å; L96-H100 PolarHBondContact O-N 3.31Å; I97-H100 PolarHBondContact O-N 3.26Å; Y98-H100 VanDerWaalsContact C-N 3.27Å; Y98-H100 PolarHBondContact O-N 3.18Å
101	F	98.3	Very high	98.4	Very high	28 Å²	28	19 Å²	19	12%	0.123	11%	0.11	C	C	.	.	H	α-helix	trans	-122.5	-8.6	-171.2	-57	-79.3	0	0	0	113.9	L27 L30 I52 Y67 I97 R103 K104 I105	L27-F101 HydrophobicContact CD2-CD2 4.3Å; L27-F101 HydrophobicContact CD2-CE2 4.44Å; L30-F101 HydrophobicContact CD1-CB 4.2Å; L30-F101 HydrophobicContact CD1-CD1 3.94Å; L30-F101 HydrophobicContact CD1-CG 4.18Å; I52-F101 HydrophobicContact CD1-CE2 4.11Å; I52-F101 HydrophobicContact CD1-CZ 4.26Å; Y67-F101 HydrophobicContact CE1-CE2 4.34Å; Y67-F101 AromaticContact CE2-CE2 3.84Å; Y67-F101 HydrophobicContact CE2-CE2 3.84Å; Y67-F101 HydrophobicContact CE2-CZ 4.28Å; Y67-F101 AromaticContact CZ-CE2 3.56Å; Y67-F101 VanDerWaalsContact OH-CE2 3.22Å; Y67-F101 WeakPolarHBondContact OH-CE2 3.47Å; Y67-F101 VanDerWaalsContact OH-CZ 3.26Å; Y67-F101 WeakPolarHBondContact OH-CZ 3.28Å; I97-F101 HydrophobicContact CD1-CD2 4.12Å; I97-F101 HydrophobicContact CD1-CE2 4.02Å; I97-F101 HydrophobicContact CG2-CD2 4.16Å; I97-F101 WeakPolarHBondContact O-CB 3.38Å; I97-F101 WeakPolarHBondContact O-CD2 3.25Å; I97-F101 PolarHBondContact O-N 3.03Å; F101-R103 VanDerWaalsContact C-N 3.31Å; F101-R103 PolarHBondContact O-N 2.93Å; F101-K104 WeakPolarHBondContact O-CA 3.45Å; F101-K104 WeakPolarHBondContact O-CB 3.49Å; F101-K104 PolarHBondContact O-N 3.34Å; F101-I105 HydrophobicContact CB-CD1 3.62Å; F101-I105 HydrophobicContact CB-CG1 4.13Å; F101-I105 WeakPolarHBondContact O-CG1 3.26Å; F101-I105 PolarHBondContact O-N 3.2Å
102	G	98.2	Very high	98.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-57.2	-39.2	-166.9	0	0	0	0	0	113.8	Y98 I105 L106	Y98-G102 WeakPolarHBondContact O-CA 3.2Å; Y98-G102 PolarHBondContact O-N 2.71Å; G102-I105 PolarHBondContact O-N 3.35Å; G102-L106 WeakPolarHBondContact O-CB 3.43Å; G102-L106 WeakPolarHBondContact O-CG 3.36Å; G102-L106 PolarHBondContact O-N 3.35Å
103	R	97.8	Very high	98.2	Very high	66 Å²	66	24.9 Å²	24.9	25%	0.249	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-46.3	174.9	-68.1	178.5	-179.1	-88.9	-9.7	112	F101 L106 S107 V121 T122 F125	F101-R103 VanDerWaalsContact C-N 3.31Å; F101-R103 PolarHBondContact O-N 2.93Å; R103-L106 PolarHBondContact O-N 3.47Å; R103-S107 WeakPolarHBondContact O-CB 3.46Å; R103-S107 PolarHBondContact O-N 3.35Å; R103-S107 PolarHBondContact O-OG 3.4Å; R103-S107 VanDerWaalsContact O-OG 3.13Å; R103-V121 HydrophobicContact CB-CG1 4.25Å; R103-T122 PolarHBondContact NH1-OG1 3.3Å; R103-F125 HydrophobicContact CG-CB 4.28Å; R103-F125 HydrophobicContact CG-CD2 3.56Å; R103-F125 HydrophobicContact CG-CE2 4.02Å; R103-F125 HydrophobicContact CG-CG 3.9Å
104	K	97.9	Very high	97.7	Very high	52 Å²	52	28.8 Å²	28.8	23%	0.226	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-46.8	176.9	-169.9	-178.6	176.6	-170.2	0	110.8	L30 E32 F101 L106 S107 C108 E114	L30-K104 HydrophobicContact CD2-CB 4Å; L30-K104 HydrophobicContact CD2-CD 3.62Å; L30-K104 HydrophobicContact CD2-CG 3.58Å; E32-K104 VanDerWaalsContact CD-NZ 3.25Å; E32-K104 IonicContact OE1-NZ 3.63Å; E32-K104 PolarHBondContact OE1-NZ 2.85Å; E32-K104 IonicContact OE2-NZ 2.68Å; E32-K104 PolarHBondContact OE2-NZ 2.89Å; F101-K104 WeakPolarHBondContact O-CA 3.45Å; F101-K104 WeakPolarHBondContact O-CB 3.49Å; F101-K104 PolarHBondContact O-N 3.34Å; K104-L106 PolarHBondContact O-N 2.98Å; K104-S107 WeakPolarHBondContact O-CB 3.38Å; K104-S107 PolarHBondContact O-N 2.86Å; K104-C108 PolarHBondContact O-N 3.09Å; K104-C108 PolarHBondContact O-SG 3.27Å; K104-E114 VanDerWaalsContact CE-CD 3.42Å; K104-E114 WeakPolarHBondContact CE-OE1 3.31Å; K104-E114 WeakPolarHBondContact CE-OE2 3.32Å; K104-E114 HydrophobicContact CG-CB 4.1Å; K104-E114 VanDerWaalsContact CG-OE2 3.31Å; K104-E114 WeakPolarHBondContact CG-OE2 3.22Å
105	I	98.6	Very high	97.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-55.9	-49.9	176.3	-68.7	158.4	0	0	0	111.1	M26 H29 L30 I97 F101 G102 C108 I109 F191	M26-I105 HydrophobicContact CB-CD1 3.74Å; M26-I105 HydrophobicContact CG-CD1 4.38Å; M26-I105 HydrophobicContact SD-CD1 4.47Å; H29-I105 HydrophobicContact CB-CG2 4.16Å; L30-I105 HydrophobicContact CD1-CG1 4.47Å; L30-I105 HydrophobicContact CD2-CG1 3.74Å; L30-I105 HydrophobicContact CG-CG1 3.98Å; I97-I105 HydrophobicContact CG2-CD1 4.09Å; F101-I105 HydrophobicContact CB-CD1 3.62Å; F101-I105 HydrophobicContact CB-CG1 4.13Å; F101-I105 WeakPolarHBondContact O-CG1 3.26Å; F101-I105 PolarHBondContact O-N 3.2Å; G102-I105 PolarHBondContact O-N 3.35Å; I105-C108 PolarHBondContact O-N 2.86Å; I105-I109 HydrophobicContact CG2-CD1 3.86Å; I105-I109 WeakPolarHBondContact O-CG1 3.17Å; I105-I109 PolarHBondContact O-N 3.25Å; I105-F191 HydrophobicContact CG2-CE1 3.86Å; I105-F191 HydrophobicContact CG2-CZ 4.09Å
106	L	98.7	Very high	96.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-43.7	178.7	-69.5	175.3	0	0	0	111.7	G102 R103 K104 C108 I109 L110 V121 L124 F125 M128 F191 V195	G102-L106 WeakPolarHBondContact O-CB 3.43Å; G102-L106 WeakPolarHBondContact O-CG 3.36Å; G102-L106 PolarHBondContact O-N 3.35Å; R103-L106 PolarHBondContact O-N 3.47Å; K104-L106 PolarHBondContact O-N 2.98Å; L106-C108 PolarHBondContact O-N 3.47Å; L106-I109 PolarHBondContact O-N 3.49Å; L106-L110 WeakPolarHBondContact O-CB 3.39Å; L106-L110 VanDerWaalsContact O-CG 3.3Å; L106-L110 WeakPolarHBondContact O-CG 3.34Å; L106-L110 PolarHBondContact O-N 2.95Å; L106-V121 HydrophobicContact CB-CG1 4.26Å; L106-L124 HydrophobicContact CD1-CB 4.12Å; L106-F125 HydrophobicContact CD1-CB 4.18Å; L106-F125 HydrophobicContact CD1-CD2 4.42Å; L106-M128 HydrophobicContact CD2-CG 4.21Å; L106-F191 HydrophobicContact CD2-CZ 4.49Å; L106-V195 HydrophobicContact CD2-CB 4.3Å; L106-V195 HydrophobicContact CD2-CG1 3.82Å; L106-V195 HydrophobicContact CD2-CG2 3.48Å; L106-V195 VanDerWaalsContact CD2-CG2 3.48Å
107	S	98.5	Very high	96.4	Very high	3 Å²	3	45 Å²	45	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-58.1	-45.9	174.9	-68.4	0	0	0	0	111.8	R103 K104 L110 G111 I112	R103-S107 WeakPolarHBondContact O-CB 3.46Å; R103-S107 PolarHBondContact O-N 3.35Å; R103-S107 PolarHBondContact O-OG 3.4Å; R103-S107 VanDerWaalsContact O-OG 3.13Å; K104-S107 WeakPolarHBondContact O-CB 3.38Å; K104-S107 PolarHBondContact O-N 2.86Å; S107-L110 PolarHBondContact O-N 3.28Å; S107-G111 PolarHBondContact O-N 3.31Å; S107-I112 CarbonylContact C-O 3.59Å; S107-I112 WeakPolarHBondContact CB-O 3.11Å; S107-I112 PolarHBondContact O-N 2.83Å
108	C	98.1	Very high	96.2	Very high	39 Å²	39	47.4 Å²	47.4	26%	0.264	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-44.3	178.2	-64.8	0	0	0	0	112.7	H29 K104 I105 L106 L110 G111	H29-C108 WeakPolarHBondContact O-CB 3.47Å; K104-C108 PolarHBondContact O-N 3.09Å; K104-C108 PolarHBondContact O-SG 3.27Å; I105-C108 PolarHBondContact O-N 2.86Å; L106-C108 PolarHBondContact O-N 3.47Å; C108-L110 VanDerWaalsContact C-N 3.28Å; C108-L110 PolarHBondContact O-N 3.33Å; C108-G111 PolarHBondContact O-N 2.94Å
109	I	98.3	Very high	96	Very high	25 Å²	25	51.5 Å²	51.5	13%	0.128	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-39.7	177.7	-69.6	167.2	0	0	0	111.1	H29 I105 L106 F191 T192 V195	H29-I109 HydrophobicContact CB-CD1 4.29Å; H29-I109 HydrophobicContact CB-CG1 3.99Å; H29-I109 WeakPolarHBondContact ND1-CG1 3.38Å; I105-I109 HydrophobicContact CG2-CD1 3.86Å; I105-I109 WeakPolarHBondContact O-CG1 3.17Å; I105-I109 PolarHBondContact O-N 3.25Å; L106-I109 PolarHBondContact O-N 3.49Å; I109-F191 HydrophobicContact CD1-CD1 4.11Å; I109-F191 HydrophobicContact CD1-CE1 3.52Å; I109-F191 HydrophobicContact CD1-CZ 4.43Å; I109-T192 HydrophobicContact CD1-CG2 4.33Å; I109-V195 HydrophobicContact CB-CG1 4.34Å; I109-V195 HydrophobicContact CD1-CG2 4.35Å; I109-V195 HydrophobicContact CG2-CB 4.32Å; I109-V195 HydrophobicContact CG2-CG1 3.72Å
110	L	98	Very high	95.9	Very high	37 Å²	37	52.5 Å²	52.5	19%	0.194	29%	0.29	C	S	.	.	H	α-helix	trans	-87.9	-5.6	-176	-63.1	171.9	0	0	0	113.9	L106 S107 C108 I112 L120 L124 V195 A199	L106-L110 WeakPolarHBondContact O-CB 3.39Å; L106-L110 VanDerWaalsContact O-CG 3.3Å; L106-L110 WeakPolarHBondContact O-CG 3.34Å; L106-L110 PolarHBondContact O-N 2.95Å; S107-L110 PolarHBondContact O-N 3.28Å; C108-L110 VanDerWaalsContact C-N 3.28Å; C108-L110 PolarHBondContact O-N 3.33Å; L110-I112 VanDerWaalsContact C-N 3.28Å; L110-I112 HydrophobicContact CB-CD1 3.81Å; L110-I112 HydrophobicContact CB-CG1 3.97Å; L110-I112 HydrophobicContact CD1-CD1 4.07Å; L110-I112 PolarHBondContact O-N 2.9Å; L110-L120 HydrophobicContact CD1-CD2 4.4Å; L110-L124 HydrophobicContact CD1-CD1 3.45Å; L110-L124 VanDerWaalsContact CD1-CD1 3.45Å; L110-V195 HydrophobicContact CD1-CG1 4.42Å; L110-V195 HydrophobicContact CD2-CG1 3.99Å; L110-V195 HydrophobicContact CG-CG1 4.13Å; L110-A199 HydrophobicContact CD1-CB 4.2Å; L110-A199 HydrophobicContact CD2-CB 3.54Å
111	G	97.3	Very high	95.9	Very high	71 Å²	71	49.5 Å²	49.5	73%	0.732	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	27.6	-174.8	0	0	0	0	0	113.7	S107 C108	S107-G111 PolarHBondContact O-N 3.31Å; C108-G111 PolarHBondContact O-N 2.94Å
112	I	97.1	Very high	95.8	Very high	37 Å²	37	50.1 Å²	50.1	19%	0.19	28%	0.283	C	S	.	.			trans	-93.3	143.6	176.3	-63	171.1	0	0	0	108.5	S107 L110 E114 D118 L120 V121	S107-I112 CarbonylContact C-O 3.59Å; S107-I112 WeakPolarHBondContact CB-O 3.11Å; S107-I112 PolarHBondContact O-N 2.83Å; L110-I112 VanDerWaalsContact C-N 3.28Å; L110-I112 HydrophobicContact CB-CD1 3.81Å; L110-I112 HydrophobicContact CB-CG1 3.97Å; L110-I112 HydrophobicContact CD1-CD1 4.07Å; L110-I112 PolarHBondContact O-N 2.9Å; I112-E114 PolarHBondContact O-N 3.22Å; I112-E114 VanDerWaalsContact O-N 3.17Å; I112-D118 HydrophobicContact CG2-CB 3.86Å; I112-L120 HydrophobicContact CD1-CD2 3.97Å; I112-V121 HydrophobicContact CB-CG2 4.38Å; I112-V121 HydrophobicContact CD1-CG2 3.72Å; I112-V121 HydrophobicContact CG2-CG2 4.13Å
113	D	94.9	Very high	95.7	Very high	87 Å²	87	51.3 Å²	51.3	47%	0.465	29%	0.293	S	S	.	.			trans	-62.4	117.8	175.7	179.3	3	0	0	0	110.3	N115 T116	D113-N115 PolarHBondContact O-N 3.43Å; D113-N115 VanDerWaalsContact O-N 3.14Å; D113-N115 WeakPolarHBondContact OD1-CB 3.14Å; D113-N115 PolarHBondContact OD1-N 3.49Å; D113-N115 PolarHBondContact OD1-ND2 3.48Å; D113-T116 HydrophobicContact CB-CG2 3.84Å; D113-T116 WeakPolarHBondContact O-CB 3.04Å; D113-T116 PolarHBondContact O-N 3.47Å; D113-T116 PolarHBondContact O-OG1 3.43Å
114	E	89.1	Confident	95.7	Very high	81 Å²	81	48.2 Å²	48.2	38%	0.379	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.4	-180	63.3	-178.5	-144.6	0	0	114	K104 I112 T116	K104-E114 VanDerWaalsContact CE-CD 3.42Å; K104-E114 WeakPolarHBondContact CE-OE1 3.31Å; K104-E114 WeakPolarHBondContact CE-OE2 3.32Å; K104-E114 HydrophobicContact CG-CB 4.1Å; K104-E114 VanDerWaalsContact CG-OE2 3.31Å; K104-E114 WeakPolarHBondContact CG-OE2 3.22Å; I112-E114 PolarHBondContact O-N 3.22Å; I112-E114 VanDerWaalsContact O-N 3.17Å; E114-T116 VanDerWaalsContact C-N 3.27Å
115	N	88.8	Confident	95.7	Very high	136 Å²	136	45.7 Å²	45.7	73%	0.727	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-6.2	176.9	-57.9	-72.4	0	0	0	112.8	D113	D113-N115 PolarHBondContact O-N 3.43Å; D113-N115 VanDerWaalsContact O-N 3.14Å; D113-N115 WeakPolarHBondContact OD1-CB 3.14Å; D113-N115 PolarHBondContact OD1-N 3.49Å; D113-N115 PolarHBondContact OD1-ND2 3.48Å
116	T	90.2	Very high	95.5	Very high	62 Å²	62	49.6 Å²	49.6	38%	0.38	29%	0.291	S	S	.	.	S	Bend	trans	-95	137.1	178.2	67.2	0	0	0	0	110.9	D113 E114 D118	D113-T116 HydrophobicContact CB-CG2 3.84Å; D113-T116 WeakPolarHBondContact O-CB 3.04Å; D113-T116 PolarHBondContact O-N 3.47Å; D113-T116 PolarHBondContact O-OG1 3.43Å; E114-T116 VanDerWaalsContact C-N 3.27Å; T116-D118 PolarHBondContact O-N 2.91Å
117	M	89.1	Confident	95.4	Very high	143 Å²	143	51.3 Å²	51.3	70%	0.704	30%	0.298	S	S	*	.			trans	-82.7	64.7	168.3	-166.7	64.3	65	0	0	109.2
118	D	95.2	Very high	95.4	Very high	50 Å²	50	51.2 Å²	51.2	27%	0.267	30%	0.297	S	S	.	.			trans	-63.2	129.4	-177.2	-167.1	-63.6	0	0	0	110.5	I112 T116 L120 V121 T122	I112-D118 HydrophobicContact CG2-CB 3.86Å; T116-D118 PolarHBondContact O-N 2.91Å; D118-L120 PolarHBondContact O-N 3.12Å; D118-L120 WeakPolarHBondContact OD1-CA 3.42Å; D118-L120 WeakPolarHBondContact OD1-CB 3.39Å; D118-L120 PolarHBondContact OD1-N 3.47Å; D118-V121 HydrophobicContact CB-CB 4.23Å; D118-V121 HydrophobicContact CB-CG2 3.99Å; D118-V121 PolarHBondContact O-N 3.35Å; D118-T122 PolarHBondContact O-N 3.42Å; D118-T122 PolarHBondContact O-OG1 3.02Å
119	P	95.5	Very high	95.4	Very high	86 Å²	86	49.4 Å²	49.4	56%	0.558	29%	0.285	S	S	*	.	H	α-helix	trans	-57.1	-34.5	177.5	-26.4	35.3	0	0	0	114.1	T122 A123	P119-T122 PolarHBondContact O-N 2.98Å; P119-A123 WeakPolarHBondContact O-CB 3.27Å; P119-A123 PolarHBondContact O-N 3.42Å
120	L	96.7	Very high	95.3	Very high	31 Å²	31	50.2 Å²	50.2	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-53.6	174.3	171.5	62.3	0	0	0	109.9	L110 I112 D118 T122 A123 L124 A199 Y203	L110-L120 HydrophobicContact CD1-CD2 4.4Å; I112-L120 HydrophobicContact CD1-CD2 3.97Å; D118-L120 PolarHBondContact O-N 3.12Å; D118-L120 WeakPolarHBondContact OD1-CA 3.42Å; D118-L120 WeakPolarHBondContact OD1-CB 3.39Å; D118-L120 PolarHBondContact OD1-N 3.47Å; L120-T122 PolarHBondContact O-N 3.4Å; L120-A123 PolarHBondContact O-N 2.9Å; L120-A123 VanDerWaalsContact O-N 3.15Å; L120-L124 HydrophobicContact CD1-CD1 3.71Å; L120-L124 HydrophobicContact CD1-CD2 4.2Å; L120-L124 HydrophobicContact CD1-CG 3.73Å; L120-L124 HydrophobicContact CG-CD1 3.88Å; L120-L124 HydrophobicContact CG-CG 4.23Å; L120-L124 WeakPolarHBondContact O-CB 3.39Å; L120-L124 VanDerWaalsContact O-CG 3.24Å; L120-L124 WeakPolarHBondContact O-CG 3.43Å; L120-L124 PolarHBondContact O-N 3.42Å; L120-A199 HydrophobicContact CD1-CB 4.46Å; L120-Y203 HydrophobicContact CB-CD1 4.42Å; L120-Y203 HydrophobicContact CB-CE1 4.04Å; L120-Y203 HydrophobicContact CD1-CD1 3.37Å; L120-Y203 HydrophobicContact CD1-CD2 3.93Å; L120-Y203 HydrophobicContact CD1-CE1 3.85Å; L120-Y203 HydrophobicContact CD1-CE2 4.38Å; L120-Y203 HydrophobicContact CD1-CG 3.38Å; L120-Y203 HydrophobicContact CG-CD1 4.42Å
121	V	98	Very high	95.2	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-58.5	-38.5	179.8	175.6	0	0	0	0	110.8	R103 L106 I112 D118 L124 F125	R103-V121 HydrophobicContact CB-CG1 4.25Å; L106-V121 HydrophobicContact CB-CG1 4.26Å; I112-V121 HydrophobicContact CB-CG2 4.38Å; I112-V121 HydrophobicContact CD1-CG2 3.72Å; I112-V121 HydrophobicContact CG2-CG2 4.13Å; D118-V121 HydrophobicContact CB-CB 4.23Å; D118-V121 HydrophobicContact CB-CG2 3.99Å; D118-V121 PolarHBondContact O-N 3.35Å; V121-L124 PolarHBondContact O-N 2.77Å; V121-F125 VanDerWaalsContact O-CB 3.32Å; V121-F125 WeakPolarHBondContact O-CB 3.42Å; V121-F125 PolarHBondContact O-N 2.95Å
122	T	95.9	Very high	95.2	Very high	42 Å²	42	47.3 Å²	47.3	26%	0.258	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-48.8	176.3	-61.5	0	0	0	0	112.5	R103 D118 P119 L120 L124 F125 D126	R103-T122 PolarHBondContact NH1-OG1 3.3Å; D118-T122 PolarHBondContact O-N 3.42Å; D118-T122 PolarHBondContact O-OG1 3.02Å; P119-T122 PolarHBondContact O-N 2.98Å; L120-T122 PolarHBondContact O-N 3.4Å; T122-L124 VanDerWaalsContact C-N 3.33Å; T122-L124 PolarHBondContact O-N 2.75Å; T122-F125 WeakPolarHBondContact O-CB 3.49Å; T122-F125 PolarHBondContact O-N 3.49Å; T122-D126 PolarHBondContact O-N 3.43Å
123	A	95.4	Very high	95.3	Very high	26 Å²	26	45.6 Å²	45.6	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-38.2	177.8	0	0	0	0	0	112.2	P119 L120 F125 K127 Y203	P119-A123 WeakPolarHBondContact O-CB 3.27Å; P119-A123 PolarHBondContact O-N 3.42Å; L120-A123 PolarHBondContact O-N 2.9Å; L120-A123 VanDerWaalsContact O-N 3.15Å; A123-F125 VanDerWaalsContact C-N 3.34Å; A123-K127 VanDerWaalsContact O-CB 3.28Å; A123-K127 WeakPolarHBondContact O-CB 3.39Å; A123-K127 PolarHBondContact O-N 3.24Å; A123-Y203 HydrophobicContact CB-CD2 3.79Å; A123-Y203 HydrophobicContact CB-CE2 3.46Å; A123-Y203 VanDerWaalsContact CB-CE2 3.46Å
124	L	97.6	Very high	95.4	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.4	-33.5	176.8	-68.1	-175.5	0	0	0	112.6	L106 L110 L120 V121 T122 K127 M128 Y198 A199 W202	L106-L124 HydrophobicContact CD1-CB 4.12Å; L110-L124 HydrophobicContact CD1-CD1 3.45Å; L110-L124 VanDerWaalsContact CD1-CD1 3.45Å; L120-L124 HydrophobicContact CD1-CD1 3.71Å; L120-L124 HydrophobicContact CD1-CD2 4.2Å; L120-L124 HydrophobicContact CD1-CG 3.73Å; L120-L124 HydrophobicContact CG-CD1 3.88Å; L120-L124 HydrophobicContact CG-CG 4.23Å; L120-L124 WeakPolarHBondContact O-CB 3.39Å; L120-L124 VanDerWaalsContact O-CG 3.24Å; L120-L124 WeakPolarHBondContact O-CG 3.43Å; L120-L124 PolarHBondContact O-N 3.42Å; V121-L124 PolarHBondContact O-N 2.77Å; T122-L124 VanDerWaalsContact C-N 3.33Å; T122-L124 PolarHBondContact O-N 2.75Å; L124-K127 PolarHBondContact O-N 3.12Å; L124-M128 VanDerWaalsContact O-CB 3.25Å; L124-M128 WeakPolarHBondContact O-CB 3.35Å; L124-M128 WeakPolarHBondContact O-CG 3.35Å; L124-M128 PolarHBondContact O-N 3.37Å; L124-Y198 VanDerWaalsContact CD2-C 3.5Å; L124-A199 HydrophobicContact CD1-CB 3.73Å; L124-W202 HydrophobicContact CD2-CE3 4.48Å
125	F	97.9	Very high	95.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.3	-50.6	177.9	-176.7	-98.1	0	0	0	111.4	Y78 Y82 Y98 R103 L106 V121 T122 A123 K127 Y129	Y78-F125 HydrophobicContact CE2-CE1 4.21Å; Y78-F125 HydrophobicContact CE2-CZ 4.34Å; Y78-F125 AromaticContact CZ-CE1 3.95Å; Y78-F125 WeakPolarHBondContact OH-CD1 3.4Å; Y78-F125 WeakPolarHBondContact OH-CE1 3.09Å; Y82-F125 HydrophobicContact CD1-CE1 4.34Å; Y82-F125 HydrophobicContact CD2-CE1 4.13Å; Y82-F125 HydrophobicContact CD2-CZ 4.49Å; Y82-F125 AromaticContact CE1-CE1 3.76Å; Y82-F125 HydrophobicContact CE1-CE1 3.76Å; Y82-F125 HydrophobicContact CE1-CZ 4.28Å; Y82-F125 AromaticContact CE2-CE1 3.5Å; Y82-F125 HydrophobicContact CE2-CE1 3.5Å; Y82-F125 AromaticContact CE2-CZ 3.52Å; Y82-F125 HydrophobicContact CE2-CZ 3.52Å; Y82-F125 AromaticContact CZ-CE1 3.3Å; Y82-F125 AromaticContact CZ-CZ 3.39Å; Y82-F125 WeakPolarHBondContact OH-CE1 3.45Å; Y82-F125 WeakPolarHBondContact OH-CZ 3.23Å; Y98-F125 HydrophobicContact CD1-CD2 4.5Å; Y98-F125 AromaticContact CD1-CE2 3.83Å; Y98-F125 HydrophobicContact CD1-CE2 3.83Å; Y98-F125 HydrophobicContact CD1-CZ 4.1Å; Y98-F125 AromaticContact CE1-CD2 3.64Å; Y98-F125 HydrophobicContact CE1-CD2 3.64Å; Y98-F125 HydrophobicContact CE1-CE1 4.43Å; Y98-F125 AromaticContact CE1-CE2 3.37Å; Y98-F125 HydrophobicContact CE1-CE2 3.37Å; Y98-F125 HydrophobicContact CE1-CG 4.27Å; Y98-F125 AromaticContact CE1-CZ 3.81Å; Y98-F125 HydrophobicContact CE1-CZ 3.81Å; Y98-F125 AromaticContact CZ-CD2 3.71Å; Y98-F125 AromaticContact CZ-CE2 3.84Å; Y98-F125 WeakPolarHBondContact O-CE2 3.29Å; Y98-F125 VanDerWaalsContact OH-CA 3.27Å; Y98-F125 WeakPolarHBondContact OH-CA 3.45Å; Y98-F125 PolarHBondContact OH-O 3.41Å; R103-F125 HydrophobicContact CG-CB 4.28Å; R103-F125 HydrophobicContact CG-CD2 3.56Å; R103-F125 HydrophobicContact CG-CE2 4.02Å; R103-F125 HydrophobicContact CG-CG 3.9Å; L106-F125 HydrophobicContact CD1-CB 4.18Å; L106-F125 HydrophobicContact CD1-CD2 4.42Å; V121-F125 VanDerWaalsContact O-CB 3.32Å; V121-F125 WeakPolarHBondContact O-CB 3.42Å; V121-F125 PolarHBondContact O-N 2.95Å; T122-F125 WeakPolarHBondContact O-CB 3.49Å; T122-F125 PolarHBondContact O-N 3.49Å; A123-F125 VanDerWaalsContact C-N 3.34Å; F125-K127 VanDerWaalsContact C-N 3.32Å; F125-K127 PolarHBondContact O-N 3.43Å; F125-Y129 PolarHBondContact O-N 3.18Å; F125-Y129 VanDerWaalsContact O-N 3.15Å
126	D	95.8	Very high	96.3	Very high	81 Å²	81	35 Å²	35	43%	0.433	20%	0.199	S	C	.	.	H	α-helix	trans	-67.2	-37.5	177.7	-58.6	-25.1	0	0	0	111	T122 S130	T122-D126 PolarHBondContact O-N 3.43Å; D126-S130 WeakPolarHBondContact O-CB 3.49Å; D126-S130 PolarHBondContact O-N 2.8Å; D126-S130 VanDerWaalsContact O-N 3.08Å; D126-S130 PolarHBondContact O-OG 3.23Å
127	K	96.4	Very high	96.7	Very high	37 Å²	37	32.1 Å²	32.1	16%	0.161	18%	0.181	C	C	.	.	H	α-helix	trans	-68	-45.8	-179.4	-177.6	57.5	-176.2	173.8	0	112.8	A123 L124 F125 Y129 S130 S131 Y198 W202	A123-K127 VanDerWaalsContact O-CB 3.28Å; A123-K127 WeakPolarHBondContact O-CB 3.39Å; A123-K127 PolarHBondContact O-N 3.24Å; L124-K127 PolarHBondContact O-N 3.12Å; F125-K127 VanDerWaalsContact C-N 3.32Å; F125-K127 PolarHBondContact O-N 3.43Å; K127-Y129 VanDerWaalsContact C-N 3.35Å; K127-S130 PolarHBondContact O-OG 3Å; K127-S130 VanDerWaalsContact O-OG 3.08Å; K127-S131 VanDerWaalsContact O-CB 3.29Å; K127-S131 WeakPolarHBondContact O-CB 3.41Å; K127-S131 PolarHBondContact O-N 2.72Å; K127-S131 PolarHBondContact O-OG 3Å; K127-Y198 HydrophobicContact CD-CD1 4.33Å; K127-Y198 HydrophobicContact CD-CE1 4.13Å; K127-Y198 VanDerWaalsContact CE-CZ 3.49Å; K127-Y198 HydrophobicContact CG-CD1 3.73Å; K127-Y198 HydrophobicContact CG-CD2 4.07Å; K127-Y198 HydrophobicContact CG-CE1 3.95Å; K127-Y198 HydrophobicContact CG-CE2 4.22Å; K127-Y198 HydrophobicContact CG-CG 3.82Å; K127-W202 HydrophobicContact CB-CH2 4.18Å; K127-W202 HydrophobicContact CB-CZ3 4.13Å; K127-W202 HydrophobicContact CD-CH2 4.27Å; K127-W202 HydrophobicContact CD-CZ2 4.05Å; K127-W202 HydrophobicContact CG-CD2 4.42Å; K127-W202 HydrophobicContact CG-CE3 4.22Å; K127-W202 HydrophobicContact CG-CH2 4.18Å; K127-W202 HydrophobicContact CG-CZ2 4.37Å; K127-W202 HydrophobicContact CG-CZ3 4.09Å
128	M	98.3	Very high	97.2	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.6	-37.6	179.7	-78.1	-62.5	-62.2	0	0	111	Y98 L106 L124 F132 I133 F191 L194 V195 Y198	Y98-M128 HydrophobicContact CE2-CB 4.39Å; Y98-M128 VanDerWaalsContact OH-CB 3.24Å; Y98-M128 WeakPolarHBondContact OH-CB 3.48Å; L106-M128 HydrophobicContact CD2-CG 4.21Å; L124-M128 VanDerWaalsContact O-CB 3.25Å; L124-M128 WeakPolarHBondContact O-CB 3.35Å; L124-M128 WeakPolarHBondContact O-CG 3.35Å; L124-M128 PolarHBondContact O-N 3.37Å; M128-F132 HydrophobicContact CE-CB 4.27Å; M128-F132 HydrophobicContact CE-CD1 3.94Å; M128-F132 HydrophobicContact CE-CG 4.36Å; M128-F132 WeakPolarHBondContact O-CB 3.45Å; M128-F132 PolarHBondContact O-N 2.91Å; M128-I133 PolarHBondContact O-N 2.88Å; M128-I133 VanDerWaalsContact O-N 3.12Å; M128-F191 HydrophobicContact CE-CD2 3.47Å; M128-F191 VanDerWaalsContact CE-CD2 3.47Å; M128-F191 HydrophobicContact CE-CE2 3.39Å; M128-F191 HydrophobicContact CE-CZ 4.41Å; M128-L194 HydrophobicContact CE-CB 4.07Å; M128-L194 HydrophobicContact SD-CB 4.04Å; M128-V195 HydrophobicContact CE-CG2 3.77Å; M128-V195 HydrophobicContact CG-CG2 4.38Å; M128-V195 HydrophobicContact SD-CG2 4.05Å; M128-Y198 HydrophobicContact CG-CD2 4.39Å; M128-Y198 HydrophobicContact SD-CD2 3.47Å; M128-Y198 WeakPolarHBondContact SD-CD2 3.37Å; M128-Y198 HydrophobicContact SD-CE2 3.81Å
129	Y	98.5	Very high	97.3	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	16%	0.159	C	C	.	.	I	π-helix	trans	-61.5	-56.5	173.9	-169.5	-96.2	0	0	0	111.6	Y78 W87 L91 Y98 F125 K127 S131 I133 V134 D137	Y78-Y129 VanDerWaalsContact CB-CZ 3.45Å; Y78-Y129 WeakPolarHBondContact CB-OH 3.29Å; Y78-Y129 AromaticContact CD1-CD1 3.99Å; Y78-Y129 HydrophobicContact CD1-CD1 3.99Å; Y78-Y129 AromaticContact CD1-CE1 3.95Å; Y78-Y129 HydrophobicContact CD1-CE1 3.95Å; Y78-Y129 AromaticContact CD2-CD1 3.59Å; Y78-Y129 HydrophobicContact CD2-CD1 3.59Å; Y78-Y129 AromaticContact CD2-CD2 3.31Å; Y78-Y129 HydrophobicContact CD2-CD2 3.31Å; Y78-Y129 AromaticContact CD2-CE1 3.5Å; Y78-Y129 HydrophobicContact CD2-CE1 3.5Å; Y78-Y129 AromaticContact CD2-CE2 3.23Å; Y78-Y129 HydrophobicContact CD2-CE2 3.23Å; Y78-Y129 AromaticContact CD2-CG 3.51Å; Y78-Y129 HydrophobicContact CD2-CG 3.51Å; Y78-Y129 AromaticContact CD2-CZ 3.35Å; Y78-Y129 HydrophobicContact CE1-CD1 4.03Å; Y78-Y129 HydrophobicContact CE1-CE1 4.46Å; Y78-Y129 HydrophobicContact CE1-CG 4.35Å; Y78-Y129 AromaticContact CE2-CD1 3.66Å; Y78-Y129 HydrophobicContact CE2-CD1 3.66Å; Y78-Y129 AromaticContact CE2-CD2 3.3Å; Y78-Y129 HydrophobicContact CE2-CD2 3.3Å; Y78-Y129 HydrophobicContact CE2-CE1 4.09Å; Y78-Y129 AromaticContact CE2-CE2 3.78Å; Y78-Y129 HydrophobicContact CE2-CE2 3.78Å; Y78-Y129 AromaticContact CE2-CG 3.25Å; Y78-Y129 HydrophobicContact CE2-CG 3.25Å; Y78-Y129 AromaticContact CG-CD1 3.73Å; Y78-Y129 HydrophobicContact CG-CD1 3.73Å; Y78-Y129 HydrophobicContact CG-CD2 4.23Å; Y78-Y129 AromaticContact CG-CE1 3.39Å; Y78-Y129 HydrophobicContact CG-CE1 3.39Å; Y78-Y129 AromaticContact CG-CE2 3.95Å; Y78-Y129 HydrophobicContact CG-CE2 3.95Å; Y78-Y129 HydrophobicContact CG-CG 4.15Å; Y78-Y129 AromaticContact CG-CZ 3.54Å; Y78-Y129 AromaticContact CZ-CD1 3.85Å; Y78-Y129 AromaticContact CZ-CG 3.69Å; W87-Y129 HydrophobicContact CB-CE1 3.73Å; W87-Y129 AromaticContact CD1-CD1 3.49Å; W87-Y129 VanDerWaalsContact CD1-CD1 3.49Å; W87-Y129 AromaticContact CD1-CE1 3.58Å; W87-Y129 HydrophobicContact CD2-CE1 4.5Å; W87-Y129 HydrophobicContact CG-CD1 4.06Å; W87-Y129 AromaticContact CG-CE1 3.67Å; W87-Y129 HydrophobicContact CG-CE1 3.67Å; L91-Y129 HydrophobicContact CD2-CE2 4.16Å; L91-Y129 WeakPolarHBondContact CD2-OH 3.46Å; Y98-Y129 AromaticContact CD1-CD2 3.79Å; Y98-Y129 HydrophobicContact CD1-CD2 3.79Å; Y98-Y129 HydrophobicContact CE1-CD2 4.15Å; Y98-Y129 HydrophobicContact CE1-CG 4.47Å; F125-Y129 PolarHBondContact O-N 3.18Å; F125-Y129 VanDerWaalsContact O-N 3.15Å; K127-Y129 VanDerWaalsContact C-N 3.35Å; Y129-S131 VanDerWaalsContact C-N 3.25Å; Y129-S131 PolarHBondContact O-N 3.14Å; Y129-I133 HydrophobicContact CD2-CB 3.63Å; Y129-I133 HydrophobicContact CD2-CG1 4.31Å; Y129-I133 HydrophobicContact CD2-CG2 3.73Å; Y129-I133 HydrophobicContact CE2-CB 3.98Å; Y129-I133 HydrophobicContact CE2-CG2 3.67Å; Y129-I133 HydrophobicContact CG-CB 4.4Å; Y129-I133 PolarHBondContact O-N 2.93Å; Y129-V134 HydrophobicContact CD1-CB 4.33Å; Y129-V134 HydrophobicContact CE1-CB 3.84Å; Y129-V134 HydrophobicContact CE1-CG2 4.06Å; Y129-V134 WeakPolarHBondContact O-CB 3.16Å; Y129-V134 WeakPolarHBondContact O-CG1 3.3Å; Y129-V134 PolarHBondContact O-N 3.4Å; Y129-D137 WeakPolarHBondContact CE2-OD2 3.29Å; Y129-D137 PolarHBondContact OH-OD2 3.07Å
130	S	95.6	Very high	97.4	Very high	42 Å²	42	25.4 Å²	25.4	29%	0.294	14%	0.144	S	C	.	.	I	π-helix	trans	-64.4	-22.9	-175.5	55.3	0	0	0	0	115.1	D126 K127	D126-S130 WeakPolarHBondContact O-CB 3.49Å; D126-S130 PolarHBondContact O-N 2.8Å; D126-S130 VanDerWaalsContact O-N 3.08Å; D126-S130 PolarHBondContact O-OG 3.23Å; K127-S130 PolarHBondContact O-OG 3Å; K127-S130 VanDerWaalsContact O-OG 3.08Å
131	S	95.2	Very high	97.5	Very high	37 Å²	37	26 Å²	26	26%	0.259	15%	0.147	S	C	.	.	I	π-helix	trans	-112.9	-7.1	-174.7	68	0	0	0	0	115.2	K127 Y129 Y198	K127-S131 VanDerWaalsContact O-CB 3.29Å; K127-S131 WeakPolarHBondContact O-CB 3.41Å; K127-S131 PolarHBondContact O-N 2.72Å; K127-S131 PolarHBondContact O-OG 3Å; Y129-S131 VanDerWaalsContact C-N 3.25Å; Y129-S131 PolarHBondContact O-N 3.14Å; S131-Y198 WeakPolarHBondContact CB-OH 3.35Å; S131-Y198 VanDerWaalsContact OG-CE2 3.22Å; S131-Y198 WeakPolarHBondContact OG-CE2 3.5Å; S131-Y198 VanDerWaalsContact OG-CZ 3.29Å; S131-Y198 PolarHBondContact OG-OH 2.92Å
132	F	98.3	Very high	97.4	Very high	11 Å²	11	28.7 Å²	28.7	5%	0.048	18%	0.177	C	C	.	.	I	π-helix	trans	-145.9	-55.8	-175.3	-173.8	-113.7	0	0	0	113.1	L22 M128 V134 E135 L158 E190 F191 L194	L22-F132 HydrophobicContact CD1-CE1 3.95Å; L22-F132 HydrophobicContact CD2-CD1 4.37Å; L22-F132 HydrophobicContact CD2-CE1 3.73Å; L22-F132 HydrophobicContact CD2-CZ 4.42Å; M128-F132 HydrophobicContact CE-CB 4.27Å; M128-F132 HydrophobicContact CE-CD1 3.94Å; M128-F132 HydrophobicContact CE-CG 4.36Å; M128-F132 WeakPolarHBondContact O-CB 3.45Å; M128-F132 PolarHBondContact O-N 2.91Å; F132-V134 PolarHBondContact O-N 2.9Å; F132-E135 WeakPolarHBondContact O-CB 3.46Å; F132-E135 PolarHBondContact O-N 3.19Å; F132-L158 HydrophobicContact CE2-CD2 3.73Å; F132-L158 HydrophobicContact CZ-CD2 3.49Å; F132-L158 VanDerWaalsContact CZ-CD2 3.49Å; F132-E190 HydrophobicContact CE2-CG 4.06Å; F132-E190 HydrophobicContact CZ-CG 4.33Å; F132-F191 AromaticContact CD1-CD2 3.84Å; F132-F191 HydrophobicContact CD1-CD2 3.84Å; F132-F191 HydrophobicContact CE1-CB 4.03Å; F132-F191 AromaticContact CE1-CD2 3.61Å; F132-F191 HydrophobicContact CE1-CD2 3.61Å; F132-F191 HydrophobicContact CE1-CG 4.3Å; F132-F191 HydrophobicContact CZ-CB 4.42Å; F132-L194 HydrophobicContact CB-CD1 4.14Å; F132-L194 HydrophobicContact CD1-CD1 4.43Å; F132-L194 HydrophobicContact CD2-CD1 3.29Å; F132-L194 HydrophobicContact CE2-CD1 3.68Å; F132-L194 HydrophobicContact CG-CD1 3.7Å; F132-L194 HydrophobicContact CZ-CD1 4.39Å
133	I	98.7	Very high	97.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-66.8	-42	-173.8	-51.2	-62.6	0	0	0	111.6	L22 M26 Y98 M128 Y129 E135 I136 D137 F191	L22-I133 HydrophobicContact CD2-CD1 3.86Å; M26-I133 HydrophobicContact SD-CD1 4.21Å; Y98-I133 HydrophobicContact CD1-CG1 4.07Å; Y98-I133 HydrophobicContact CD2-CD1 3.83Å; Y98-I133 HydrophobicContact CD2-CG1 3.77Å; Y98-I133 HydrophobicContact CE1-CG1 4.29Å; Y98-I133 HydrophobicContact CE2-CD1 4.24Å; Y98-I133 HydrophobicContact CE2-CG1 4.01Å; Y98-I133 HydrophobicContact CG-CD1 4.19Å; Y98-I133 HydrophobicContact CG-CG1 3.8Å; Y98-I133 HydrophobicContact CG-CG2 4.26Å; M128-I133 PolarHBondContact O-N 2.88Å; M128-I133 VanDerWaalsContact O-N 3.12Å; Y129-I133 HydrophobicContact CD2-CB 3.63Å; Y129-I133 HydrophobicContact CD2-CG1 4.31Å; Y129-I133 HydrophobicContact CD2-CG2 3.73Å; Y129-I133 HydrophobicContact CE2-CB 3.98Å; Y129-I133 HydrophobicContact CE2-CG2 3.67Å; Y129-I133 HydrophobicContact CG-CB 4.4Å; Y129-I133 PolarHBondContact O-N 2.93Å; I133-E135 PolarHBondContact O-N 3.41Å; I133-I136 WeakPolarHBondContact O-CA 3.5Å; I133-I136 WeakPolarHBondContact O-CB 3.3Å; I133-I136 PolarHBondContact O-N 2.75Å; I133-D137 PolarHBondContact O-N 3.08Å; I133-F191 HydrophobicContact CD1-CE2 4.25Å
134	V	98.2	Very high	97.4	Very high	13 Å²	13	32.8 Å²	32.8	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-29.4	-179.3	72.3	0	0	0	0	112.8	W87 I89 Y129 F132 A138	W87-V134 HydrophobicContact CD2-CG2 4.07Å; W87-V134 HydrophobicContact CE3-CG2 3.77Å; W87-V134 HydrophobicContact CG-CG2 4.46Å; W87-V134 HydrophobicContact CH2-CG1 4.48Å; W87-V134 HydrophobicContact CZ3-CG1 4.46Å; W87-V134 HydrophobicContact CZ3-CG2 4.25Å; I89-V134 HydrophobicContact CB-CG2 4.47Å; I89-V134 HydrophobicContact CD1-CG2 3.86Å; I89-V134 HydrophobicContact CG1-CG2 4.49Å; Y129-V134 HydrophobicContact CD1-CB 4.33Å; Y129-V134 HydrophobicContact CE1-CB 3.84Å; Y129-V134 HydrophobicContact CE1-CG2 4.06Å; Y129-V134 WeakPolarHBondContact O-CB 3.16Å; Y129-V134 WeakPolarHBondContact O-CG1 3.3Å; Y129-V134 PolarHBondContact O-N 3.4Å; F132-V134 PolarHBondContact O-N 2.9Å; V134-A138 WeakPolarHBondContact O-CB 3.2Å; V134-A138 PolarHBondContact O-N 2.92Å
135	E	97.9	Very high	97.2	Very high	69 Å²	69	39.4 Å²	39.4	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-43.3	173	177.3	-178.9	128.9	0	0	110.8	F132 I133 A138 I139	F132-E135 WeakPolarHBondContact O-CB 3.46Å; F132-E135 PolarHBondContact O-N 3.19Å; I133-E135 PolarHBondContact O-N 3.41Å; E135-A138 PolarHBondContact O-N 3.35Å; E135-I139 HydrophobicContact CG-CD1 3.77Å; E135-I139 WeakPolarHBondContact O-CB 3.35Å; E135-I139 VanDerWaalsContact O-CG1 3.25Å; E135-I139 WeakPolarHBondContact O-CG1 3.35Å; E135-I139 PolarHBondContact O-N 3.42Å
136	I	98.7	Very high	96.9	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-44.9	-179.1	-56.2	-57	0	0	0	110.7	A18 D19 L22 A94 I133 A138 I139 D140 L158	A18-I136 HydrophobicContact CB-CD1 4.17Å; A18-I136 HydrophobicContact CB-CG2 4.47Å; D19-I136 VanDerWaalsContact CA-CG2 3.47Å; D19-I136 HydrophobicContact CB-CG2 3.62Å; L22-I136 HydrophobicContact CD2-CB 4.37Å; L22-I136 HydrophobicContact CD2-CG1 3.91Å; L22-I136 HydrophobicContact CD2-CG2 4.32Å; A94-I136 HydrophobicContact CB-CG2 3.95Å; I133-I136 WeakPolarHBondContact O-CA 3.5Å; I133-I136 WeakPolarHBondContact O-CB 3.3Å; I133-I136 PolarHBondContact O-N 2.75Å; I136-A138 VanDerWaalsContact C-N 3.34Å; I136-A138 PolarHBondContact O-N 2.92Å; I136-I139 PolarHBondContact O-N 2.86Å; I136-D140 WeakPolarHBondContact O-CB 3.25Å; I136-D140 PolarHBondContact O-N 3.3Å; I136-D140 VanDerWaalsContact O-N 3.12Å; I136-L158 HydrophobicContact CD1-CD2 4.28Å
137	D	98.8	Very high	96.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.1	-47.6	173.3	-74.3	-24.9	0	0	0	111.5	I89 L91 S92 G95 Y129 I133 N141	I89-D137 HydrophobicContact CG2-CB 4.16Å; L91-D137 WeakPolarHBondContact CD2-OD2 3.38Å; S92-D137 PolarHBondContact N-OD1 3.23Å; S92-D137 PolarHBondContact OG-OD1 3.37Å; G95-D137 WeakPolarHBondContact CA-OD1 3.49Å; G95-D137 PolarHBondContact N-OD1 3.3Å; Y129-D137 WeakPolarHBondContact CE2-OD2 3.29Å; Y129-D137 PolarHBondContact OH-OD2 3.07Å; I133-D137 PolarHBondContact O-N 3.08Å; D137-N141 WeakPolarHBondContact O-CB 3.45Å; D137-N141 PolarHBondContact O-N 3.22Å; D137-N141 PolarHBondContact O-ND2 3.17Å
138	A	98.2	Very high	96.6	Very high	14 Å²	14	47.2 Å²	47.2	12%	0.116	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-47.1	-178.1	0	0	0	0	0	112.4	I89 V134 E135 I136 D140 N141 G142 V143	I89-A138 HydrophobicContact CD1-CB 3.85Å; I89-A138 HydrophobicContact CG2-CB 4.08Å; V134-A138 WeakPolarHBondContact O-CB 3.2Å; V134-A138 PolarHBondContact O-N 2.92Å; E135-A138 PolarHBondContact O-N 3.35Å; I136-A138 VanDerWaalsContact C-N 3.34Å; I136-A138 PolarHBondContact O-N 2.92Å; A138-D140 PolarHBondContact O-N 2.91Å; A138-N141 PolarHBondContact O-N 3.03Å; A138-G142 PolarHBondContact O-N 2.96Å; A138-G142 VanDerWaalsContact O-N 3.11Å; A138-V143 HydrophobicContact CB-CB 4.08Å; A138-V143 PolarHBondContact O-N 3.3Å
139	I	97.8	Very high	96.2	Very high	80 Å²	80	53.2 Å²	53.2	41%	0.41	33%	0.33	S	S	.	.	H	α-helix	trans	-62.1	-45.7	-178.8	-73	169.6	0	0	0	110.7	E135 I136 G142	E135-I139 HydrophobicContact CG-CD1 3.77Å; E135-I139 WeakPolarHBondContact O-CB 3.35Å; E135-I139 VanDerWaalsContact O-CG1 3.25Å; E135-I139 WeakPolarHBondContact O-CG1 3.35Å; E135-I139 PolarHBondContact O-N 3.42Å; I136-I139 PolarHBondContact O-N 2.86Å; I139-G142 PolarHBondContact O-N 3.3Å
140	D	98.3	Very high	95.9	Very high	44 Å²	44	58 Å²	58	24%	0.235	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-40.9	-178.4	-179.4	58.1	0	0	0	111.9	D19 H69 S92 I136 A138 G142	D19-D140 HydrophobicContact CB-CB 4.28Å; H69-D140 IonicContact CE1-OD2 3.89Å; H69-D140 PolarHBondContact CE1-OD2 3.02Å; H69-D140 IonicContact ND1-OD2 3.44Å; H69-D140 IonicContact NE2-OD2 2.7Å; H69-D140 PolarHBondContact NE2-OD2 3.22Å; H69-D140 VanDerWaalsContact NE2-OD2 3.11Å; S92-D140 WeakPolarHBondContact CB-OD2 3.2Å; I136-D140 WeakPolarHBondContact O-CB 3.25Å; I136-D140 PolarHBondContact O-N 3.3Å; I136-D140 VanDerWaalsContact O-N 3.12Å; A138-D140 PolarHBondContact O-N 2.91Å; D140-G142 PolarHBondContact O-N 3.18Å
141	N	97.9	Very high	95.9	Very high	43 Å²	43	67.9 Å²	67.9	23%	0.23	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	5.5	175.5	-74.3	-80.3	0	0	0	114.5	K90 D137 A138 V143	K90-N141 WeakPolarHBondContact CD-OD1 3.44Å; K90-N141 WeakPolarHBondContact CE-OD1 3.3Å; K90-N141 WeakPolarHBondContact CG-OD1 3.41Å; K90-N141 PolarHBondContact O-ND2 3.16Å; D137-N141 WeakPolarHBondContact O-CB 3.45Å; D137-N141 PolarHBondContact O-N 3.22Å; D137-N141 PolarHBondContact O-ND2 3.17Å; A138-N141 PolarHBondContact O-N 3.03Å; N141-V143 HydrophobicContact CB-CG2 4.19Å; N141-V143 PolarHBondContact O-N 3.12Å
142	G	96.1	Very high	95.8	Very high	62 Å²	62	74.5 Å²	74.5	64%	0.639	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	21.9	179.1	0	0	0	0	0	114.3	A138 I139 D140 P144	A138-G142 PolarHBondContact O-N 2.96Å; A138-G142 VanDerWaalsContact O-N 3.11Å; I139-G142 PolarHBondContact O-N 3.3Å; D140-G142 PolarHBondContact O-N 3.18Å; G142-P144 WeakPolarHBondContact O-CD 3.22Å
143	V	96.6	Very high	95.5	Very high	59 Å²	59	78.1 Å²	78.1	36%	0.358	43%	0.433	S	S	.	.			trans	-79.2	118.6	176.6	-179.1	0	0	0	0	108.9	I89 A138 N141	I89-V143 HydrophobicContact CD1-CG1 4.2Å; I89-V143 HydrophobicContact CG2-CG2 4.26Å; A138-V143 HydrophobicContact CB-CB 4.08Å; A138-V143 PolarHBondContact O-N 3.3Å; N141-V143 HydrophobicContact CB-CG2 4.19Å; N141-V143 PolarHBondContact O-N 3.12Å
144	P	94.3	Very high	95.2	Very high	94 Å²	94	82.2 Å²	82.2	61%	0.61	45%	0.453	S	S	*	.			trans	-71.3	145.7	-178.7	30.5	-35.3	0	0	0	111	G142 A146	G142-P144 WeakPolarHBondContact O-CD 3.22Å; P144-A146 PolarHBondContact O-N 3.41Å; P144-A146 VanDerWaalsContact O-N 3.09Å
145	M	93	Very high	95	Very high	139 Å²	139	86.5 Å²	86.5	69%	0.685	48%	0.476	S	S	*	.	S	Bend	trans	-57.2	-25.2	176	-177.4	-177.2	-70.7	0	0	113.6	M154	M145-M154 HydrophobicContact CE-CE 4.36Å
146	A	93.2	Very high	94.9	Very high	37 Å²	37	88.3 Å²	88.3	31%	0.306	49%	0.492	S	S	.	.			trans	-146.2	152.6	177.6	0	0	0	0	0	111	P144 T148 L150	P144-A146 PolarHBondContact O-N 3.41Å; P144-A146 VanDerWaalsContact O-N 3.09Å; A146-T148 PolarHBondContact O-N 3.22Å; A146-L150 HydrophobicContact CB-CD2 4.03Å
147	T	91.7	Very high	94.8	Very high	151 Å²	151	89.1 Å²	89.1	93%	0.926	50%	0.497	S	S	*	.	S	Bend	trans	-75	-15.5	172.8	54.7	0	0	0	0	113
148	T	93.1	Very high	94.8	Very high	95 Å²	95	89.5 Å²	89.5	58%	0.583	50%	0.499	S	S	*	.	S	Bend	trans	-99.5	152.8	174.8	58.4	0	0	0	0	110.5	A146 L150	A146-T148 PolarHBondContact O-N 3.22Å; T148-L150 PolarHBondContact O-N 3.17Å
149	P	90.7	Very high	94.8	Very high	125 Å²	125	89.7 Å²	89.7	81%	0.812	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-56.2	128	176.3	-25.1	34.4	0	0	0	111.7
150	L	91.9	Very high	94.8	Very high	103 Å²	103	87 Å²	87	54%	0.539	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63.2	138.7	173.8	-60.2	179.5	0	0	0	109.9	A146 T148 Y152	A146-L150 HydrophobicContact CB-CD2 4.03Å; T148-L150 PolarHBondContact O-N 3.17Å; L150-Y152 VanDerWaalsContact C-N 3.25Å; L150-Y152 PolarHBondContact O-N 3.44Å
151	R	94.7	Very high	94.8	Very high	249 Å²	249	88.7 Å²	88.7	94%	0.94	49%	0.491	S	S	*	.	S	Bend	trans	-72.7	-18.5	178.6	-67	-171.8	-179.7	-166	1	113.5
152	Y	94.9	Very high	94.9	Very high	175 Å²	175	86.6 Å²	86.6	69%	0.686	48%	0.48	S	S	*	.	S	Bend	trans	-154.1	158.5	177.7	58.4	-91.4	0	0	0	109.8	L150	L150-Y152 VanDerWaalsContact C-N 3.25Å; L150-Y152 PolarHBondContact O-N 3.44Å
153	S	91.9	Very high	95	Very high	87 Å²	87	86.8 Å²	86.8	61%	0.608	47%	0.466	S	S	*	.			trans	-90.2	134.7	172.9	59.1	0	0	0	0	111.1	N155	S153-N155 PolarHBondContact OG-ND2 2.77Å
154	M	91.4	Very high	95	Very high	86 Å²	86	91.2 Å²	91.2	42%	0.424	48%	0.477	S	S	.	.			trans	-91.7	112.9	173	-171.4	-174.5	-59.9	0	0	110.5	M145 S160	M145-M154 HydrophobicContact CE-CE 4.36Å; M154-S160 PolarHBondContact O-OG 3Å
155	N	93.9	Very high	95.1	Very high	104 Å²	104	89.7 Å²	89.7	56%	0.556	46%	0.462	S	S	*	.			trans	-103	5.7	178.2	-69.3	-70.2	0	0	0	113.1	S153 S160 R164	S153-N155 PolarHBondContact OG-ND2 2.77Å; N155-S160 VanDerWaalsContact O-CB 3.29Å; N155-S160 WeakPolarHBondContact O-CB 3.48Å; N155-R164 PolarHBondContact O-NH1 3.48Å
156	T	96.6	Very high	95.4	Very high	107 Å²	107	84.1 Å²	84.1	66%	0.656	44%	0.435	S	S	*	.			trans	-110.9	0.1	-176.3	53.7	0	0	0	0	114	R161	T156-R161 WeakPolarHBondContact O-CD 3.45Å
157	S	96.4	Very high	95.5	Very high	17 Å²	17	84.5 Å²	84.5	12%	0.119	43%	0.434	C	S	.	.	S	Bend	trans	-59.8	162	175.2	63.4	0	0	0	0	111.9	S159 S160 R161	S157-S159 VanDerWaalsContact C-N 3.33Å; S157-S159 PolarHBondContact O-N 2.8Å; S157-S160 WeakPolarHBondContact O-CB 3.46Å; S157-S160 PolarHBondContact O-N 3.21Å; S157-S160 VanDerWaalsContact O-N 3.12Å; S157-S160 WeakPolarHBondContact OG-CB 3.3Å; S157-S160 PolarHBondContact OG-N 3.27Å; S157-S160 PolarHBondContact OG-OG 3.19Å; S157-R161 WeakPolarHBondContact O-CG 3.37Å; S157-R161 PolarHBondContact O-N 3.07Å
158	L	98.3	Very high	95.7	Very high	9 Å²	9	79 Å²	79	5%	0.047	41%	0.405	C	S	.	.	H	α-helix	trans	-56.6	-48.5	178.6	-176.8	60.8	0	0	0	110.9	F132 I136 S160 R161 V162 L186 V187 E190	F132-L158 HydrophobicContact CE2-CD2 3.73Å; F132-L158 HydrophobicContact CZ-CD2 3.49Å; F132-L158 VanDerWaalsContact CZ-CD2 3.49Å; I136-L158 HydrophobicContact CD1-CD2 4.28Å; L158-S160 VanDerWaalsContact C-N 3.29Å; L158-S160 PolarHBondContact O-N 3.18Å; L158-R161 WeakPolarHBondContact O-CB 3.23Å; L158-R161 PolarHBondContact O-N 3.49Å; L158-V162 HydrophobicContact CD1-CG2 4.36Å; L158-V162 HydrophobicContact CG-CG2 4.44Å; L158-V162 WeakPolarHBondContact O-CG2 3.46Å; L158-V162 PolarHBondContact O-N 3.29Å; L158-L186 HydrophobicContact CD1-CD2 4.18Å; L158-L186 HydrophobicContact CD1-CG 4.16Å; L158-V187 HydrophobicContact CD1-CG2 4.02Å; L158-V187 HydrophobicContact CD2-CG1 4.4Å; L158-V187 HydrophobicContact CD2-CG2 4.21Å; L158-V187 HydrophobicContact CG-CG2 4.23Å; L158-E190 HydrophobicContact CD1-CB 4.22Å; L158-E190 HydrophobicContact CD1-CG 4.26Å; L158-E190 HydrophobicContact CD2-CB 4.42Å; L158-E190 HydrophobicContact CD2-CG 4.27Å
159	S	98.3	Very high	95.7	Very high	17 Å²	17	85.4 Å²	85.4	12%	0.119	42%	0.418	C	S	.	.	H	α-helix	trans	-60.7	-35.7	177.1	-44.1	0	0	0	0	113.2	A18 S157 N163	A18-S159 WeakPolarHBondContact CB-OG 3.42Å; S157-S159 VanDerWaalsContact C-N 3.33Å; S157-S159 PolarHBondContact O-N 2.8Å; S159-N163 WeakPolarHBondContact O-CB 3.36Å; S159-N163 PolarHBondContact O-N 3.46Å
160	S	98.1	Very high	95.9	Very high	25 Å²	25	84.2 Å²	84.2	18%	0.175	41%	0.405	C	S	.	.	H	α-helix	trans	-67.3	-37.1	173.9	-62.5	0	0	0	0	112.7	M154 N155 S157 L158 R164	M154-S160 PolarHBondContact O-OG 3Å; N155-S160 VanDerWaalsContact O-CB 3.29Å; N155-S160 WeakPolarHBondContact O-CB 3.48Å; S157-S160 WeakPolarHBondContact O-CB 3.46Å; S157-S160 PolarHBondContact O-N 3.21Å; S157-S160 VanDerWaalsContact O-N 3.12Å; S157-S160 WeakPolarHBondContact OG-CB 3.3Å; S157-S160 PolarHBondContact OG-N 3.27Å; S157-S160 PolarHBondContact OG-OG 3.19Å; L158-S160 VanDerWaalsContact C-N 3.29Å; L158-S160 PolarHBondContact O-N 3.18Å; S160-R164 WeakPolarHBondContact O-CG 3.45Å; S160-R164 PolarHBondContact O-N 3.11Å; S160-R164 PolarHBondContact O-NH1 3.44Å
161	R	98.5	Very high	95.8	Very high	78 Å²	78	84.7 Å²	84.7	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-70.1	-45.4	177.7	-67.6	161	70	-166.7	8.4	110.9	T156 S157 L158 N163 R164 M165 L186 E190	T156-R161 WeakPolarHBondContact O-CD 3.45Å; S157-R161 WeakPolarHBondContact O-CG 3.37Å; S157-R161 PolarHBondContact O-N 3.07Å; L158-R161 WeakPolarHBondContact O-CB 3.23Å; L158-R161 PolarHBondContact O-N 3.49Å; R161-N163 VanDerWaalsContact C-N 3.34Å; R161-R164 PolarHBondContact O-N 2.95Å; R161-M165 PolarHBondContact O-N 3.12Å; R161-L186 HydrophobicContact CB-CD2 3.77Å; R161-L186 VanDerWaalsContact CZ-CD1 3.5Å; R161-E190 IonicContact CZ-OE2 3.47Å; R161-E190 IonicContact NH1-OE2 3.79Å; R161-E190 PolarHBondContact NH1-OE2 3.23Å; R161-E190 IonicContact NH2-OE2 3.73Å
162	V	98.6	Very high	95.4	Very high	0 Å²	0	80.4 Å²	80.4	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-59.2	-45.9	174	172.1	0	0	0	0	110.5	F16 H17 A18 I21 L158 R164 M165 A183 L186 V187	F16-V162 HydrophobicContact CD2-CG1 3.77Å; F16-V162 HydrophobicContact CE2-CG1 3.89Å; H17-V162 VanDerWaalsContact O-CG1 3.29Å; H17-V162 WeakPolarHBondContact O-CG1 3.4Å; A18-V162 HydrophobicContact CB-CB 4.39Å; A18-V162 HydrophobicContact CB-CG2 4.28Å; I21-V162 HydrophobicContact CG1-CG1 4.29Å; L158-V162 HydrophobicContact CD1-CG2 4.36Å; L158-V162 HydrophobicContact CG-CG2 4.44Å; L158-V162 WeakPolarHBondContact O-CG2 3.46Å; L158-V162 PolarHBondContact O-N 3.29Å; V162-R164 PolarHBondContact O-N 2.93Å; V162-M165 WeakPolarHBondContact O-CA 3.38Å; V162-M165 WeakPolarHBondContact O-CB 3.17Å; V162-M165 PolarHBondContact O-N 2.97Å; V162-A183 HydrophobicContact CG1-CB 4.22Å; V162-L186 HydrophobicContact CG2-CD2 4.35Å; V162-V187 HydrophobicContact CG2-CG2 3.5Å; V162-V187 VanDerWaalsContact CG2-CG2 3.5Å
163	N	97.9	Very high	95.3	Very high	66 Å²	66	80 Å²	80	35%	0.353	41%	0.409	S	S	.	.	H	α-helix	trans	-56.4	-36.7	177.8	-179.2	60.2	0	0	0	113	R15 S159 R161 M165 N166	R15-N163 PolarHBondContact NE-OD1 3.45Å; R15-N163 PolarHBondContact NH2-OD1 3.49Å; S159-N163 WeakPolarHBondContact O-CB 3.36Å; S159-N163 PolarHBondContact O-N 3.46Å; R161-N163 VanDerWaalsContact C-N 3.34Å; N163-M165 PolarHBondContact O-N 3Å; N163-N166 PolarHBondContact O-N 3.21Å; N163-N166 PolarHBondContact O-ND2 3.33Å
164	R	97	Very high	95.3	Very high	151 Å²	151	78 Å²	78	57%	0.57	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.2	176.2	-70.9	-167.4	-57	-86.4	9.4	114.4	N155 S160 R161 V162	N155-R164 PolarHBondContact O-NH1 3.48Å; S160-R164 WeakPolarHBondContact O-CG 3.45Å; S160-R164 PolarHBondContact O-N 3.11Å; S160-R164 PolarHBondContact O-NH1 3.44Å; R161-R164 PolarHBondContact O-N 2.95Å; V162-R164 PolarHBondContact O-N 2.93Å
165	M	97.6	Very high	95.5	Very high	62 Å²	62	78 Å²	78	31%	0.305	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-11	176.1	-68.4	178.9	164.2	0	0	112.6	F16 R161 V162 N163 C179 N182 A183 L186	F16-M165 HydrophobicContact CE2-CB 4.26Å; F16-M165 HydrophobicContact CZ-CB 4.2Å; R161-M165 PolarHBondContact O-N 3.12Å; V162-M165 WeakPolarHBondContact O-CA 3.38Å; V162-M165 WeakPolarHBondContact O-CB 3.17Å; V162-M165 PolarHBondContact O-N 2.97Å; N163-M165 PolarHBondContact O-N 3Å; M165-C179 WeakPolarHBondContact O-CB 3.47Å; M165-C179 PolarHBondContact O-SG 2.96Å; M165-N182 HydrophobicContact SD-CB 4.46Å; M165-A183 HydrophobicContact CB-CB 4.27Å; M165-A183 VanDerWaalsContact SD-CA 3.5Å; M165-A183 HydrophobicContact SD-CB 3.97Å; M165-L186 HydrophobicContact CE-CB 4.12Å; M165-L186 HydrophobicContact CE-CD2 3.77Å; M165-L186 HydrophobicContact CE-CG 4.41Å; M165-L186 HydrophobicContact SD-CB 4.28Å; M165-L186 HydrophobicContact SD-CD2 3.89Å
166	N	98	Very high	95.6	Very high	22 Å²	22	75.9 Å²	75.9	12%	0.118	38%	0.382	C	S	.	.	S	Bend	trans	-61.2	150.6	170.2	-81.1	-78.8	0	0	0	111.3	R15 F16 N163 A168	R15-N166 VanDerWaalsContact CA-OD1 3.32Å; R15-N166 WeakPolarHBondContact CA-OD1 3.41Å; F16-N166 VanDerWaalsContact CD1-OD1 3.27Å; F16-N166 WeakPolarHBondContact CD1-OD1 3.49Å; F16-N166 WeakPolarHBondContact CE1-OD1 3.39Å; F16-N166 WeakPolarHBondContact CG-OD1 3.45Å; F16-N166 HydrophobicContact CZ-CB 4.42Å; F16-N166 PolarHBondContact N-OD1 3.49Å; F16-N166 PolarHBondContact O-ND2 2.89Å; N163-N166 PolarHBondContact O-N 3.21Å; N163-N166 PolarHBondContact O-ND2 3.33Å; N166-A168 PolarHBondContact O-N 3.47Å
167	P	96.3	Very high	95.6	Very high	45 Å²	45	75.5 Å²	75.5	29%	0.292	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-51.3	130.6	169.5	-27.8	36.4	0	0	0	112	T174 E176 C179	P167-T174 HydrophobicContact CB-CG2 4.04Å; P167-T174 HydrophobicContact CG-CG2 4.18Å; P167-E176 HydrophobicContact CG-CB 4.03Å; P167-E176 HydrophobicContact CG-CG 3.95Å; P167-C179 HydrophobicContact CG-CB 4.42Å
168	A	94.7	Very high	95.6	Very high	37 Å²	37	78.4 Å²	78.4	31%	0.306	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-73.2	142.7	175.4	0	0	0	0	0	110.4	N166 N170 Q171	N166-A168 PolarHBondContact O-N 3.47Å; A168-N170 WeakPolarHBondContact CB-OD1 3.28Å; A168-N170 PolarHBondContact O-N 3Å; A168-Q171 HydrophobicContact CB-CB 4.24Å; A168-Q171 HydrophobicContact CB-CG 3.99Å; A168-Q171 PolarHBondContact O-N 3.21Å
169	W	93.2	Very high	95.6	Very high	228 Å²	228	78.8 Å²	78.8	86%	0.864	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.1	-178.1	71.3	-90	0	0	0	113.9
170	N	95.1	Very high	95.6	Very high	101 Å²	101	78.4 Å²	78.4	54%	0.54	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	12.5	-179.3	65.4	-31.2	0	0	0	113.7	A168	A168-N170 WeakPolarHBondContact CB-OD1 3.28Å; A168-N170 PolarHBondContact O-N 3Å
171	Q	90.9	Very high	95.6	Very high	112 Å²	112	81.9 Å²	81.9	52%	0.523	41%	0.409	S	S	.	.			trans	-123.7	74.3	178	-63.6	-179.7	-32.5	0	0	109.9	A168 D173 T174	A168-Q171 HydrophobicContact CB-CB 4.24Å; A168-Q171 HydrophobicContact CB-CG 3.99Å; A168-Q171 PolarHBondContact O-N 3.21Å; Q171-D173 VanDerWaalsContact C-N 3.26Å; Q171-D173 PolarHBondContact O-N 3.05Å; Q171-T174 WeakPolarHBondContact CB-OG1 3.22Å; Q171-T174 WeakPolarHBondContact O-CB 3.41Å; Q171-T174 PolarHBondContact O-N 3.08Å; Q171-T174 PolarHBondContact O-OG1 3.04Å
172	L	85.7	Confident	95.6	Very high	159 Å²	159	81.6 Å²	81.6	83%	0.832	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.7	-169.9	-60.9	176.7	0	0	0	114.8	T174	L172-T174 VanDerWaalsContact C-N 3.34Å
173	D	92.3	Very high	95.6	Very high	166 Å²	166	81.6 Å²	81.6	89%	0.888	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	8.7	-177.9	-56.6	-46.7	0	0	0	113.3	Q171 D175	Q171-D173 VanDerWaalsContact C-N 3.26Å; Q171-D173 PolarHBondContact O-N 3.05Å; D173-D175 PolarHBondContact O-N 3.3Å
174	T	93.5	Very high	95.7	Very high	46 Å²	46	79.3 Å²	79.3	28%	0.282	40%	0.401	S	S	.	.			trans	-70.5	122.7	-179.5	-53	0	0	0	0	110.6	P167 Q171 L172 E176 C179	P167-T174 HydrophobicContact CB-CG2 4.04Å; P167-T174 HydrophobicContact CG-CG2 4.18Å; Q171-T174 WeakPolarHBondContact CB-OG1 3.22Å; Q171-T174 WeakPolarHBondContact O-CB 3.41Å; Q171-T174 PolarHBondContact O-N 3.08Å; Q171-T174 PolarHBondContact O-OG1 3.04Å; L172-T174 VanDerWaalsContact C-N 3.34Å; T174-E176 PolarHBondContact O-N 3.08Å; T174-E176 VanDerWaalsContact O-N 3.16Å; T174-C179 WeakPolarHBondContact CG2-SG 3.42Å
175	D	95.2	Very high	95.7	Very high	86 Å²	86	77.2 Å²	77.2	46%	0.46	40%	0.398	S	S	.	.			trans	-72.8	107.2	174.7	-172.7	-16.7	0	0	0	111.1	D173 T177 V178 C179	D173-D175 PolarHBondContact O-N 3.3Å; D175-T177 PolarHBondContact O-N 3.06Å; D175-T177 WeakPolarHBondContact OD1-CA 3.11Å; D175-T177 WeakPolarHBondContact OD1-CB 3.31Å; D175-T177 PolarHBondContact OD1-N 2.84Å; D175-T177 PolarHBondContact OD1-OG1 2.7Å; D175-V178 HydrophobicContact CB-CB 4.2Å; D175-V178 HydrophobicContact CB-CG2 3.96Å; D175-V178 PolarHBondContact O-N 3.12Å; D175-V178 VanDerWaalsContact O-N 3.16Å; D175-C179 PolarHBondContact O-N 2.88Å; D175-C179 VanDerWaalsContact O-N 3.1Å
176	E	95.2	Very high	95.8	Very high	59 Å²	59	75.5 Å²	75.5	28%	0.276	39%	0.39	S	S	.	.	H	α-helix	trans	-58.6	-30.6	177.6	-163.4	-166.6	124	0	0	112.8	G14 R40 P167 T174 C179 F180	G14-E176 VanDerWaalsContact CA-OE1 3.31Å; G14-E176 WeakPolarHBondContact CA-OE1 3.28Å; G14-E176 WeakPolarHBondContact CA-OE2 3.47Å; G14-E176 PolarHBondContact N-OE1 2.62Å; R40-E176 IonicContact CZ-OE1 2.9Å; R40-E176 IonicContact NH1-OE1 3.03Å; R40-E176 PolarHBondContact NH1-OE1 3.46Å; R40-E176 IonicContact NH2-OE1 2.68Å; R40-E176 PolarHBondContact NH2-OE1 3.29Å; P167-E176 HydrophobicContact CG-CB 4.03Å; P167-E176 HydrophobicContact CG-CG 3.95Å; T174-E176 PolarHBondContact O-N 3.08Å; T174-E176 VanDerWaalsContact O-N 3.16Å; E176-C179 WeakPolarHBondContact O-CB 3.29Å; E176-C179 PolarHBondContact O-N 2.77Å; E176-F180 WeakPolarHBondContact O-CB 3.45Å; E176-F180 PolarHBondContact O-N 2.77Å
177	T	96.1	Very high	95.8	Very high	100 Å²	100	74.5 Å²	74.5	61%	0.613	38%	0.384	S	S	*	.	H	α-helix	trans	-66.8	-42.2	178.1	-50.4	0	0	0	0	110.8	D175 F180 H181	D175-T177 PolarHBondContact O-N 3.06Å; D175-T177 WeakPolarHBondContact OD1-CA 3.11Å; D175-T177 WeakPolarHBondContact OD1-CB 3.31Å; D175-T177 PolarHBondContact OD1-N 2.84Å; D175-T177 PolarHBondContact OD1-OG1 2.7Å; T177-F180 PolarHBondContact O-N 3.38Å; T177-H181 WeakPolarHBondContact O-CB 3.29Å; T177-H181 PolarHBondContact O-N 3.3Å
178	V	97.1	Very high	96	Very high	77 Å²	77	74.9 Å²	74.9	47%	0.467	38%	0.384	S	S	.	.	H	α-helix	trans	-66	-43.4	175.7	175.2	0	0	0	0	110.3	D175 F180 H181 N182	D175-V178 HydrophobicContact CB-CB 4.2Å; D175-V178 HydrophobicContact CB-CG2 3.96Å; D175-V178 PolarHBondContact O-N 3.12Å; D175-V178 VanDerWaalsContact O-N 3.16Å; V178-F180 PolarHBondContact O-N 3.06Å; V178-H181 PolarHBondContact O-N 2.88Å; V178-N182 VanDerWaalsContact O-CG 3.27Å; V178-N182 PolarHBondContact O-N 3.45Å; V178-N182 PolarHBondContact O-ND2 2.89Å
179	C	98.2	Very high	96.2	Very high	17 Å²	17	79.5 Å²	79.5	12%	0.115	40%	0.397	C	S	.	.	H	α-helix	trans	-55.9	-50.4	174.4	-79.3	0	0	0	0	112.4	F16 M165 P167 T174 D175 E176 H181 N182 A183	F16-C179 HydrophobicContact CE1-CB 3.9Å; F16-C179 HydrophobicContact CZ-CB 4.01Å; M165-C179 WeakPolarHBondContact O-CB 3.47Å; M165-C179 PolarHBondContact O-SG 2.96Å; P167-C179 HydrophobicContact CG-CB 4.42Å; T174-C179 WeakPolarHBondContact CG2-SG 3.42Å; D175-C179 PolarHBondContact O-N 2.88Å; D175-C179 VanDerWaalsContact O-N 3.1Å; E176-C179 WeakPolarHBondContact O-CB 3.29Å; E176-C179 PolarHBondContact O-N 2.77Å; C179-H181 PolarHBondContact O-N 3.47Å; C179-N182 PolarHBondContact O-N 3.45Å; C179-A183 PolarHBondContact O-N 2.9Å
180	F	98.5	Very high	96.4	Very high	10 Å²	10	71.7 Å²	71.7	4%	0.044	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-43	178.4	-175	-84.6	0	0	0	111.6	T11 F16 I21 I38 R40 E176 T177 V178 N182 A183 L184	T11-F180 HydrophobicContact CG2-CE2 4.32Å; T11-F180 HydrophobicContact CG2-CZ 4.14Å; F16-F180 HydrophobicContact CB-CD2 4.01Å; F16-F180 HydrophobicContact CB-CE2 4.29Å; F16-F180 HydrophobicContact CD1-CB 4.18Å; F16-F180 AromaticContact CD1-CD2 3.87Å; F16-F180 HydrophobicContact CD1-CD2 3.87Å; F16-F180 HydrophobicContact CE1-CB 4.07Å; F16-F180 AromaticContact CG-CD2 3.96Å; F16-F180 HydrophobicContact CG-CD2 3.96Å; I21-F180 HydrophobicContact CD1-CD1 4.23Å; I21-F180 HydrophobicContact CD1-CD2 3.32Å; I21-F180 HydrophobicContact CD1-CE1 4.05Å; I21-F180 HydrophobicContact CD1-CE2 3.14Å; I21-F180 HydrophobicContact CD1-CG 3.9Å; I21-F180 HydrophobicContact CD1-CZ 3.53Å; I21-F180 HydrophobicContact CG1-CE2 4.3Å; I38-F180 HydrophobicContact CD1-CE1 3.94Å; I38-F180 HydrophobicContact CG2-CE1 3.91Å; I38-F180 HydrophobicContact CG2-CZ 4.05Å; R40-F180 VanDerWaalsContact CD-CD2 3.42Å; R40-F180 HydrophobicContact CG-CE2 4.45Å; R40-F180 HydrophobicContact CG-CZ 4.49Å; R40-F180 VanDerWaalsContact NE-CE2 3.27Å; E176-F180 WeakPolarHBondContact O-CB 3.45Å; E176-F180 PolarHBondContact O-N 2.77Å; T177-F180 PolarHBondContact O-N 3.38Å; V178-F180 PolarHBondContact O-N 3.06Å; F180-N182 VanDerWaalsContact C-N 3.33Å; F180-N182 PolarHBondContact O-N 3.01Å; F180-A183 PolarHBondContact O-N 2.89Å; F180-L184 WeakPolarHBondContact O-CB 3.3Å; F180-L184 PolarHBondContact O-N 3.38Å
181	H	98.3	Very high	96.6	Very high	98 Å²	98	66.9 Å²	66.9	45%	0.454	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-40.5	177.7	-172.7	70.3	0	0	0	112.4	T177 V178 C179 L184 Q185	T177-H181 WeakPolarHBondContact O-CB 3.29Å; T177-H181 PolarHBondContact O-N 3.3Å; V178-H181 PolarHBondContact O-N 2.88Å; C179-H181 PolarHBondContact O-N 3.47Å; H181-L184 WeakPolarHBondContact O-CB 3.24Å; H181-L184 PolarHBondContact O-N 2.94Å; H181-Q185 PolarHBondContact CD2-NE2 3.02Å; H181-Q185 PolarHBondContact NE2-NE2 2.79Å; H181-Q185 WeakPolarHBondContact O-CG 3.47Å; H181-Q185 PolarHBondContact O-N 3.49Å
182	N	98.6	Very high	97	Very high	72 Å²	72	62.5 Å²	62.5	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-40.3	175.7	-68.7	-25.1	0	0	0	111.9	M165 V178 C179 F180 Q185 L186	M165-N182 HydrophobicContact SD-CB 4.46Å; V178-N182 VanDerWaalsContact O-CG 3.27Å; V178-N182 PolarHBondContact O-N 3.45Å; V178-N182 PolarHBondContact O-ND2 2.89Å; C179-N182 PolarHBondContact O-N 3.45Å; F180-N182 VanDerWaalsContact C-N 3.33Å; F180-N182 PolarHBondContact O-N 3.01Å; N182-Q185 PolarHBondContact O-N 3.14Å; N182-L186 PolarHBondContact O-N 3.32Å; N182-L186 VanDerWaalsContact O-N 3.08Å
183	A	98.8	Very high	97.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-41.7	174.1	0	0	0	0	0	111.9	F16 I21 V162 M165 C179 F180 L186 V187	F16-A183 HydrophobicContact CD2-CB 4.21Å; F16-A183 HydrophobicContact CE2-CB 3.53Å; F16-A183 HydrophobicContact CZ-CB 4.06Å; I21-A183 HydrophobicContact CD1-CB 4.08Å; I21-A183 HydrophobicContact CG1-CB 4.47Å; I21-A183 HydrophobicContact CG2-CB 4.44Å; V162-A183 HydrophobicContact CG1-CB 4.22Å; M165-A183 HydrophobicContact CB-CB 4.27Å; M165-A183 VanDerWaalsContact SD-CA 3.5Å; M165-A183 HydrophobicContact SD-CB 3.97Å; C179-A183 PolarHBondContact O-N 2.9Å; F180-A183 PolarHBondContact O-N 2.89Å; A183-L186 WeakPolarHBondContact O-CB 3.38Å; A183-L186 PolarHBondContact O-N 3.32Å; A183-V187 WeakPolarHBondContact O-CG2 3.49Å; A183-V187 PolarHBondContact O-N 3.39Å
184	L	98.8	Very high	97.9	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-47.5	175.8	-172.8	71.2	0	0	0	111.8	I21 C24 A25 K28 I38 F180 H181 L186 V187 D188	I21-L184 HydrophobicContact CG2-CB 4.34Å; I21-L184 HydrophobicContact CG2-CD1 4.15Å; I21-L184 WeakPolarHBondContact O-CD1 3.47Å; C24-L184 HydrophobicContact CB-CD1 3.89Å; A25-L184 HydrophobicContact CB-CD1 3.9Å; K28-L184 HydrophobicContact CD-CD2 4.27Å; I38-L184 HydrophobicContact CD1-CD1 4.41Å; I38-L184 HydrophobicContact CD1-CD2 3.68Å; F180-L184 WeakPolarHBondContact O-CB 3.3Å; F180-L184 PolarHBondContact O-N 3.38Å; H181-L184 WeakPolarHBondContact O-CB 3.24Å; H181-L184 PolarHBondContact O-N 2.94Å; L184-L186 VanDerWaalsContact C-N 3.3Å; L184-L186 PolarHBondContact O-N 2.88Å; L184-V187 PolarHBondContact O-N 3.39Å; L184-D188 WeakPolarHBondContact O-CB 3.43Å; L184-D188 PolarHBondContact O-N 2.88Å
185	Q	98.7	Very high	98.1	Very high	107 Å²	107	49.6 Å²	49.6	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-40.5	175.9	-71	-178.9	-0	0	0	112.2	H181 N182 K189	H181-Q185 PolarHBondContact CD2-NE2 3.02Å; H181-Q185 PolarHBondContact NE2-NE2 2.79Å; H181-Q185 WeakPolarHBondContact O-CG 3.47Å; H181-Q185 PolarHBondContact O-N 3.49Å; N182-Q185 PolarHBondContact O-N 3.14Å; Q185-K189 VanDerWaalsContact O-CB 3.28Å; Q185-K189 WeakPolarHBondContact O-CB 3.19Å; Q185-K189 PolarHBondContact O-N 3.4Å
186	L	98.8	Very high	98.3	Very high	27 Å²	27	49.2 Å²	49.2	14%	0.141	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-51.6	178	171.9	67.8	0	0	0	111.4	L158 R161 V162 M165 N182 A183 L184 K189 E190	L158-L186 HydrophobicContact CD1-CD2 4.18Å; L158-L186 HydrophobicContact CD1-CG 4.16Å; R161-L186 HydrophobicContact CB-CD2 3.77Å; R161-L186 VanDerWaalsContact CZ-CD1 3.5Å; V162-L186 HydrophobicContact CG2-CD2 4.35Å; M165-L186 HydrophobicContact CE-CB 4.12Å; M165-L186 HydrophobicContact CE-CD2 3.77Å; M165-L186 HydrophobicContact CE-CG 4.41Å; M165-L186 HydrophobicContact SD-CB 4.28Å; M165-L186 HydrophobicContact SD-CD2 3.89Å; N182-L186 PolarHBondContact O-N 3.32Å; N182-L186 VanDerWaalsContact O-N 3.08Å; A183-L186 WeakPolarHBondContact O-CB 3.38Å; A183-L186 PolarHBondContact O-N 3.32Å; L184-L186 VanDerWaalsContact C-N 3.3Å; L184-L186 PolarHBondContact O-N 2.88Å; L186-K189 PolarHBondContact O-N 3.39Å; L186-E190 PolarHBondContact O-N 3.41Å
187	V	98.9	Very high	98.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67	-43.7	-176.6	170.8	0	0	0	0	111	I21 L22 A25 L158 V162 A183 L184 K189 E190 F191	I21-V187 HydrophobicContact CB-CG2 4.27Å; I21-V187 HydrophobicContact CG2-CB 3.71Å; I21-V187 HydrophobicContact CG2-CG1 4.15Å; I21-V187 HydrophobicContact CG2-CG2 3.54Å; L22-V187 HydrophobicContact CB-CG1 3.69Å; L22-V187 HydrophobicContact CD1-CG1 3.69Å; L22-V187 HydrophobicContact CG-CG1 4.26Å; A25-V187 HydrophobicContact CB-CG1 4.34Å; L158-V187 HydrophobicContact CD1-CG2 4.02Å; L158-V187 HydrophobicContact CD2-CG1 4.4Å; L158-V187 HydrophobicContact CD2-CG2 4.21Å; L158-V187 HydrophobicContact CG-CG2 4.23Å; V162-V187 HydrophobicContact CG2-CG2 3.5Å; V162-V187 VanDerWaalsContact CG2-CG2 3.5Å; A183-V187 WeakPolarHBondContact O-CG2 3.49Å; A183-V187 PolarHBondContact O-N 3.39Å; L184-V187 PolarHBondContact O-N 3.39Å; V187-K189 VanDerWaalsContact C-N 3.31Å; V187-K189 PolarHBondContact O-N 3.01Å; V187-E190 PolarHBondContact O-N 3.04Å; V187-F191 WeakPolarHBondContact O-CB 3.14Å; V187-F191 PolarHBondContact O-N 3.23Å
188	D	98.8	Very high	98.6	Very high	53 Å²	53	47 Å²	47	28%	0.283	23%	0.234	S	C	.	.	H	α-helix	trans	-56.9	-46	174.8	179.1	52.6	0	0	0	111.6	A25 H29 L184 E190 F191 T192	A25-D188 HydrophobicContact CB-CB 4.07Å; H29-D188 IonicContact CD2-OD1 3.76Å; H29-D188 IonicContact CE1-OD1 3.23Å; H29-D188 PolarHBondContact CE1-OD1 3.39Å; H29-D188 IonicContact NE2-OD1 3.3Å; H29-D188 PolarHBondContact NE2-OD1 2.94Å; L184-D188 WeakPolarHBondContact O-CB 3.43Å; L184-D188 PolarHBondContact O-N 2.88Å; D188-E190 PolarHBondContact O-N 3.5Å; D188-F191 PolarHBondContact O-N 2.95Å; D188-T192 WeakPolarHBondContact O-CB 3.19Å; D188-T192 WeakPolarHBondContact O-CG2 3.32Å; D188-T192 PolarHBondContact O-N 3.17Å; D188-T192 PolarHBondContact O-OG1 2.79Å
189	K	98.8	Very high	98.6	Very high	135 Å²	135	43.6 Å²	43.6	59%	0.587	21%	0.214	S	C	*	.	H	α-helix	trans	-65.7	-41	179	-175.9	57.5	-178.9	170	0	112.4	Q185 L186 V187 T192 T193	Q185-K189 VanDerWaalsContact O-CB 3.28Å; Q185-K189 WeakPolarHBondContact O-CB 3.19Å; Q185-K189 PolarHBondContact O-N 3.4Å; L186-K189 PolarHBondContact O-N 3.39Å; V187-K189 VanDerWaalsContact C-N 3.31Å; V187-K189 PolarHBondContact O-N 3.01Å; K189-T192 PolarHBondContact O-OG1 2.64Å; K189-T193 WeakPolarHBondContact O-CB 3.31Å; K189-T193 PolarHBondContact O-N 3.19Å; K189-T193 PolarHBondContact O-OG1 3.21Å
190	E	98.8	Very high	98.6	Very high	63 Å²	63	47.8 Å²	47.8	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-63	-50	177.1	-166	75.4	-141.9	0	0	110.4	F132 L158 R161 L186 V187 D188 T193 L194	F132-E190 HydrophobicContact CE2-CG 4.06Å; F132-E190 HydrophobicContact CZ-CG 4.33Å; L158-E190 HydrophobicContact CD1-CB 4.22Å; L158-E190 HydrophobicContact CD1-CG 4.26Å; L158-E190 HydrophobicContact CD2-CB 4.42Å; L158-E190 HydrophobicContact CD2-CG 4.27Å; R161-E190 IonicContact CZ-OE2 3.47Å; R161-E190 IonicContact NH1-OE2 3.79Å; R161-E190 PolarHBondContact NH1-OE2 3.23Å; R161-E190 IonicContact NH2-OE2 3.73Å; L186-E190 PolarHBondContact O-N 3.41Å; V187-E190 PolarHBondContact O-N 3.04Å; D188-E190 PolarHBondContact O-N 3.5Å; E190-T193 PolarHBondContact O-N 3.27Å; E190-L194 WeakPolarHBondContact O-CG 3.21Å; E190-L194 PolarHBondContact O-N 3.26Å
191	F	98.8	Very high	98.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-54	179.5	178.2	-112.9	0	0	0	112	L22 M26 I105 L106 I109 M128 F132 I133 V187 D188 T193 L194 V195	L22-F191 HydrophobicContact CD1-CB 4.04Å; L22-F191 HydrophobicContact CD1-CD2 4.07Å; L22-F191 HydrophobicContact CD1-CG 4.05Å; M26-F191 HydrophobicContact CG-CD1 4.28Å; M26-F191 HydrophobicContact CG-CE1 3.83Å; M26-F191 HydrophobicContact CG-CE2 4.31Å; M26-F191 HydrophobicContact CG-CZ 3.84Å; M26-F191 HydrophobicContact SD-CE2 4.17Å; M26-F191 HydrophobicContact SD-CZ 4.02Å; I105-F191 HydrophobicContact CG2-CE1 3.86Å; I105-F191 HydrophobicContact CG2-CZ 4.09Å; L106-F191 HydrophobicContact CD2-CZ 4.49Å; I109-F191 HydrophobicContact CD1-CD1 4.11Å; I109-F191 HydrophobicContact CD1-CE1 3.52Å; I109-F191 HydrophobicContact CD1-CZ 4.43Å; M128-F191 HydrophobicContact CE-CD2 3.47Å; M128-F191 VanDerWaalsContact CE-CD2 3.47Å; M128-F191 HydrophobicContact CE-CE2 3.39Å; M128-F191 HydrophobicContact CE-CZ 4.41Å; F132-F191 AromaticContact CD1-CD2 3.84Å; F132-F191 HydrophobicContact CD1-CD2 3.84Å; F132-F191 HydrophobicContact CE1-CB 4.03Å; F132-F191 AromaticContact CE1-CD2 3.61Å; F132-F191 HydrophobicContact CE1-CD2 3.61Å; F132-F191 HydrophobicContact CE1-CG 4.3Å; F132-F191 HydrophobicContact CZ-CB 4.42Å; I133-F191 HydrophobicContact CD1-CE2 4.25Å; V187-F191 WeakPolarHBondContact O-CB 3.14Å; V187-F191 PolarHBondContact O-N 3.23Å; D188-F191 PolarHBondContact O-N 2.95Å; F191-T193 VanDerWaalsContact C-N 3.31Å; F191-T193 PolarHBondContact O-N 3.33Å; F191-L194 PolarHBondContact O-N 3.01Å; F191-L194 VanDerWaalsContact O-N 3.14Å; F191-V195 HydrophobicContact CD1-CG2 4.46Å; F191-V195 HydrophobicContact CD2-CG2 4.46Å; F191-V195 HydrophobicContact CE1-CG2 4.16Å; F191-V195 HydrophobicContact CE2-CG2 4.18Å; F191-V195 HydrophobicContact CZ-CG2 4.01Å; F191-V195 WeakPolarHBondContact O-CG2 3.28Å; F191-V195 PolarHBondContact O-N 3.21Å
192	T	98.7	Very high	98.5	Very high	21 Å²	21	46.7 Å²	46.7	13%	0.129	23%	0.234	C	C	.	.	H	α-helix	trans	-63	-36.3	-179.4	52.7	0	0	0	0	112.5	H29 I109 D188 K189 L194 V195 H196	H29-T192 VanDerWaalsContact CE1-CG2 3.5Å; H29-T192 WeakPolarHBondContact CE1-CG2 3.4Å; H29-T192 WeakPolarHBondContact NE2-CG2 3.34Å; I109-T192 HydrophobicContact CD1-CG2 4.33Å; D188-T192 WeakPolarHBondContact O-CB 3.19Å; D188-T192 WeakPolarHBondContact O-CG2 3.32Å; D188-T192 PolarHBondContact O-N 3.17Å; D188-T192 PolarHBondContact O-OG1 2.79Å; K189-T192 PolarHBondContact O-OG1 2.64Å; T192-L194 VanDerWaalsContact C-N 3.34Å; T192-L194 PolarHBondContact O-N 3.43Å; T192-V195 PolarHBondContact O-N 2.79Å; T192-H196 PolarHBondContact O-CD2 3.08Å; T192-H196 VanDerWaalsContact O-CD2 3.23Å; T192-H196 PolarHBondContact O-N 2.95Å
193	T	98.7	Very high	98.4	Very high	66 Å²	66	46.6 Å²	46.6	41%	0.405	23%	0.229	S	C	.	.	H	α-helix	trans	-63.4	-40.8	175.4	-60.5	0	0	0	0	111.3	K189 E190 F191 F197	K189-T193 WeakPolarHBondContact O-CB 3.31Å; K189-T193 PolarHBondContact O-N 3.19Å; K189-T193 PolarHBondContact O-OG1 3.21Å; E190-T193 PolarHBondContact O-N 3.27Å; F191-T193 VanDerWaalsContact C-N 3.31Å; F191-T193 PolarHBondContact O-N 3.33Å; T193-F197 VanDerWaalsContact O-CB 3.3Å; T193-F197 WeakPolarHBondContact O-CB 3.42Å; T193-F197 PolarHBondContact O-N 2.77Å
194	L	98.6	Very high	98.3	Very high	34 Å²	34	49.7 Å²	49.7	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-69.2	-40.9	175.9	-71.7	174.2	0	0	0	112.3	M128 F132 E190 F191 T192 H196 F197 Y198	M128-L194 HydrophobicContact CE-CB 4.07Å; M128-L194 HydrophobicContact SD-CB 4.04Å; F132-L194 HydrophobicContact CB-CD1 4.14Å; F132-L194 HydrophobicContact CD1-CD1 4.43Å; F132-L194 HydrophobicContact CD2-CD1 3.29Å; F132-L194 HydrophobicContact CE2-CD1 3.68Å; F132-L194 HydrophobicContact CG-CD1 3.7Å; F132-L194 HydrophobicContact CZ-CD1 4.39Å; E190-L194 WeakPolarHBondContact O-CG 3.21Å; E190-L194 PolarHBondContact O-N 3.26Å; F191-L194 PolarHBondContact O-N 3.01Å; F191-L194 VanDerWaalsContact O-N 3.14Å; T192-L194 VanDerWaalsContact C-N 3.34Å; T192-L194 PolarHBondContact O-N 3.43Å; L194-H196 PolarHBondContact O-N 2.99Å; L194-F197 PolarHBondContact O-N 3.11Å; L194-Y198 HydrophobicContact CB-CD2 4.45Å; L194-Y198 HydrophobicContact CB-CE2 4.29Å; L194-Y198 HydrophobicContact CD2-CE2 4.36Å; L194-Y198 WeakPolarHBondContact O-CD2 3.4Å; L194-Y198 PolarHBondContact O-N 3.41Å
195	V	98.8	Very high	98.2	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.1	-51.8	174.4	172.6	0	0	0	0	110.5	L106 I109 L110 M128 F191 T192 Y198 A199	L106-V195 HydrophobicContact CD2-CB 4.3Å; L106-V195 HydrophobicContact CD2-CG1 3.82Å; L106-V195 HydrophobicContact CD2-CG2 3.48Å; L106-V195 VanDerWaalsContact CD2-CG2 3.48Å; I109-V195 HydrophobicContact CB-CG1 4.34Å; I109-V195 HydrophobicContact CD1-CG2 4.35Å; I109-V195 HydrophobicContact CG2-CB 4.32Å; I109-V195 HydrophobicContact CG2-CG1 3.72Å; L110-V195 HydrophobicContact CD1-CG1 4.42Å; L110-V195 HydrophobicContact CD2-CG1 3.99Å; L110-V195 HydrophobicContact CG-CG1 4.13Å; M128-V195 HydrophobicContact CE-CG2 3.77Å; M128-V195 HydrophobicContact CG-CG2 4.38Å; M128-V195 HydrophobicContact SD-CG2 4.05Å; F191-V195 HydrophobicContact CD1-CG2 4.46Å; F191-V195 HydrophobicContact CD2-CG2 4.46Å; F191-V195 HydrophobicContact CE1-CG2 4.16Å; F191-V195 HydrophobicContact CE2-CG2 4.18Å; F191-V195 HydrophobicContact CZ-CG2 4.01Å; F191-V195 WeakPolarHBondContact O-CG2 3.28Å; F191-V195 PolarHBondContact O-N 3.21Å; T192-V195 PolarHBondContact O-N 2.79Å; V195-Y198 PolarHBondContact O-N 2.95Å; V195-A199 VanDerWaalsContact O-CB 3.3Å; V195-A199 WeakPolarHBondContact O-CB 3.16Å; V195-A199 PolarHBondContact O-N 3.49Å
196	H	98.6	Very high	98.1	Very high	77 Å²	77	48 Å²	48	36%	0.356	24%	0.237	S	C	.	.	H	α-helix	trans	-65.4	-40.3	177.6	-79.2	-65.9	0	0	0	113	T192 L194 Y198 A199 D200	T192-H196 PolarHBondContact O-CD2 3.08Å; T192-H196 VanDerWaalsContact O-CD2 3.23Å; T192-H196 PolarHBondContact O-N 2.95Å; L194-H196 PolarHBondContact O-N 2.99Å; H196-Y198 VanDerWaalsContact C-N 3.31Å; H196-Y198 PolarHBondContact O-N 2.83Å; H196-A199 PolarHBondContact O-N 3.05Å; H196-D200 IonicContact CG-OD2 3.2Å; H196-D200 IonicContact ND1-OD2 3.76Å; H196-D200 PolarHBondContact ND1-OD2 3.15Å; H196-D200 VanDerWaalsContact O-CB 3.24Å; H196-D200 WeakPolarHBondContact O-CB 3.49Å; H196-D200 PolarHBondContact O-N 3.5Å
197	F	98.3	Very high	98	Very high	88 Å²	88	53.1 Å²	53.1	39%	0.386	26%	0.261	S	S	.	.	I	π-helix	trans	-57.9	-46.6	174.7	170.6	-102.9	0	0	0	111.3	T193 L194 T201 W202	T193-F197 VanDerWaalsContact O-CB 3.3Å; T193-F197 WeakPolarHBondContact O-CB 3.42Å; T193-F197 PolarHBondContact O-N 2.77Å; L194-F197 PolarHBondContact O-N 3.11Å; F197-T201 HydrophobicContact CD2-CG2 4.26Å; F197-T201 HydrophobicContact CE2-CG2 3.86Å; F197-T201 WeakPolarHBondContact O-CA 3.46Å; F197-T201 VanDerWaalsContact O-CB 3.23Å; F197-T201 WeakPolarHBondContact O-CB 3.33Å; F197-T201 PolarHBondContact O-N 2.92Å; F197-W202 PolarHBondContact O-N 3.47Å
198	Y	98.4	Very high	97.9	Very high	26 Å²	26	55.7 Å²	55.7	10%	0.102	27%	0.273	C	S	.	.	I	π-helix	trans	-71	-35.5	-179.3	-68.1	-55.2	0	0	0	112.5	L124 K127 M128 S131 L194 V195 H196 W202 Y203	L124-Y198 VanDerWaalsContact CD2-C 3.5Å; K127-Y198 HydrophobicContact CD-CD1 4.33Å; K127-Y198 HydrophobicContact CD-CE1 4.13Å; K127-Y198 VanDerWaalsContact CE-CZ 3.49Å; K127-Y198 HydrophobicContact CG-CD1 3.73Å; K127-Y198 HydrophobicContact CG-CD2 4.07Å; K127-Y198 HydrophobicContact CG-CE1 3.95Å; K127-Y198 HydrophobicContact CG-CE2 4.22Å; K127-Y198 HydrophobicContact CG-CG 3.82Å; M128-Y198 HydrophobicContact CG-CD2 4.39Å; M128-Y198 HydrophobicContact SD-CD2 3.47Å; M128-Y198 WeakPolarHBondContact SD-CD2 3.37Å; M128-Y198 HydrophobicContact SD-CE2 3.81Å; S131-Y198 WeakPolarHBondContact CB-OH 3.35Å; S131-Y198 VanDerWaalsContact OG-CE2 3.22Å; S131-Y198 WeakPolarHBondContact OG-CE2 3.5Å; S131-Y198 VanDerWaalsContact OG-CZ 3.29Å; S131-Y198 PolarHBondContact OG-OH 2.92Å; L194-Y198 HydrophobicContact CB-CD2 4.45Å; L194-Y198 HydrophobicContact CB-CE2 4.29Å; L194-Y198 HydrophobicContact CD2-CE2 4.36Å; L194-Y198 WeakPolarHBondContact O-CD2 3.4Å; L194-Y198 PolarHBondContact O-N 3.41Å; V195-Y198 PolarHBondContact O-N 2.95Å; H196-Y198 VanDerWaalsContact C-N 3.31Å; H196-Y198 PolarHBondContact O-N 2.83Å; Y198-W202 HydrophobicContact CD1-CB 3.69Å; Y198-W202 HydrophobicContact CD1-CD2 4.12Å; Y198-W202 HydrophobicContact CD1-CE3 4.41Å; Y198-W202 AromaticContact CD1-CG 3.81Å; Y198-W202 HydrophobicContact CD1-CG 3.81Å; Y198-W202 HydrophobicContact CE1-CG 4.48Å; Y198-Y203 VanDerWaalsContact O-CB 3.31Å; Y198-Y203 WeakPolarHBondContact O-CB 3.03Å; Y198-Y203 PolarHBondContact O-N 2.93Å
199	A	98.3	Very high	97.8	Very high	5 Å²	5	53.1 Å²	53.1	4%	0.041	26%	0.26	C	S	.	.	I	π-helix	trans	-70.9	-49.6	178.3	0	0	0	0	0	113.1	L110 L120 L124 V195 H196 P204	L110-A199 HydrophobicContact CD1-CB 4.2Å; L110-A199 HydrophobicContact CD2-CB 3.54Å; L120-A199 HydrophobicContact CD1-CB 4.46Å; L124-A199 HydrophobicContact CD1-CB 3.73Å; V195-A199 VanDerWaalsContact O-CB 3.3Å; V195-A199 WeakPolarHBondContact O-CB 3.16Å; V195-A199 PolarHBondContact O-N 3.49Å; H196-A199 PolarHBondContact O-N 3.05Å; A199-P204 VanDerWaalsContact O-CD 3.29Å; A199-P204 WeakPolarHBondContact O-CD 3.05Å
200	D	97.6	Very high	97.6	Very high	105 Å²	105	49.4 Å²	49.4	56%	0.561	25%	0.246	S	C	*	.	I	π-helix	trans	-94.1	-21	-166.5	-56	-38.1	0	0	0	112.3	H196	H196-D200 IonicContact CG-OD2 3.2Å; H196-D200 IonicContact ND1-OD2 3.76Å; H196-D200 PolarHBondContact ND1-OD2 3.15Å; H196-D200 VanDerWaalsContact O-CB 3.24Å; H196-D200 WeakPolarHBondContact O-CB 3.49Å; H196-D200 PolarHBondContact O-N 3.5Å
201	T	96.7	Very high	97.5	Very high	67 Å²	67	49.1 Å²	49.1	41%	0.411	25%	0.247	S	C	.	.	I	π-helix	trans	-119.6	-51.7	-176	-54.4	0	0	0	0	113.1	F197 P234	F197-T201 HydrophobicContact CD2-CG2 4.26Å; F197-T201 HydrophobicContact CE2-CG2 3.86Å; F197-T201 WeakPolarHBondContact O-CA 3.46Å; F197-T201 VanDerWaalsContact O-CB 3.23Å; F197-T201 WeakPolarHBondContact O-CB 3.33Å; F197-T201 PolarHBondContact O-N 2.92Å; T201-P234 HydrophobicContact CG2-CG 4.25Å
202	W	97.3	Very high	97.4	Very high	17 Å²	17	49.4 Å²	49.4	6%	0.064	25%	0.249	C	C	.	.	I	π-helix	trans	-73.5	-49.7	-176.3	175.2	82.7	0	0	0	112.4	L124 K127 F197 Y198 A205 P234 H238	L124-W202 HydrophobicContact CD2-CE3 4.48Å; K127-W202 HydrophobicContact CB-CH2 4.18Å; K127-W202 HydrophobicContact CB-CZ3 4.13Å; K127-W202 HydrophobicContact CD-CH2 4.27Å; K127-W202 HydrophobicContact CD-CZ2 4.05Å; K127-W202 HydrophobicContact CG-CD2 4.42Å; K127-W202 HydrophobicContact CG-CE3 4.22Å; K127-W202 HydrophobicContact CG-CH2 4.18Å; K127-W202 HydrophobicContact CG-CZ2 4.37Å; K127-W202 HydrophobicContact CG-CZ3 4.09Å; F197-W202 PolarHBondContact O-N 3.47Å; Y198-W202 HydrophobicContact CD1-CB 3.69Å; Y198-W202 HydrophobicContact CD1-CD2 4.12Å; Y198-W202 HydrophobicContact CD1-CE3 4.41Å; Y198-W202 AromaticContact CD1-CG 3.81Å; Y198-W202 HydrophobicContact CD1-CG 3.81Å; Y198-W202 HydrophobicContact CE1-CG 4.48Å; W202-A205 VanDerWaalsContact O-CB 3.3Å; W202-A205 WeakPolarHBondContact O-CB 3.48Å; W202-A205 PolarHBondContact O-N 3.3Å; W202-P234 HydrophobicContact CB-CG 4.46Å; W202-H238 AromaticContact CD1-NE2 3.67Å; W202-H238 AromaticContact CD2-CE1 3.85Å; W202-H238 AromaticContact CD2-NE2 3.69Å; W202-H238 AromaticContact CE2-CE1 3.34Å; W202-H238 AromaticContact CE2-NE2 3.43Å; W202-H238 AromaticContact CG-NE2 3.84Å; W202-H238 AromaticContact CH2-CE1 3.84Å; W202-H238 AromaticContact CZ2-CE1 3.35Å; W202-H238 WeakPolarHBondContact CZ2-CE1 3.4Å; W202-H238 AromaticContact CZ2-NE2 3.95Å; W202-H238 AromaticContact NE1-CE1 3.71Å; W202-H238 AromaticContact NE1-NE2 3.41Å; W202-H238 PolarHBondContact NE1-NE2 2.88Å; W202-H238 PolarHBondContact O-NE2 3.23Å
203	Y	97.6	Very high	97.2	Very high	70 Å²	70	48.4 Å²	48.4	28%	0.275	24%	0.243	S	C	.	.	H	α-helix	trans	-62.8	-45.7	-173.7	-174.5	-101.3	0	0	0	113.2	L120 A123 Y198 A205 R206	L120-Y203 HydrophobicContact CB-CD1 4.42Å; L120-Y203 HydrophobicContact CB-CE1 4.04Å; L120-Y203 HydrophobicContact CD1-CD1 3.37Å; L120-Y203 HydrophobicContact CD1-CD2 3.93Å; L120-Y203 HydrophobicContact CD1-CE1 3.85Å; L120-Y203 HydrophobicContact CD1-CE2 4.38Å; L120-Y203 HydrophobicContact CD1-CG 3.38Å; L120-Y203 HydrophobicContact CG-CD1 4.42Å; A123-Y203 HydrophobicContact CB-CD2 3.79Å; A123-Y203 HydrophobicContact CB-CE2 3.46Å; A123-Y203 VanDerWaalsContact CB-CE2 3.46Å; Y198-Y203 VanDerWaalsContact O-CB 3.31Å; Y198-Y203 WeakPolarHBondContact O-CB 3.03Å; Y198-Y203 PolarHBondContact O-N 2.93Å; Y203-A205 PolarHBondContact O-N 3.47Å; Y203-R206 WeakPolarHBondContact O-CB 3.14Å; Y203-R206 PolarHBondContact O-N 3.15Å; Y203-R206 VanDerWaalsContact O-N 3.08Å
204	P	96.5	Very high	97	Very high	65 Å²	65	51.4 Å²	51.4	42%	0.422	25%	0.25	S	S	.	.	H	α-helix	trans	-64	-26.6	178.1	-23	36	0	0	0	113.2	A199 R206 E207	A199-P204 VanDerWaalsContact O-CD 3.29Å; A199-P204 WeakPolarHBondContact O-CD 3.05Å; P204-R206 PolarHBondContact O-N 2.97Å; P204-R206 VanDerWaalsContact O-N 3.17Å; P204-E207 PolarHBondContact O-N 3.3Å
205	A	97.3	Very high	96.8	Very high	2 Å²	2	54 Å²	54	2%	0.017	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-24.9	176.7	0	0	0	0	0	112.4	W202 Y203 E207 I208 V209 C233 P234	W202-A205 VanDerWaalsContact O-CB 3.3Å; W202-A205 WeakPolarHBondContact O-CB 3.48Å; W202-A205 PolarHBondContact O-N 3.3Å; Y203-A205 PolarHBondContact O-N 3.47Å; A205-E207 VanDerWaalsContact C-N 3.34Å; A205-E207 PolarHBondContact O-N 2.84Å; A205-I208 WeakPolarHBondContact O-CB 3.11Å; A205-I208 PolarHBondContact O-N 3.47Å; A205-V209 WeakPolarHBondContact O-CG2 3.24Å; A205-V209 PolarHBondContact O-N 3.4Å; A205-C233 HydrophobicContact CB-CB 3.92Å; A205-P234 HydrophobicContact CB-CG 3.77Å
206	R	95.9	Very high	96.6	Very high	87 Å²	87	56.7 Å²	56.7	33%	0.328	27%	0.274	S	S	.	.	H	α-helix	trans	-55	-48	179.7	-174.4	167.7	-172.3	73.1	-4.8	112.9	Y203 P204 I208 V209 L210 H238 E241	Y203-R206 WeakPolarHBondContact O-CB 3.14Å; Y203-R206 PolarHBondContact O-N 3.15Å; Y203-R206 VanDerWaalsContact O-N 3.08Å; P204-R206 PolarHBondContact O-N 2.97Å; P204-R206 VanDerWaalsContact O-N 3.17Å; R206-I208 VanDerWaalsContact C-N 3.33Å; R206-V209 PolarHBondContact O-N 2.79Å; R206-L210 WeakPolarHBondContact O-CB 3.27Å; R206-L210 PolarHBondContact O-N 2.89Å; R206-H238 PolarHBondContact NH1-ND1 3.25Å; R206-H238 VanDerWaalsContact NH1-ND1 3.19Å; R206-E241 IonicContact CZ-OE2 3.92Å; R206-E241 IonicContact NH1-OE2 2.68Å; R206-E241 PolarHBondContact NH1-OE2 2.75Å; R206-E241 IonicContact NH2-OE2 3.43Å
207	E	95.8	Very high	96.4	Very high	135 Å²	135	58.1 Å²	58.1	63%	0.631	28%	0.277	S	S	*	.	H	α-helix	trans	-65.6	-40.4	-178	-175.4	175	179.5	0	0	111.1	P204 A205 V209 L210 N211	P204-E207 PolarHBondContact O-N 3.3Å; A205-E207 VanDerWaalsContact C-N 3.34Å; A205-E207 PolarHBondContact O-N 2.84Å; E207-V209 VanDerWaalsContact C-N 3.32Å; E207-V209 PolarHBondContact O-N 3.21Å; E207-L210 PolarHBondContact O-N 3.21Å; E207-N211 WeakPolarHBondContact O-CB 3.24Å; E207-N211 VanDerWaalsContact O-CG 3.3Å; E207-N211 PolarHBondContact O-N 2.77Å; E207-N211 PolarHBondContact O-ND2 3.46Å
208	I	97.4	Very high	96.3	Very high	53 Å²	53	59.1 Å²	59.1	27%	0.272	30%	0.295	S	S	.	.	H	α-helix	trans	-57.6	-47.6	175.3	-59.7	175.2	0	0	0	110.1	A205 R206 N211 A212 I228 E229 C233	A205-I208 WeakPolarHBondContact O-CB 3.11Å; A205-I208 PolarHBondContact O-N 3.47Å; R206-I208 VanDerWaalsContact C-N 3.33Å; I208-N211 PolarHBondContact O-N 2.65Å; I208-A212 WeakPolarHBondContact O-CB 3.25Å; I208-A212 PolarHBondContact O-N 3.21Å; I208-I228 HydrophobicContact CG2-CG2 3.99Å; I208-E229 HydrophobicContact CG2-CB 4.23Å; I208-C233 HydrophobicContact CD1-CB 4.49Å
209	V	97	Very high	96.2	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.9	-40.8	-179.6	-177.5	0	0	0	0	111.7	A205 R206 E207 N211 A212 V213 I228 W235 H238 F239 I242	A205-V209 WeakPolarHBondContact O-CG2 3.24Å; A205-V209 PolarHBondContact O-N 3.4Å; R206-V209 PolarHBondContact O-N 2.79Å; E207-V209 VanDerWaalsContact C-N 3.32Å; E207-V209 PolarHBondContact O-N 3.21Å; V209-N211 VanDerWaalsContact C-N 3.32Å; V209-N211 PolarHBondContact O-N 3.48Å; V209-A212 WeakPolarHBondContact O-CB 3.33Å; V209-A212 PolarHBondContact O-N 2.83Å; V209-V213 HydrophobicContact CG1-CG2 4.44Å; V209-V213 WeakPolarHBondContact O-CG2 3.47Å; V209-V213 PolarHBondContact O-N 3.11Å; V209-I228 HydrophobicContact CG2-CD1 4.33Å; V209-W235 HydrophobicContact CG2-CB 3.54Å; V209-H238 HydrophobicContact CB-CB 4.05Å; V209-H238 HydrophobicContact CG1-CB 4.22Å; V209-H238 HydrophobicContact CG2-CB 4.02Å; V209-F239 HydrophobicContact CG1-CB 3.95Å; V209-I242 HydrophobicContact CB-CD1 4Å; V209-I242 HydrophobicContact CG1-CD1 3.82Å
210	L	95.6	Very high	96.1	Very high	56 Å²	56	59 Å²	59	29%	0.293	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-44.9	176.4	-179.3	61.6	0	0	0	111.4	R206 E207 V213 K214 I242	R206-L210 WeakPolarHBondContact O-CB 3.27Å; R206-L210 PolarHBondContact O-N 2.89Å; E207-L210 PolarHBondContact O-N 3.21Å; L210-V213 PolarHBondContact O-N 2.7Å; L210-K214 HydrophobicContact CD1-CD 4.46Å; L210-K214 HydrophobicContact CG-CD 4.28Å; L210-K214 WeakPolarHBondContact O-CB 3.5Å; L210-K214 WeakPolarHBondContact O-CG 3.24Å; L210-K214 PolarHBondContact O-N 2.92Å; L210-I242 HydrophobicContact CB-CD1 3.9Å; L210-I242 HydrophobicContact CD1-CD1 4.4Å; L210-I242 HydrophobicContact CD1-CG1 4.42Å; L210-I242 HydrophobicContact CD1-CG2 3.98Å
211	N	96.3	Very high	95.9	Very high	58 Å²	58	59.2 Å²	59.2	31%	0.31	31%	0.306	S	S	.	.	H	α-helix	trans	-66.5	-39.3	177	-70.5	-22.5	0	0	0	111.4	E207 I208 V209 V213 K214 N215	E207-N211 WeakPolarHBondContact O-CB 3.24Å; E207-N211 VanDerWaalsContact O-CG 3.3Å; E207-N211 PolarHBondContact O-N 2.77Å; E207-N211 PolarHBondContact O-ND2 3.46Å; I208-N211 PolarHBondContact O-N 2.65Å; V209-N211 VanDerWaalsContact C-N 3.32Å; V209-N211 PolarHBondContact O-N 3.48Å; N211-V213 PolarHBondContact O-N 3.43Å; N211-K214 PolarHBondContact O-N 2.92Å; N211-N215 VanDerWaalsContact O-CB 3.27Å; N211-N215 WeakPolarHBondContact O-CB 3.35Å; N211-N215 VanDerWaalsContact O-CG 3.32Å; N211-N215 PolarHBondContact O-N 3.36Å; N211-N215 PolarHBondContact O-ND2 3.06Å; N211-N215 VanDerWaalsContact O-ND2 3.12Å
212	A	96.6	Very high	95.7	Very high	5 Å²	5	57.6 Å²	57.6	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	-59.1	-45.9	175.1	0	0	0	0	0	112	I208 V209 N215 R216 I226 Y227 I228	I208-A212 WeakPolarHBondContact O-CB 3.25Å; I208-A212 PolarHBondContact O-N 3.21Å; V209-A212 WeakPolarHBondContact O-CB 3.33Å; V209-A212 PolarHBondContact O-N 2.83Å; A212-N215 PolarHBondContact O-N 2.77Å; A212-R216 PolarHBondContact O-N 2.85Å; A212-I226 HydrophobicContact CB-CB 4.18Å; A212-Y227 WeakPolarHBondContact CB-O 3.27Å; A212-I228 HydrophobicContact CB-CD1 3.78Å
213	V	94.9	Very high	95.5	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-66.8	-42.5	177.6	174.2	0	0	0	0	111.5	V209 L210 N211 N215 R216 I226 F239 I242 L246 L262	V209-V213 HydrophobicContact CG1-CG2 4.44Å; V209-V213 WeakPolarHBondContact O-CG2 3.47Å; V209-V213 PolarHBondContact O-N 3.11Å; L210-V213 PolarHBondContact O-N 2.7Å; N211-V213 PolarHBondContact O-N 3.43Å; V213-N215 PolarHBondContact O-N 3.32Å; V213-R216 VanDerWaalsContact O-CD 3.22Å; V213-R216 WeakPolarHBondContact O-CD 3.43Å; V213-R216 VanDerWaalsContact O-CG 3.26Å; V213-R216 WeakPolarHBondContact O-CG 3.41Å; V213-R216 PolarHBondContact O-NH1 3.04Å; V213-I226 HydrophobicContact CG2-CG2 4.4Å; V213-F239 HydrophobicContact CG2-CD2 4.19Å; V213-I242 HydrophobicContact CB-CG2 4.4Å; V213-I242 HydrophobicContact CG1-CG2 4.33Å; V213-I242 HydrophobicContact CG2-CG2 4.35Å; V213-L246 HydrophobicContact CG1-CD1 3.65Å; V213-L262 HydrophobicContact CG1-CD1 4.14Å; V213-L262 HydrophobicContact CG2-CD1 4.49Å
214	K	93.5	Very high	95.4	Very high	128 Å²	128	53.9 Å²	53.9	56%	0.557	28%	0.284	S	S	*	.	H	α-helix	trans	-63.2	-40.2	177.1	-75.7	175.3	178.3	175.3	0	112.4	L210 N211	L210-K214 HydrophobicContact CD1-CD 4.46Å; L210-K214 HydrophobicContact CG-CD 4.28Å; L210-K214 WeakPolarHBondContact O-CB 3.5Å; L210-K214 WeakPolarHBondContact O-CG 3.24Å; L210-K214 PolarHBondContact O-N 2.92Å; N211-K214 PolarHBondContact O-N 2.92Å
215	N	94.6	Very high	95.4	Very high	90 Å²	90	50.8 Å²	50.8	48%	0.481	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	5.8	-174.5	-66.1	-36	0	0	0	114.2	N211 A212 V213 Y217 S218 V219	N211-N215 VanDerWaalsContact O-CB 3.27Å; N211-N215 WeakPolarHBondContact O-CB 3.35Å; N211-N215 VanDerWaalsContact O-CG 3.32Å; N211-N215 PolarHBondContact O-N 3.36Å; N211-N215 PolarHBondContact O-ND2 3.06Å; N211-N215 VanDerWaalsContact O-ND2 3.12Å; A212-N215 PolarHBondContact O-N 2.77Å; V213-N215 PolarHBondContact O-N 3.32Å; N215-Y217 VanDerWaalsContact C-N 3.26Å; N215-Y217 PolarHBondContact O-N 2.89Å; N215-Y217 VanDerWaalsContact O-N 3.14Å; N215-S218 WeakPolarHBondContact O-CB 3.45Å; N215-S218 PolarHBondContact O-N 3.41Å; N215-V219 PolarHBondContact O-N 2.76Å
216	R	95.1	Very high	95.4	Very high	55 Å²	55	50.7 Å²	50.7	21%	0.208	26%	0.264	C	S	.	.	H	α-helix	trans	-51.4	-38.7	-175.2	68.7	-169	-175.5	-84.3	2.1	114.3	A212 V213 S218 V219 D220 G223 I226 L262	A212-R216 PolarHBondContact O-N 2.85Å; V213-R216 VanDerWaalsContact O-CD 3.22Å; V213-R216 WeakPolarHBondContact O-CD 3.43Å; V213-R216 VanDerWaalsContact O-CG 3.26Å; V213-R216 WeakPolarHBondContact O-CG 3.41Å; V213-R216 PolarHBondContact O-NH1 3.04Å; R216-S218 VanDerWaalsContact C-N 3.27Å; R216-S218 PolarHBondContact O-N 3.22Å; R216-V219 WeakPolarHBondContact O-CB 3.41Å; R216-V219 PolarHBondContact O-N 3.42Å; R216-D220 PolarHBondContact O-N 2.68Å; R216-D220 VanDerWaalsContact O-O 3.13Å; R216-G223 VanDerWaalsContact CD-O 3.25Å; R216-G223 WeakPolarHBondContact CD-O 3.47Å; R216-I226 HydrophobicContact CB-CG2 3.85Å; R216-L262 HydrophobicContact CB-CD2 4.49Å
217	Y	94.6	Very high	95.5	Very high	107 Å²	107	49.6 Å²	49.6	42%	0.42	26%	0.26	S	S	.	.	H	α-helix	trans	-69.3	-23.4	179.4	-62.7	-69.2	0	0	0	113.9	N215 D220 D260	N215-Y217 VanDerWaalsContact C-N 3.26Å; N215-Y217 PolarHBondContact O-N 2.89Å; N215-Y217 VanDerWaalsContact O-N 3.14Å; Y217-D220 WeakPolarHBondContact CA-O 3.36Å; Y217-D220 CarbonylContact O-C 3.58Å; Y217-D260 PolarHBondContact OH-OD2 3.49Å
218	S	95.9	Very high	95.6	Very high	109 Å²	109	43.1 Å²	43.1	76%	0.762	23%	0.23	S	C	*	.	H	α-helix	trans	-81.1	-19.7	172.1	-55.5	0	0	0	0	112.1	N215 R216	N215-S218 WeakPolarHBondContact O-CB 3.45Å; N215-S218 PolarHBondContact O-N 3.41Å; R216-S218 VanDerWaalsContact C-N 3.27Å; R216-S218 PolarHBondContact O-N 3.22Å
219	V	96.5	Very high	95.4	Very high	17 Å²	17	46.8 Å²	46.8	10%	0.103	25%	0.246	C	C	.	.	H	α-helix	trans	-81.1	-48.9	175.1	178.6	0	0	0	0	109.9	N215 R216 I225 I266 L333	N215-V219 PolarHBondContact O-N 2.76Å; R216-V219 WeakPolarHBondContact O-CB 3.41Å; R216-V219 PolarHBondContact O-N 3.42Å; V219-I225 HydrophobicContact CG1-CB 4.5Å; V219-I225 HydrophobicContact CG1-CG2 4.15Å; V219-I266 HydrophobicContact CG1-CD1 4.24Å; V219-L333 HydrophobicContact CG1-CD2 3.95Å
220	D	95.6	Very high	95.1	Very high	11 Å²	11	48.6 Å²	48.6	6%	0.059	26%	0.264	C	S	.	.			trans	-149	138.7	175	-172	74.8	0	0	0	110.6	R216 Y217 S222 G223 I225 R337	R216-D220 PolarHBondContact O-N 2.68Å; R216-D220 VanDerWaalsContact O-O 3.13Å; Y217-D220 WeakPolarHBondContact CA-O 3.36Å; Y217-D220 CarbonylContact O-C 3.58Å; D220-S222 PolarHBondContact O-N 2.89Å; D220-S222 VanDerWaalsContact O-N 3.12Å; D220-S222 WeakPolarHBondContact OD2-CB 3.18Å; D220-S222 PolarHBondContact OD2-N 3.39Å; D220-S222 PolarHBondContact OD2-OG 3.16Å; D220-G223 PolarHBondContact O-N 3.48Å; D220-I225 HydrophobicContact CB-CB 4.1Å; D220-I225 HydrophobicContact CB-CD1 3.81Å; D220-I225 HydrophobicContact CB-CG1 4.23Å; D220-R337 IonicContact OD1-CZ 3.79Å; D220-R337 IonicContact OD1-NE 2.71Å; D220-R337 PolarHBondContact OD1-NE 2.75Å; D220-R337 IonicContact OD1-NH2 3.11Å; D220-R337 PolarHBondContact OD1-NH2 3.47Å
221	S	93.3	Very high	94.7	Very high	110 Å²	110	49.8 Å²	49.8	77%	0.769	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23	-175.8	53.1	0	0	0	0	113.7	G223	S221-G223 PolarHBondContact O-N 3.32Å
222	S	92.3	Very high	94.1	Very high	34 Å²	34	48.6 Å²	48.6	24%	0.238	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-15.7	173.9	68.1	0	0	0	0	113.5	D220 S224	D220-S222 PolarHBondContact O-N 2.89Å; D220-S222 VanDerWaalsContact O-N 3.12Å; D220-S222 WeakPolarHBondContact OD2-CB 3.18Å; D220-S222 PolarHBondContact OD2-N 3.39Å; D220-S222 PolarHBondContact OD2-OG 3.16Å; S222-S224 PolarHBondContact O-N 3.5Å; S222-S224 PolarHBondContact O-OG 3.04Å; S222-S224 WeakPolarHBondContact OG-CB 3.32Å; S222-S224 PolarHBondContact OG-N 3.48Å; S222-S224 VanDerWaalsContact OG-N 3.13Å
223	G	93.3	Very high	94	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	62.9	2.8	-170.2	0	0	0	0	0	114.8	R216 D220 S221 I225 L262	R216-G223 VanDerWaalsContact CD-O 3.25Å; R216-G223 WeakPolarHBondContact CD-O 3.47Å; D220-G223 PolarHBondContact O-N 3.48Å; S221-G223 PolarHBondContact O-N 3.32Å; G223-I225 VanDerWaalsContact C-N 3.27Å; G223-I225 PolarHBondContact O-N 2.98Å; G223-L262 WeakPolarHBondContact O-CD2 2.97Å
224	S	94.9	Very high	93.9	Very high	8 Å²	8	51.8 Å²	51.8	6%	0.056	30%	0.296	C	S	.	.			trans	-83.5	-3	-176.4	-62	0	0	0	0	113.3	S222 P261 L263 F264	S222-S224 PolarHBondContact O-N 3.5Å; S222-S224 PolarHBondContact O-OG 3.04Å; S222-S224 WeakPolarHBondContact OG-CB 3.32Å; S222-S224 PolarHBondContact OG-N 3.48Å; S222-S224 VanDerWaalsContact OG-N 3.13Å; S224-P261 WeakPolarHBondContact CA-O 3.48Å; S224-P261 WeakPolarHBondContact CB-O 3.41Å; S224-P261 PolarHBondContact OG-O 3.35Å; S224-L263 PolarHBondContact O-N 3.02Å; S224-F264 PolarHBondContact O-N 2.96Å; S224-F264 VanDerWaalsContact O-N 3.12Å
225	I	97.4	Very high	94	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.7	-174.1	-51.1	170.3	0	0	0	109.6	V219 D220 G223 F264 I266 L333 A336 I340	V219-I225 HydrophobicContact CG1-CB 4.5Å; V219-I225 HydrophobicContact CG1-CG2 4.15Å; D220-I225 HydrophobicContact CB-CB 4.1Å; D220-I225 HydrophobicContact CB-CD1 3.81Å; D220-I225 HydrophobicContact CB-CG1 4.23Å; G223-I225 VanDerWaalsContact C-N 3.27Å; G223-I225 PolarHBondContact O-N 2.98Å; I225-F264 WeakPolarHBondContact CA-O 3.3Å; I225-F264 HydrophobicContact CG1-CB 4.5Å; I225-F264 HydrophobicContact CG2-CB 4.42Å; I225-I266 HydrophobicContact CG2-CD1 4.5Å; I225-I266 HydrophobicContact CG2-CG1 4.31Å; I225-I266 HydrophobicContact CG2-CG2 4.05Å; I225-L333 HydrophobicContact CD1-CD2 4.29Å; I225-L333 HydrophobicContact CG2-CD2 4.1Å; I225-A336 HydrophobicContact CD1-CB 3.43Å; I225-A336 VanDerWaalsContact CD1-CB 3.43Å; I225-A336 HydrophobicContact CG1-CB 4.09Å; I225-I340 HydrophobicContact CD1-CD1 4.49Å; I225-I340 HydrophobicContact CG1-CD1 4.44Å
226	I	96.7	Very high	93.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.1	173.4	58.4	175.3	0	0	0	111	A212 V213 R216 I228 F239 L262 F264 A265 I266 I279	A212-I226 HydrophobicContact CB-CB 4.18Å; V213-I226 HydrophobicContact CG2-CG2 4.4Å; R216-I226 HydrophobicContact CB-CG2 3.85Å; I226-I228 HydrophobicContact CD1-CD1 3.95Å; I226-I228 HydrophobicContact CG1-CD1 4.44Å; I226-F239 HydrophobicContact CD1-CD2 3.91Å; I226-F239 HydrophobicContact CD1-CE2 4.25Å; I226-L262 HydrophobicContact CG2-CD2 3.38Å; I226-F264 PolarHBondContact N-O 3.2Å; I226-A265 HydrophobicContact CD1-CB 4.14Å; I226-A265 HydrophobicContact CG1-CB 3.85Å; I226-A265 CarbonylContact O-C 3.57Å; I226-A265 WeakPolarHBondContact O-CA 3.5Å; I226-I266 WeakPolarHBondContact O-CG1 3.47Å; I226-I266 PolarHBondContact O-N 3.3Å; I226-I279 HydrophobicContact CD1-CD1 4.35Å
227	Y	97.8	Very high	93.6	Very high	64 Å²	64	42.6 Å²	42.6	25%	0.251	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.3	172.1	169.6	-128.8	0	0	0	109.5	A212 E229 I266 W274	A212-Y227 WeakPolarHBondContact CB-O 3.27Å; Y227-E229 HydrophobicContact CE1-CB 4.34Å; Y227-I266 WeakPolarHBondContact CA-O 2.94Å; Y227-I266 HydrophobicContact CD2-CG1 4.2Å; Y227-W274 HydrophobicContact CD2-CH2 4.46Å; Y227-W274 AromaticContact CD2-CZ3 3.91Å; Y227-W274 HydrophobicContact CD2-CZ3 3.91Å; Y227-W274 AromaticContact CE2-CH2 3.67Å; Y227-W274 HydrophobicContact CE2-CH2 3.67Å; Y227-W274 AromaticContact CE2-CZ3 3.47Å; Y227-W274 HydrophobicContact CE2-CZ3 3.47Å; Y227-W274 VanDerWaalsContact CE2-CZ3 3.47Å
228	I	97.7	Very high	93.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.24	C	C	.	.			trans	-85.2	111.7	172.2	-53.3	-59.9	0	0	0	107.6	I208 V209 A212 I226 C233 W235 A265 I266 Y267	I208-I228 HydrophobicContact CG2-CG2 3.99Å; V209-I228 HydrophobicContact CG2-CD1 4.33Å; A212-I228 HydrophobicContact CB-CD1 3.78Å; I226-I228 HydrophobicContact CD1-CD1 3.95Å; I226-I228 HydrophobicContact CG1-CD1 4.44Å; I228-C233 WeakPolarHBondContact CG2-SG 3.05Å; I228-W235 HydrophobicContact CD1-CB 3.93Å; I228-W235 HydrophobicContact CD1-CG 4.29Å; I228-W235 HydrophobicContact CG1-CB 4.2Å; I228-W235 HydrophobicContact CG1-CG 4.16Å; I228-W235 HydrophobicContact CG2-CB 4.46Å; I228-A265 HydrophobicContact CG1-CB 4.22Å; I228-I266 PolarHBondContact N-O 3.29Å; I228-Y267 WeakPolarHBondContact O-CB 3.42Å
229	E	94.5	Very high	93.5	Very high	130 Å²	130	32.3 Å²	32.3	61%	0.607	20%	0.204	S	C	*	.			trans	-65.3	146.5	-177.9	-173.4	171.8	-165.8	0	0	112.4	I208 Y227	I208-E229 HydrophobicContact CG2-CB 4.23Å; Y227-E229 HydrophobicContact CE1-CB 4.34Å
230	G	90.9	Very high	93.3	Very high	38 Å²	38	32.6 Å²	32.6	39%	0.392	20%	0.204	S	C	.	.	S	Bend	trans	89.3	-153.2	179.4	0	0	0	0	0	113.3	G232	G230-G232 VanDerWaalsContact C-N 3.32Å; G230-G232 PolarHBondContact O-N 3.1Å
231	T	87.4	Confident	93.1	Very high	81 Å²	81	35.4 Å²	35.4	50%	0.497	22%	0.217	S	C	.	.	S	Bend	trans	-95.2	22.1	-174	59.8	0	0	0	0	114.2	Q268 K270	T231-Q268 CarbonylContact C-O 3.56Å; T231-Q268 WeakPolarHBondContact CA-O 3.46Å; T231-K270 HydrophobicContact CG2-CG 4.12Å
232	G	82.7	Confident	93	Very high	33 Å²	33	30.5 Å²	30.5	34%	0.34	18%	0.182	S	C	.	.			trans	93.1	142.3	-168.3	0	0	0	0	0	112.5	G230	G230-G232 VanDerWaalsContact C-N 3.32Å; G230-G232 PolarHBondContact O-N 3.1Å
233	C	93.6	Very high	92.9	Very high	27 Å²	27	30.7 Å²	30.7	18%	0.182	18%	0.179	C	C	.	.			trans	-139	167	176.6	73.9	0	0	0	0	109.6	A205 I208 I228 W235	A205-C233 HydrophobicContact CB-CB 3.92Å; I208-C233 HydrophobicContact CD1-CB 4.49Å; I228-C233 WeakPolarHBondContact CG2-SG 3.05Å; C233-W235 VanDerWaalsContact O-CD1 3.31Å; C233-W235 PolarHBondContact O-N 3.3Å
234	P	93.6	Very high	92.6	Very high	45 Å²	45	37.6 Å²	37.6	29%	0.292	21%	0.209	S	C	.	.	S	Bend	trans	-69.2	76.8	174.5	29.5	-36.3	0	0	0	111.2	T201 W202 A205	T201-P234 HydrophobicContact CG2-CG 4.25Å; W202-P234 HydrophobicContact CB-CG 4.46Å; A205-P234 HydrophobicContact CB-CG 3.77Å
235	W	95	Very high	92.2	Very high	11 Å²	11	39.9 Å²	39.9	4%	0.042	22%	0.224	C	C	.	.			trans	-85	-28.9	-168.4	65.1	-96.8	0	0	0	114.2	V209 I228 C233 T237 H238 F239 A265 Q277 I279	V209-W235 HydrophobicContact CG2-CB 3.54Å; I228-W235 HydrophobicContact CD1-CB 3.93Å; I228-W235 HydrophobicContact CD1-CG 4.29Å; I228-W235 HydrophobicContact CG1-CB 4.2Å; I228-W235 HydrophobicContact CG1-CG 4.16Å; I228-W235 HydrophobicContact CG2-CB 4.46Å; C233-W235 VanDerWaalsContact O-CD1 3.31Å; C233-W235 PolarHBondContact O-N 3.3Å; W235-T237 PolarHBondContact O-N 3Å; W235-H238 PolarHBondContact O-N 3Å; W235-F239 HydrophobicContact CE3-CB 3.82Å; W235-F239 HydrophobicContact CE3-CG 4.29Å; W235-F239 HydrophobicContact CZ3-CB 4.03Å; W235-F239 HydrophobicContact CZ3-CD1 4.34Å; W235-F239 HydrophobicContact CZ3-CG 4.07Å; W235-F239 WeakPolarHBondContact O-CB 3.37Å; W235-F239 PolarHBondContact O-N 3.42Å; W235-A265 HydrophobicContact CD2-CB 4.41Å; W235-A265 HydrophobicContact CH2-CB 4.21Å; W235-A265 HydrophobicContact CZ2-CB 4Å; W235-A265 HydrophobicContact CZ3-CB 4.47Å; W235-Q277 HydrophobicContact CZ2-CB 4.44Å; W235-Q277 HydrophobicContact CZ2-CG 4Å; W235-I279 HydrophobicContact CH2-CG1 3.95Å; W235-I279 HydrophobicContact CZ3-CG1 4.16Å
236	S	91.7	Very high	91.5	Very high	28 Å²	28	43 Å²	43	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-49.7	-164.9	-169.6	0	0	0	0	113.9	F239 F240	S236-F239 WeakPolarHBondContact O-CB 3.17Å; S236-F239 PolarHBondContact O-N 3.47Å; S236-F240 WeakPolarHBondContact O-CD2 3.27Å; S236-F240 PolarHBondContact O-N 2.88Å
237	T	89.8	Confident	90.7	Very high	42 Å²	42	45.3 Å²	45.3	26%	0.258	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-46.8	-179.5	-53.8	0	0	0	0	111.2	W235 F239 F240 E241	W235-T237 PolarHBondContact O-N 3Å; T237-F239 VanDerWaalsContact C-N 3.26Å; T237-F239 PolarHBondContact O-N 3.36Å; T237-F240 PolarHBondContact O-N 3.35Å; T237-E241 WeakPolarHBondContact O-CG 3.43Å; T237-E241 PolarHBondContact O-N 3.09Å; T237-E241 VanDerWaalsContact O-N 3.14Å
238	H	94.4	Very high	89.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-38.1	176.6	-70.3	-56.9	0	0	0	112.2	W202 R206 V209 W235 F240 E241 I242	W202-H238 AromaticContact CD1-NE2 3.67Å; W202-H238 AromaticContact CD2-CE1 3.85Å; W202-H238 AromaticContact CD2-NE2 3.69Å; W202-H238 AromaticContact CE2-CE1 3.34Å; W202-H238 AromaticContact CE2-NE2 3.43Å; W202-H238 AromaticContact CG-NE2 3.84Å; W202-H238 AromaticContact CH2-CE1 3.84Å; W202-H238 AromaticContact CZ2-CE1 3.35Å; W202-H238 WeakPolarHBondContact CZ2-CE1 3.4Å; W202-H238 AromaticContact CZ2-NE2 3.95Å; W202-H238 AromaticContact NE1-CE1 3.71Å; W202-H238 AromaticContact NE1-NE2 3.41Å; W202-H238 PolarHBondContact NE1-NE2 2.88Å; W202-H238 PolarHBondContact O-NE2 3.23Å; R206-H238 PolarHBondContact NH1-ND1 3.25Å; R206-H238 VanDerWaalsContact NH1-ND1 3.19Å; V209-H238 HydrophobicContact CB-CB 4.05Å; V209-H238 HydrophobicContact CG1-CB 4.22Å; V209-H238 HydrophobicContact CG2-CB 4.02Å; W235-H238 PolarHBondContact O-N 3Å; H238-F240 PolarHBondContact O-N 2.99Å; H238-E241 IonicContact ND1-OE2 3.53Å; H238-E241 PolarHBondContact O-N 3.08Å; H238-I242 HydrophobicContact CB-CD1 4.33Å; H238-I242 VanDerWaalsContact O-CB 3.3Å; H238-I242 WeakPolarHBondContact O-CB 3.49Å; H238-I242 VanDerWaalsContact O-CD1 3.3Å; H238-I242 WeakPolarHBondContact O-CD1 3.43Å; H238-I242 WeakPolarHBondContact O-CG1 3.48Å; H238-I242 PolarHBondContact O-N 3.14Å
239	F	94.7	Very high	88.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.1	-49.8	178	166.9	-90.3	0	0	0	111.4	V209 V213 I226 W235 S236 T237 I242 E243 L262 I279	V209-F239 HydrophobicContact CG1-CB 3.95Å; V213-F239 HydrophobicContact CG2-CD2 4.19Å; I226-F239 HydrophobicContact CD1-CD2 3.91Å; I226-F239 HydrophobicContact CD1-CE2 4.25Å; W235-F239 HydrophobicContact CE3-CB 3.82Å; W235-F239 HydrophobicContact CE3-CG 4.29Å; W235-F239 HydrophobicContact CZ3-CB 4.03Å; W235-F239 HydrophobicContact CZ3-CD1 4.34Å; W235-F239 HydrophobicContact CZ3-CG 4.07Å; W235-F239 WeakPolarHBondContact O-CB 3.37Å; W235-F239 PolarHBondContact O-N 3.42Å; S236-F239 WeakPolarHBondContact O-CB 3.17Å; S236-F239 PolarHBondContact O-N 3.47Å; T237-F239 VanDerWaalsContact C-N 3.26Å; T237-F239 PolarHBondContact O-N 3.36Å; F239-I242 PolarHBondContact O-N 3.16Å; F239-E243 VanDerWaalsContact O-CB 3.32Å; F239-E243 WeakPolarHBondContact O-CB 3.19Å; F239-E243 PolarHBondContact O-N 3.32Å; F239-L262 HydrophobicContact CE2-CB 3.78Å; F239-L262 HydrophobicContact CE2-CD1 3.66Å; F239-L262 HydrophobicContact CE2-CG 4.21Å; F239-L262 HydrophobicContact CZ-CB 3.73Å; F239-L262 HydrophobicContact CZ-CD1 4.12Å; F239-I279 HydrophobicContact CD1-CG2 4Å; F239-I279 HydrophobicContact CD2-CD1 4.42Å; F239-I279 HydrophobicContact CE1-CD1 4.44Å; F239-I279 HydrophobicContact CE1-CG2 3.36Å; F239-I279 HydrophobicContact CE2-CD1 3.77Å; F239-I279 HydrophobicContact CZ-CD1 3.81Å; F239-I279 HydrophobicContact CZ-CG2 3.7Å
240	F	91.9	Very high	87.1	Confident	23 Å²	23	51.3 Å²	51.3	10%	0.101	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-38.5	-179.2	-71.9	-66.5	0	0	0	112.4	S236 T237 H238 K244 I279 P280 N282 E283	S236-F240 WeakPolarHBondContact O-CD2 3.27Å; S236-F240 PolarHBondContact O-N 2.88Å; T237-F240 PolarHBondContact O-N 3.35Å; H238-F240 PolarHBondContact O-N 2.99Å; F240-K244 VanDerWaalsContact O-CB 3.31Å; F240-K244 WeakPolarHBondContact O-CB 3.3Å; F240-K244 PolarHBondContact O-N 3.27Å; F240-I279 HydrophobicContact CZ-CG2 4.43Å; F240-P280 HydrophobicContact CZ-CB 4.04Å; F240-P280 HydrophobicContact CZ-CG 4.49Å; F240-P280 WeakPolarHBondContact CZ-O 3.42Å; F240-N282 VanDerWaalsContact CZ-C 3.45Å; F240-E283 HydrophobicContact CD2-CB 3.66Å; F240-E283 HydrophobicContact CE2-CB 4.12Å; F240-E283 HydrophobicContact CG-CB 4.24Å
241	E	90.8	Very high	85.4	Confident	70 Å²	70	58.8 Å²	58.8	33%	0.327	32%	0.315	S	S	.	.	H	α-helix	trans	-62.8	-44.1	174.2	-69.9	173.8	-167.3	0	0	112.3	R206 T237 H238 S245	R206-E241 IonicContact CZ-OE2 3.92Å; R206-E241 IonicContact NH1-OE2 2.68Å; R206-E241 PolarHBondContact NH1-OE2 2.75Å; R206-E241 IonicContact NH2-OE2 3.43Å; T237-E241 WeakPolarHBondContact O-CG 3.43Å; T237-E241 PolarHBondContact O-N 3.09Å; T237-E241 VanDerWaalsContact O-N 3.14Å; H238-E241 IonicContact ND1-OE2 3.53Å; H238-E241 PolarHBondContact O-N 3.08Å; E241-S245 WeakPolarHBondContact O-CB 3.34Å; E241-S245 PolarHBondContact O-N 3.12Å
242	I	92	Very high	83.7	Confident	7 Å²	7	60.3 Å²	60.3	4%	0.036	32%	0.32	C	S	.	.	H	α-helix	trans	-66.5	-45.3	179.3	-71.8	161.6	0	0	0	110.1	V209 L210 V213 H238 F239 S245 L246	V209-I242 HydrophobicContact CB-CD1 4Å; V209-I242 HydrophobicContact CG1-CD1 3.82Å; L210-I242 HydrophobicContact CB-CD1 3.9Å; L210-I242 HydrophobicContact CD1-CD1 4.4Å; L210-I242 HydrophobicContact CD1-CG1 4.42Å; L210-I242 HydrophobicContact CD1-CG2 3.98Å; V213-I242 HydrophobicContact CB-CG2 4.4Å; V213-I242 HydrophobicContact CG1-CG2 4.33Å; V213-I242 HydrophobicContact CG2-CG2 4.35Å; H238-I242 HydrophobicContact CB-CD1 4.33Å; H238-I242 VanDerWaalsContact O-CB 3.3Å; H238-I242 WeakPolarHBondContact O-CB 3.49Å; H238-I242 VanDerWaalsContact O-CD1 3.3Å; H238-I242 WeakPolarHBondContact O-CD1 3.43Å; H238-I242 WeakPolarHBondContact O-CG1 3.48Å; H238-I242 PolarHBondContact O-N 3.14Å; F239-I242 PolarHBondContact O-N 3.16Å; I242-S245 WeakPolarHBondContact O-CB 3.44Å; I242-S245 PolarHBondContact O-N 2.87Å; I242-L246 HydrophobicContact CG2-CD1 4.01Å; I242-L246 HydrophobicContact CG2-CG 4.37Å; I242-L246 WeakPolarHBondContact O-CG 3.37Å; I242-L246 PolarHBondContact O-N 2.76Å
243	E	89.8	Confident	82.1	Confident	38 Å²	38	63.9 Å²	63.9	18%	0.178	33%	0.33	C	S	.	.	H	α-helix	trans	-60	-48.1	177.5	-174.8	-179.8	-118.6	0	0	111.3	F239 S245 L246 L247 R290	F239-E243 VanDerWaalsContact O-CB 3.32Å; F239-E243 WeakPolarHBondContact O-CB 3.19Å; F239-E243 PolarHBondContact O-N 3.32Å; E243-S245 VanDerWaalsContact C-N 3.3Å; E243-S245 PolarHBondContact O-N 3.34Å; E243-L246 PolarHBondContact O-N 3.1Å; E243-L247 HydrophobicContact CG-CD1 4.19Å; E243-L247 WeakPolarHBondContact O-CG 3.42Å; E243-L247 PolarHBondContact O-N 3.2Å; E243-R290 IonicContact OE1-CZ 2.66Å; E243-R290 VanDerWaalsContact OE1-CZ 3.27Å; E243-R290 IonicContact OE1-NH1 3.7Å; E243-R290 PolarHBondContact OE1-NH1 3.31Å; E243-R290 IonicContact OE1-NH2 3.27Å; E243-R290 PolarHBondContact OE1-NH2 2.96Å; E243-R290 IonicContact OE2-CZ 3.67Å; E243-R290 IonicContact OE2-NH1 2.98Å; E243-R290 IonicContact OE2-NH2 3.84Å; E243-R290 PolarHBondContact OE2-NH2 3.35Å
244	K	87	Confident	79.8	Confident	145 Å²	145	68.9 Å²	68.9	63%	0.63	36%	0.355	S	S	*	.	H	α-helix	trans	-56.2	-44.5	174.6	-175.2	178.7	179.9	-179.7	0	111.6	F240 L247 L248	F240-K244 VanDerWaalsContact O-CB 3.31Å; F240-K244 WeakPolarHBondContact O-CB 3.3Å; F240-K244 PolarHBondContact O-N 3.27Å; K244-L247 PolarHBondContact O-N 2.7Å; K244-L248 HydrophobicContact CG-CD1 4.18Å; K244-L248 VanDerWaalsContact O-CG 3.29Å; K244-L248 WeakPolarHBondContact O-CG 3.5Å; K244-L248 PolarHBondContact O-N 3.35Å
245	S	86.6	Confident	77.4	Confident	55 Å²	55	72.7 Å²	72.7	39%	0.385	37%	0.369	S	S	.	.	H	α-helix	trans	-63.7	-41.7	177.3	-178.8	0	0	0	0	112.8	E241 I242 E243 L248 N249	E241-S245 WeakPolarHBondContact O-CB 3.34Å; E241-S245 PolarHBondContact O-N 3.12Å; I242-S245 WeakPolarHBondContact O-CB 3.44Å; I242-S245 PolarHBondContact O-N 2.87Å; E243-S245 VanDerWaalsContact C-N 3.3Å; E243-S245 PolarHBondContact O-N 3.34Å; S245-L248 PolarHBondContact O-N 3.45Å; S245-N249 WeakPolarHBondContact O-CB 3.5Å; S245-N249 PolarHBondContact O-N 3.42Å; S245-N249 VanDerWaalsContact O-N 3.07Å; S245-N249 PolarHBondContact O-ND2 3.19Å; S245-N249 PolarHBondContact OG-ND2 3.3Å
246	L	82.9	Confident	75.1	Confident	66 Å²	66	75.3 Å²	75.3	35%	0.346	38%	0.383	S	S	.	.	H	α-helix	trans	-66.2	-38.5	176.5	-70.2	174.9	0	0	0	111.9	V213 I242 E243 N250	V213-L246 HydrophobicContact CG1-CD1 3.65Å; I242-L246 HydrophobicContact CG2-CD1 4.01Å; I242-L246 HydrophobicContact CG2-CG 4.37Å; I242-L246 WeakPolarHBondContact O-CG 3.37Å; I242-L246 PolarHBondContact O-N 2.76Å; E243-L246 PolarHBondContact O-N 3.1Å; L246-N250 WeakPolarHBondContact O-CB 3.41Å; L246-N250 PolarHBondContact O-N 2.94Å; L246-N250 VanDerWaalsContact O-N 3.12Å; L246-N250 PolarHBondContact O-ND2 3.23Å
247	L	79.4	Confident	73	Confident	48 Å²	48	81.2 Å²	81.2	25%	0.251	41%	0.407	S	S	.	.	H	α-helix	trans	-65.2	-42.8	175.5	-70.7	170.7	0	0	0	111.9	E243 K244 N249 N250 I256	E243-L247 HydrophobicContact CG-CD1 4.19Å; E243-L247 WeakPolarHBondContact O-CG 3.42Å; E243-L247 PolarHBondContact O-N 3.2Å; K244-L247 PolarHBondContact O-N 2.7Å; L247-N249 PolarHBondContact O-N 3.09Å; L247-N250 PolarHBondContact O-N 2.94Å; L247-I256 HydrophobicContact CD2-CB 3.89Å; L247-I256 HydrophobicContact CD2-CG2 3.58Å
248	L	76.5	Confident	71.1	Confident	130 Å²	130	87.1 Å²	87.1	68%	0.681	43%	0.43	S	S	*	.	H	α-helix	trans	-66.4	-36.1	178.3	-71.5	170.4	0	0	0	113.1	K244 S245	K244-L248 HydrophobicContact CG-CD1 4.18Å; K244-L248 VanDerWaalsContact O-CG 3.29Å; K244-L248 WeakPolarHBondContact O-CG 3.5Å; K244-L248 PolarHBondContact O-N 3.35Å; S245-L248 PolarHBondContact O-N 3.45Å
249	N	73	Confident	69.1	Low	119 Å²	119	93 Å²	93	64%	0.636	46%	0.461	S	S	*	.	H	α-helix	trans	-78	-24.7	179.8	-73.3	-44.6	0	0	0	113.1	S245 L247 K251	S245-N249 WeakPolarHBondContact O-CB 3.5Å; S245-N249 PolarHBondContact O-N 3.42Å; S245-N249 VanDerWaalsContact O-N 3.07Å; S245-N249 PolarHBondContact O-ND2 3.19Å; S245-N249 PolarHBondContact OG-ND2 3.3Å; L247-N249 PolarHBondContact O-N 3.09Å; N249-K251 PolarHBondContact O-N 2.87Å
250	N	66.6	Low	67.6	Low	72 Å²	72	95.9 Å²	95.9	39%	0.385	48%	0.476	S	S	.	.			trans	-85.5	93.6	174.2	-76.3	-60.4	0	0	0	110.2	L246 L247 N252 I256	L246-N250 WeakPolarHBondContact O-CB 3.41Å; L246-N250 PolarHBondContact O-N 2.94Å; L246-N250 VanDerWaalsContact O-N 3.12Å; L246-N250 PolarHBondContact O-ND2 3.23Å; L247-N250 PolarHBondContact O-N 2.94Å; N250-N252 PolarHBondContact O-N 3.46Å; N250-I256 HydrophobicContact CB-CD1 3.39Å; N250-I256 WeakPolarHBondContact ND2-CD1 3.26Å
251	K	53.5	Low	67.1	Low	195 Å²	195	97.7 Å²	97.7	85%	0.848	49%	0.491	S	S	*	.	S	Bend	trans	-58	-11.4	175.9	-69	-175.3	176.8	-179.6	0	114.4	N249 I253	N249-K251 PolarHBondContact O-N 2.87Å; K251-I253 PolarHBondContact O-N 3.19Å
252	N	51.5	Low	67.2	Low	112 Å²	112	95 Å²	95	60%	0.599	48%	0.478	S	S	*	.			trans	-98.3	67.3	172.6	-68.4	-13.2	0	0	0	110.4	N250 N254 E255	N250-N252 PolarHBondContact O-N 3.46Å; N252-N254 PolarHBondContact O-N 2.87Å; N252-E255 PolarHBondContact O-N 3.3Å
253	I	49.2	Very low	67.3	Low	109 Å²	109	95.4 Å²	95.4	56%	0.559	48%	0.48	S	S	*	.	H	α-helix	trans	-53.8	-24.2	-177.8	-65.2	171.5	0	0	0	112.5	K251 E255	K251-I253 PolarHBondContact O-N 3.19Å; I253-E255 VanDerWaalsContact C-N 3.31Å; I253-E255 PolarHBondContact O-N 3.35Å
254	N	46.6	Very low	67.7	Low	131 Å²	131	93.6 Å²	93.6	70%	0.701	47%	0.472	S	S	*	.	H	α-helix	trans	-72	-13.4	-177.6	-68.4	-24.1	0	0	0	115.4	N252 K258	N252-N254 PolarHBondContact O-N 2.87Å; N254-K258 WeakPolarHBondContact O-CB 3.43Å
255	E	43.1	Very low	68.2	Low	126 Å²	126	86.7 Å²	86.7	59%	0.589	44%	0.442	S	S	*	.	H	α-helix	trans	-100.6	-33.2	-174.2	-71.3	-175.2	159.5	0	0	114.2	N252 I253 N259	N252-E255 PolarHBondContact O-N 3.3Å; I253-E255 VanDerWaalsContact C-N 3.31Å; I253-E255 PolarHBondContact O-N 3.35Å; E255-N259 PolarHBondContact O-N 3.03Å
256	I	46.4	Very low	68.7	Low	66 Å²	66	84.1 Å²	84.1	34%	0.338	42%	0.424	S	S	.	.	H	α-helix	trans	-82.2	-37.5	-172.3	-60.8	177	0	0	0	112.4	L247 N250 K258	L247-I256 HydrophobicContact CD2-CB 3.89Å; L247-I256 HydrophobicContact CD2-CG2 3.58Å; N250-I256 HydrophobicContact CB-CD1 3.39Å; N250-I256 WeakPolarHBondContact ND2-CD1 3.26Å; I256-K258 VanDerWaalsContact C-N 3.31Å
257	E	48.4	Very low	69.4	Low	151 Å²	151	82.5 Å²	82.5	71%	0.706	41%	0.413	S	S	*	.	H	α-helix	trans	-72.5	-26.7	172.1	-79.2	-170	159.6	0	0	112.4
258	K	49.3	Very low	70.3	Confident	167 Å²	167	83.3 Å²	83.3	73%	0.726	42%	0.416	S	S	*	.	H	α-helix	trans	-86	-29.8	-174.2	-89.4	-173.8	174.3	177.6	0	115.1	N254 I256	N254-K258 WeakPolarHBondContact O-CB 3.43Å; I256-K258 VanDerWaalsContact C-N 3.31Å
259	N	52.2	Low	71.2	Confident	122 Å²	122	81.5 Å²	81.5	65%	0.652	40%	0.4	S	S	*	.	H	α-helix	trans	-107.9	-37.4	-168.2	-77.9	-1	0	0	0	116.3	E255	E255-N259 PolarHBondContact O-N 3.03Å
260	D	63.1	Low	72.2	Confident	61 Å²	61	84.7 Å²	84.7	33%	0.326	41%	0.408	S	S	.	.			trans	-143.4	86.7	-175.5	-65.2	-35.9	0	0	0	112.2	Y217 L262	Y217-D260 PolarHBondContact OH-OD2 3.49Å; D260-L262 PolarHBondContact O-N 3.38Å
261	P	80.3	Confident	73.5	Confident	62 Å²	62	85.4 Å²	85.4	40%	0.403	41%	0.412	S	S	.	.			trans	-63.6	131.9	170.4	27.5	-32.3	0	0	0	109.2	S224 L263	S224-P261 WeakPolarHBondContact CA-O 3.48Å; S224-P261 WeakPolarHBondContact CB-O 3.41Å; S224-P261 PolarHBondContact OG-O 3.35Å; P261-L263 HydrophobicContact CB-CD2 3.79Å; P261-L263 HydrophobicContact CB-CG 4.22Å; P261-L263 HydrophobicContact CG-CD1 4.29Å; P261-L263 HydrophobicContact CG-CD2 3.76Å; P261-L263 HydrophobicContact CG-CG 3.99Å; P261-L263 WeakPolarHBondContact O-CG 3.41Å; P261-L263 PolarHBondContact O-N 3.16Å; P261-L263 VanDerWaalsContact O-N 3.16Å
262	L	93	Very high	75.5	Confident	14 Å²	14	79.8 Å²	79.8	7%	0.073	40%	0.397	C	S	.	.			trans	-65.7	112.6	162.4	-79.5	160.2	0	0	0	107.5	V213 R216 G223 I226 F239 D260 I279 R290	V213-L262 HydrophobicContact CG1-CD1 4.14Å; V213-L262 HydrophobicContact CG2-CD1 4.49Å; R216-L262 HydrophobicContact CB-CD2 4.49Å; G223-L262 WeakPolarHBondContact O-CD2 2.97Å; I226-L262 HydrophobicContact CG2-CD2 3.38Å; F239-L262 HydrophobicContact CE2-CB 3.78Å; F239-L262 HydrophobicContact CE2-CD1 3.66Å; F239-L262 HydrophobicContact CE2-CG 4.21Å; F239-L262 HydrophobicContact CZ-CB 3.73Å; F239-L262 HydrophobicContact CZ-CD1 4.12Å; D260-L262 PolarHBondContact O-N 3.38Å; L262-I279 HydrophobicContact CB-CD1 4.06Å; L262-R290 WeakPolarHBondContact O-CD 3.49Å; L262-R290 PolarHBondContact O-NH1 2.78Å
263	L	95.6	Very high	77.7	Confident	15 Å²	15	75.6 Å²	75.6	8%	0.079	38%	0.376	C	S	.	.			trans	-107.6	-38.4	-170.6	-66.8	176.3	0	0	0	113.3	S224 P261 I279 R290 L291 I340	S224-L263 PolarHBondContact O-N 3.02Å; P261-L263 HydrophobicContact CB-CD2 3.79Å; P261-L263 HydrophobicContact CB-CG 4.22Å; P261-L263 HydrophobicContact CG-CD1 4.29Å; P261-L263 HydrophobicContact CG-CD2 3.76Å; P261-L263 HydrophobicContact CG-CG 3.99Å; P261-L263 WeakPolarHBondContact O-CG 3.41Å; P261-L263 PolarHBondContact O-N 3.16Å; P261-L263 VanDerWaalsContact O-N 3.16Å; L263-I279 WeakPolarHBondContact O-CB 3.5Å; L263-I279 PolarHBondContact O-N 3.41Å; L263-R290 HydrophobicContact CD2-CB 3.78Å; L263-L291 HydrophobicContact CD1-CB 4.4Å; L263-L291 HydrophobicContact CD1-CD2 3.86Å; L263-L291 HydrophobicContact CD2-CB 3.9Å; L263-I340 HydrophobicContact CD1-CD1 4.12Å; L263-I340 HydrophobicContact CD1-CG1 3.82Å
264	F	97.4	Very high	80	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140	-172.6	-59.8	-74.7	0	0	0	112.3	S224 I225 I226 I276 Q277 A278 L291 L293 A336 T339 I340	S224-F264 PolarHBondContact O-N 2.96Å; S224-F264 VanDerWaalsContact O-N 3.12Å; I225-F264 WeakPolarHBondContact CA-O 3.3Å; I225-F264 HydrophobicContact CG1-CB 4.5Å; I225-F264 HydrophobicContact CG2-CB 4.42Å; I226-F264 PolarHBondContact N-O 3.2Å; F264-I276 HydrophobicContact CB-CD1 4.41Å; F264-I276 HydrophobicContact CB-CG1 4.22Å; F264-I276 HydrophobicContact CD1-CD1 3.79Å; F264-I276 HydrophobicContact CD1-CG1 3.79Å; F264-I276 HydrophobicContact CE1-CD1 4.26Å; F264-I276 HydrophobicContact CG-CD1 4.03Å; F264-I276 HydrophobicContact CG-CG1 4.19Å; F264-Q277 CarbonylContact C-O 3.54Å; F264-Q277 WeakPolarHBondContact CA-O 3.46Å; F264-A278 HydrophobicContact CD1-CB 4.08Å; F264-A278 HydrophobicContact CE1-CB 3.88Å; F264-L291 WeakPolarHBondContact CE1-O 3.43Å; F264-L291 HydrophobicContact CE2-CD2 4.04Å; F264-L291 HydrophobicContact CZ-CB 4.12Å; F264-L291 HydrophobicContact CZ-CD2 3.97Å; F264-L291 HydrophobicContact CZ-CG 3.98Å; F264-L291 WeakPolarHBondContact CZ-O 3.44Å; F264-L293 HydrophobicContact CE1-CD2 4.05Å; F264-A336 HydrophobicContact CD2-CB 3.98Å; F264-A336 HydrophobicContact CG-CB 4.29Å; F264-T339 HydrophobicContact CE2-CG2 4.42Å; F264-T339 HydrophobicContact CZ-CG2 3.68Å; F264-I340 HydrophobicContact CD2-CD1 4.3Å; F264-I340 HydrophobicContact CD2-CG1 4.42Å; F264-I340 HydrophobicContact CE2-CD1 4.21Å; F264-I340 HydrophobicContact CE2-CG1 3.82Å
265	A	97.2	Very high	82.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.5	162.7	0	0	0	0	0	109.4	I226 I228 W235 Q277	I226-A265 HydrophobicContact CD1-CB 4.14Å; I226-A265 HydrophobicContact CG1-CB 3.85Å; I226-A265 CarbonylContact O-C 3.57Å; I226-A265 WeakPolarHBondContact O-CA 3.5Å; I228-A265 HydrophobicContact CG1-CB 4.22Å; W235-A265 HydrophobicContact CD2-CB 4.41Å; W235-A265 HydrophobicContact CH2-CB 4.21Å; W235-A265 HydrophobicContact CZ2-CB 4Å; W235-A265 HydrophobicContact CZ3-CB 4.47Å; A265-Q277 PolarHBondContact N-O 3.23Å; A265-Q277 PolarHBondContact O-N 3.34Å
266	I	98.1	Very high	85.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	146.5	172	66.3	166.8	0	0	0	111.2	V219 I225 I226 Y227 I228 T275 I276 V332 L333	V219-I266 HydrophobicContact CG1-CD1 4.24Å; I225-I266 HydrophobicContact CG2-CD1 4.5Å; I225-I266 HydrophobicContact CG2-CG1 4.31Å; I225-I266 HydrophobicContact CG2-CG2 4.05Å; I226-I266 WeakPolarHBondContact O-CG1 3.47Å; I226-I266 PolarHBondContact O-N 3.3Å; Y227-I266 WeakPolarHBondContact CA-O 2.94Å; Y227-I266 HydrophobicContact CD2-CG1 4.2Å; I228-I266 PolarHBondContact N-O 3.29Å; I266-T275 WeakPolarHBondContact CA-O 3.44Å; I266-T275 WeakPolarHBondContact CB-O 3.12Å; I266-I276 HydrophobicContact CG2-CB 4.25Å; I266-I276 HydrophobicContact CG2-CG1 4.35Å; I266-V332 HydrophobicContact CB-CG2 4.26Å; I266-V332 HydrophobicContact CD1-CG2 4.31Å; I266-V332 HydrophobicContact CG2-CB 4.35Å; I266-V332 HydrophobicContact CG2-CG2 4.18Å; I266-L333 HydrophobicContact CD1-CD1 4.43Å; I266-L333 HydrophobicContact CD1-CD2 3.59Å; I266-L333 HydrophobicContact CD1-CG 3.79Å
267	Y	97.9	Very high	87.5	Confident	33 Å²	33	57.9 Å²	57.9	13%	0.129	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	155.1	176.4	49.2	-86.9	0	0	0	111.7	I228 W274 T275 Q277	I228-Y267 WeakPolarHBondContact O-CB 3.42Å; Y267-W274 WeakPolarHBondContact O-CA 3.48Å; Y267-T275 HydrophobicContact CE1-CG2 4.04Å; Y267-T275 HydrophobicContact CE2-CG2 4Å; Y267-T275 WeakPolarHBondContact CE2-OG1 3.33Å; Y267-T275 PolarHBondContact N-O 2.68Å; Y267-T275 VanDerWaalsContact N-O 3.16Å; Y267-T275 PolarHBondContact O-N 2.75Å; Y267-Q277 HydrophobicContact CE1-CB 4.26Å; Y267-Q277 PolarHBondContact OH-OE1 3.24Å
268	Q	97.6	Very high	89.8	Confident	64 Å²	64	50.8 Å²	50.8	30%	0.299	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	150.2	173.4	-160.8	171.8	26.6	0	0	110.2	T231 S272 T273 W274	T231-Q268 CarbonylContact C-O 3.56Å; T231-Q268 WeakPolarHBondContact CA-O 3.46Å; Q268-S272 PolarHBondContact NE2-O 3.23Å; Q268-S272 VanDerWaalsContact NE2-O 3.13Å; Q268-T273 CarbonylContact C-O 3.55Å; Q268-T273 WeakPolarHBondContact CG-O 3.46Å; Q268-W274 HydrophobicContact CB-CD2 4.08Å; Q268-W274 HydrophobicContact CB-CE3 4.32Å; Q268-W274 HydrophobicContact CB-CH2 4.02Å; Q268-W274 HydrophobicContact CB-CZ2 3.76Å; Q268-W274 HydrophobicContact CB-CZ3 4.3Å; Q268-W274 HydrophobicContact CG-CD2 4.24Å; Q268-W274 HydrophobicContact CG-CZ2 3.96Å
269	R	95.4	Very high	91.9	Very high	92 Å²	92	42.9 Å²	42.9	35%	0.347	22%	0.217	S	C	.	.			trans	-101	165.2	173.5	-68.1	166	58.2	101.4	3	109.6	D271 S272 T273 T275	R269-D271 WeakPolarHBondContact CB-OD1 3.13Å; R269-D271 IonicContact CZ-OD2 3.18Å; R269-D271 IonicContact NE-OD1 3.46Å; R269-D271 IonicContact NE-OD2 2.76Å; R269-D271 PolarHBondContact NE-OD2 2.93Å; R269-D271 IonicContact NH2-OD2 2.83Å; R269-D271 PolarHBondContact NH2-OD2 3.39Å; R269-D271 PolarHBondContact O-N 3.24Å; R269-S272 PolarHBondContact O-N 2.91Å; R269-T273 WeakPolarHBondContact CB-O 3.32Å; R269-T273 VanDerWaalsContact CD-OG1 3.24Å; R269-T273 WeakPolarHBondContact CD-OG1 3.27Å; R269-T273 PolarHBondContact N-O 3.43Å; R269-T273 PolarHBondContact NE-OG1 3.28Å; R269-T275 WeakPolarHBondContact CD-OG1 3.41Å; R269-T275 VanDerWaalsContact CG-OG1 3.31Å; R269-T275 WeakPolarHBondContact CG-OG1 3.19Å
270	K	93.8	Very high	93.9	Very high	186 Å²	186	37.3 Å²	37.3	81%	0.809	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.7	177	-66.1	-176	178	-179.8	0	113.7	T231 S272	T231-K270 HydrophobicContact CG2-CG 4.12Å; K270-S272 PolarHBondContact O-N 3.43Å
271	D	94.4	Very high	95.1	Very high	87 Å²	87	39.1 Å²	39.1	47%	0.465	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	12.8	175.5	59.6	20.3	0	0	0	113	R269 T273	R269-D271 WeakPolarHBondContact CB-OD1 3.13Å; R269-D271 IonicContact CZ-OD2 3.18Å; R269-D271 IonicContact NE-OD1 3.46Å; R269-D271 IonicContact NE-OD2 2.76Å; R269-D271 PolarHBondContact NE-OD2 2.93Å; R269-D271 IonicContact NH2-OD2 2.83Å; R269-D271 PolarHBondContact NH2-OD2 3.39Å; R269-D271 PolarHBondContact O-N 3.24Å; D271-T273 PolarHBondContact O-N 3.13Å; D271-T273 VanDerWaalsContact O-N 3.11Å; D271-T273 WeakPolarHBondContact OD1-CB 3.29Å; D271-T273 PolarHBondContact OD1-N 3.17Å; D271-T273 PolarHBondContact OD1-OG1 3.23Å
272	S	94.8	Very high	95.3	Very high	77 Å²	77	39.4 Å²	39.4	54%	0.538	20%	0.195	S	C	.	.	S	Bend	trans	66.7	-5.3	-175.5	-57.2	0	0	0	0	116.1	Q268 R269 K270	Q268-S272 PolarHBondContact NE2-O 3.23Å; Q268-S272 VanDerWaalsContact NE2-O 3.13Å; R269-S272 PolarHBondContact O-N 2.91Å; K270-S272 PolarHBondContact O-N 3.43Å
273	T	97.3	Very high	94.6	Very high	24 Å²	24	43 Å²	43	15%	0.147	21%	0.211	C	C	.	.			trans	-72.6	166.9	171.8	69.3	0	0	0	0	110.8	Q268 R269 D271	Q268-T273 CarbonylContact C-O 3.55Å; Q268-T273 WeakPolarHBondContact CG-O 3.46Å; R269-T273 WeakPolarHBondContact CB-O 3.32Å; R269-T273 VanDerWaalsContact CD-OG1 3.24Å; R269-T273 WeakPolarHBondContact CD-OG1 3.27Å; R269-T273 PolarHBondContact N-O 3.43Å; R269-T273 PolarHBondContact NE-OG1 3.28Å; D271-T273 PolarHBondContact O-N 3.13Å; D271-T273 VanDerWaalsContact O-N 3.11Å; D271-T273 WeakPolarHBondContact OD1-CB 3.29Å; D271-T273 PolarHBondContact OD1-N 3.17Å; D271-T273 PolarHBondContact OD1-OG1 3.23Å
274	W	98.4	Very high	93.6	Very high	22 Å²	22	49.9 Å²	49.9	8%	0.083	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.2	-173.4	-75.3	75.5	0	0	0	110.5	Y227 Y267 Q268 V325 H326 T328 R329 V332	Y227-W274 HydrophobicContact CD2-CH2 4.46Å; Y227-W274 AromaticContact CD2-CZ3 3.91Å; Y227-W274 HydrophobicContact CD2-CZ3 3.91Å; Y227-W274 AromaticContact CE2-CH2 3.67Å; Y227-W274 HydrophobicContact CE2-CH2 3.67Å; Y227-W274 AromaticContact CE2-CZ3 3.47Å; Y227-W274 HydrophobicContact CE2-CZ3 3.47Å; Y227-W274 VanDerWaalsContact CE2-CZ3 3.47Å; Y267-W274 WeakPolarHBondContact O-CA 3.48Å; Q268-W274 HydrophobicContact CB-CD2 4.08Å; Q268-W274 HydrophobicContact CB-CE3 4.32Å; Q268-W274 HydrophobicContact CB-CH2 4.02Å; Q268-W274 HydrophobicContact CB-CZ2 3.76Å; Q268-W274 HydrophobicContact CB-CZ3 4.3Å; Q268-W274 HydrophobicContact CG-CD2 4.24Å; Q268-W274 HydrophobicContact CG-CZ2 3.96Å; W274-V325 CarbonylContact O-C 3.52Å; W274-V325 VanDerWaalsContact O-CA 3.23Å; W274-V325 WeakPolarHBondContact O-CA 3.26Å; W274-V325 WeakPolarHBondContact O-CG1 3.35Å; W274-H326 PolarHBondContact N-O 2.88Å; W274-H326 PolarHBondContact O-N 3.4Å; W274-T328 VanDerWaalsContact CD1-C 3.45Å; W274-R329 VanDerWaalsContact CD1-N 3.35Å; W274-R329 HydrophobicContact CD2-CB 3.72Å; W274-R329 HydrophobicContact CD2-CG 4.2Å; W274-R329 HydrophobicContact CE3-CB 3.96Å; W274-R329 HydrophobicContact CE3-CG 3.89Å; W274-R329 HydrophobicContact CG-CB 4.34Å; W274-R329 HydrophobicContact CH2-CB 3.98Å; W274-R329 HydrophobicContact CH2-CG 3.79Å; W274-R329 HydrophobicContact CZ2-CB 3.73Å; W274-R329 HydrophobicContact CZ2-CG 4.09Å; W274-R329 HydrophobicContact CZ3-CB 4.08Å; W274-R329 HydrophobicContact CZ3-CG 3.68Å; W274-V332 HydrophobicContact CB-CB 4.36Å; W274-V332 HydrophobicContact CB-CG1 3.63Å; W274-V332 HydrophobicContact CB-CG2 3.73Å; W274-V332 HydrophobicContact CE3-CG2 4.24Å; W274-V332 HydrophobicContact CG-CG2 4.38Å; W274-V332 VanDerWaalsContact O-CG1 3.23Å; W274-V332 WeakPolarHBondContact O-CG1 3.44Å
275	T	98.2	Very high	92.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.2	176.7	-52.7	0	0	0	0	109.7	I266 Y267 R269 Q277 L323 G324	I266-T275 WeakPolarHBondContact CA-O 3.44Å; I266-T275 WeakPolarHBondContact CB-O 3.12Å; Y267-T275 HydrophobicContact CE1-CG2 4.04Å; Y267-T275 HydrophobicContact CE2-CG2 4Å; Y267-T275 WeakPolarHBondContact CE2-OG1 3.33Å; Y267-T275 PolarHBondContact N-O 2.68Å; Y267-T275 VanDerWaalsContact N-O 3.16Å; Y267-T275 PolarHBondContact O-N 2.75Å; R269-T275 WeakPolarHBondContact CD-OG1 3.41Å; R269-T275 VanDerWaalsContact CG-OG1 3.31Å; R269-T275 WeakPolarHBondContact CG-OG1 3.19Å; T275-Q277 HydrophobicContact CG2-CB 4.49Å; T275-L323 HydrophobicContact CG2-CD1 3.68Å; T275-L323 HydrophobicContact CG2-CD2 4.32Å; T275-L323 HydrophobicContact CG2-CG 3.68Å; T275-G324 WeakPolarHBondContact CA-O 3.47Å
276	I	98.2	Very high	91.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.7	157.6	176.8	171.4	0	0	0	107.7	F264 I266 L293 L323 G324 V332 M335 A336	F264-I276 HydrophobicContact CB-CD1 4.41Å; F264-I276 HydrophobicContact CB-CG1 4.22Å; F264-I276 HydrophobicContact CD1-CD1 3.79Å; F264-I276 HydrophobicContact CD1-CG1 3.79Å; F264-I276 HydrophobicContact CE1-CD1 4.26Å; F264-I276 HydrophobicContact CG-CD1 4.03Å; F264-I276 HydrophobicContact CG-CG1 4.19Å; I266-I276 HydrophobicContact CG2-CB 4.25Å; I266-I276 HydrophobicContact CG2-CG1 4.35Å; I276-L293 HydrophobicContact CD1-CD2 3.93Å; I276-L293 HydrophobicContact CG1-CD2 4.48Å; I276-L293 HydrophobicContact CG2-CD1 4.25Å; I276-L323 CarbonylContact O-C 3.59Å; I276-L323 WeakPolarHBondContact O-CA 3.47Å; I276-G324 WeakPolarHBondContact CG2-O 3.48Å; I276-G324 PolarHBondContact N-O 2.74Å; I276-G324 PolarHBondContact O-N 3.22Å; I276-V332 HydrophobicContact CB-CB 4.19Å; I276-V332 HydrophobicContact CB-CG1 4.28Å; I276-V332 HydrophobicContact CG2-CG1 4.29Å; I276-M335 HydrophobicContact CD1-CB 4.46Å; I276-A336 VanDerWaalsContact CD1-CA 3.48Å; I276-A336 HydrophobicContact CD1-CB 3.48Å; I276-A336 VanDerWaalsContact CD1-CB 3.48Å
277	Q	96.9	Very high	90	Very high	39 Å²	39	64.7 Å²	64.7	18%	0.182	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	123.8	178.9	-170.4	170.5	-1.5	0	0	109.2	W235 F264 A265 Y267 T275 F322	W235-Q277 HydrophobicContact CZ2-CB 4.44Å; W235-Q277 HydrophobicContact CZ2-CG 4Å; F264-Q277 CarbonylContact C-O 3.54Å; F264-Q277 WeakPolarHBondContact CA-O 3.46Å; A265-Q277 PolarHBondContact N-O 3.23Å; A265-Q277 PolarHBondContact O-N 3.34Å; Y267-Q277 HydrophobicContact CE1-CB 4.26Å; Y267-Q277 PolarHBondContact OH-OE1 3.24Å; T275-Q277 HydrophobicContact CG2-CB 4.49Å; Q277-F322 WeakPolarHBondContact CA-O 3.35Å
278	A	96	Very high	89.3	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.4	175	0	0	0	0	0	109.6	F264 Q289 L291 F322	F264-A278 HydrophobicContact CD1-CB 4.08Å; F264-A278 HydrophobicContact CE1-CB 3.88Å; A278-Q289 HydrophobicContact CB-CB 3.82Å; A278-Q289 HydrophobicContact CB-CG 3.62Å; A278-L291 WeakPolarHBondContact CB-O 3.34Å; A278-F322 PolarHBondContact N-O 2.81Å
279	I	94.9	Very high	88.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-70.9	130	-177.9	-65.6	175.4	0	0	0	108.8	I226 W235 F239 F240 L262 L263 R290	I226-I279 HydrophobicContact CD1-CD1 4.35Å; W235-I279 HydrophobicContact CH2-CG1 3.95Å; W235-I279 HydrophobicContact CZ3-CG1 4.16Å; F239-I279 HydrophobicContact CD1-CG2 4Å; F239-I279 HydrophobicContact CD2-CD1 4.42Å; F239-I279 HydrophobicContact CE1-CD1 4.44Å; F239-I279 HydrophobicContact CE1-CG2 3.36Å; F239-I279 HydrophobicContact CE2-CD1 3.77Å; F239-I279 HydrophobicContact CZ-CD1 3.81Å; F239-I279 HydrophobicContact CZ-CG2 3.7Å; F240-I279 HydrophobicContact CZ-CG2 4.43Å; L262-I279 HydrophobicContact CB-CD1 4.06Å; L263-I279 WeakPolarHBondContact O-CB 3.5Å; L263-I279 PolarHBondContact O-N 3.41Å; I279-R290 PolarHBondContact O-N 3.47Å
280	P	92.8	Very high	88.7	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.032	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-62.8	161.8	176.9	-21.9	33.2	0	0	0	113.2	F240 N282 S288 R290	F240-P280 HydrophobicContact CZ-CB 4.04Å; F240-P280 HydrophobicContact CZ-CG 4.49Å; F240-P280 WeakPolarHBondContact CZ-O 3.42Å; P280-N282 VanDerWaalsContact C-N 3.32Å; P280-N282 WeakPolarHBondContact CB-O 3.31Å; P280-S288 CarbonylContact C-O 3.5Å; P280-S288 WeakPolarHBondContact CA-O 3.31Å; P280-R290 PolarHBondContact O-NE 3.06Å
281	L	88.8	Confident	88.7	Confident	99 Å²	99	52.8 Å²	52.8	52%	0.518	27%	0.268	S	S	.	.	S	Bend	trans	-64.6	-39.3	172.4	-67.1	179.8	0	0	0	111.6	S288 R290	L281-S288 PolarHBondContact N-O 2.95Å; L281-R290 HydrophobicContact CD2-CB 4.42Å; L281-R290 HydrophobicContact CD2-CG 3.93Å
282	N	84.2	Confident	88.8	Confident	69 Å²	69	50.5 Å²	50.5	37%	0.369	26%	0.258	S	S	.	.	S	Bend	trans	-150.9	168.4	177.2	61.2	62.9	0	0	0	110.6	F240 P280 H284 N285	F240-N282 VanDerWaalsContact CZ-C 3.45Å; P280-N282 VanDerWaalsContact C-N 3.32Å; P280-N282 WeakPolarHBondContact CB-O 3.31Å; N282-H284 PolarHBondContact O-N 3.48Å; N282-H284 PolarHBondContact OD1-N 3.45Å; N282-N285 PolarHBondContact O-N 3.48Å; N282-N285 WeakPolarHBondContact OD1-CB 3.29Å; N282-N285 PolarHBondContact OD1-N 2.87Å
283	E	78.9	Confident	88.9	Confident	90 Å²	90	46.8 Å²	46.8	42%	0.421	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.1	-176.7	65.9	-175.7	160.2	0	0	114.9	F240	F240-E283 HydrophobicContact CD2-CB 3.66Å; F240-E283 HydrophobicContact CE2-CB 4.12Å; F240-E283 HydrophobicContact CG-CB 4.24Å
284	H	75	Confident	89	Confident	159 Å²	159	46.6 Å²	46.6	74%	0.736	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-14.4	-176.1	-56	-56.4	0	0	0	113.3	N282	N282-H284 PolarHBondContact O-N 3.48Å; N282-H284 PolarHBondContact OD1-N 3.45Å
285	N	74.4	Confident	88.9	Confident	71 Å²	71	53 Å²	53	38%	0.38	26%	0.262	S	S	.	.			trans	-123.5	74.9	-176	-167	-7.2	0	0	0	112.4	N282 F287 S288	N282-N285 PolarHBondContact O-N 3.48Å; N282-N285 WeakPolarHBondContact OD1-CB 3.29Å; N282-N285 PolarHBondContact OD1-N 2.87Å; N285-F287 PolarHBondContact O-N 3.41Å; N285-F287 PolarHBondContact OD1-N 2.85Å; N285-S288 VanDerWaalsContact CB-OG 3.32Å; N285-S288 WeakPolarHBondContact CB-OG 3.37Å; N285-S288 WeakPolarHBondContact ND2-CB 3.32Å; N285-S288 PolarHBondContact ND2-OG 3.08Å; N285-S288 VanDerWaalsContact ND2-OG 3.1Å; N285-S288 PolarHBondContact O-N 3.13Å; N285-S288 VanDerWaalsContact O-N 3.09Å; N285-S288 PolarHBondContact O-OG 3Å; N285-S288 VanDerWaalsContact O-OG 3.09Å; N285-S288 PolarHBondContact OD1-N 3.26Å
286	N	69.5	Low	88.8	Confident	96 Å²	96	56.3 Å²	56.3	51%	0.513	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-20.4	177.4	-68.3	-29.8	0	0	0	114	Q289	N286-Q289 PolarHBondContact O-NE2 3.29Å
287	F	73.5	Confident	88.8	Confident	143 Å²	143	56.4 Å²	56.4	63%	0.627	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-5.6	-177.8	-64.4	-73.2	0	0	0	114.4	N285 Q289	N285-F287 PolarHBondContact O-N 3.41Å; N285-F287 PolarHBondContact OD1-N 2.85Å; F287-Q289 PolarHBondContact O-NE2 3.38Å; F287-Q289 PolarHBondContact O-OE1 3.01Å
288	S	81.9	Confident	88.9	Confident	23 Å²	23	58.2 Å²	58.2	16%	0.161	29%	0.291	C	S	.	.			trans	-100.3	110.5	167.8	62	0	0	0	0	110	P280 L281 N285	P280-S288 CarbonylContact C-O 3.5Å; P280-S288 WeakPolarHBondContact CA-O 3.31Å; L281-S288 PolarHBondContact N-O 2.95Å; N285-S288 VanDerWaalsContact CB-OG 3.32Å; N285-S288 WeakPolarHBondContact CB-OG 3.37Å; N285-S288 WeakPolarHBondContact ND2-CB 3.32Å; N285-S288 PolarHBondContact ND2-OG 3.08Å; N285-S288 VanDerWaalsContact ND2-OG 3.1Å; N285-S288 PolarHBondContact O-N 3.13Å; N285-S288 VanDerWaalsContact O-N 3.09Å; N285-S288 PolarHBondContact O-OG 3Å; N285-S288 VanDerWaalsContact O-OG 3.09Å; N285-S288 PolarHBondContact OD1-N 3.26Å
289	Q	88.1	Confident	89	Confident	23 Å²	23	60.4 Å²	60.4	11%	0.107	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-95.8	145.9	179.5	-59.6	72.6	39.4	0	0	110.6	A278 N286 F287 L291 P292 F322	A278-Q289 HydrophobicContact CB-CB 3.82Å; A278-Q289 HydrophobicContact CB-CG 3.62Å; N286-Q289 PolarHBondContact O-NE2 3.29Å; F287-Q289 PolarHBondContact O-NE2 3.38Å; F287-Q289 PolarHBondContact O-OE1 3.01Å; Q289-L291 VanDerWaalsContact C-N 3.26Å; Q289-L291 PolarHBondContact O-N 3.47Å; Q289-P292 HydrophobicContact CB-CB 4.08Å; Q289-P292 HydrophobicContact CG-CB 4.37Å; Q289-F322 HydrophobicContact CG-CB 3.94Å
290	R	92.4	Very high	89.1	Confident	60 Å²	60	61.8 Å²	61.8	23%	0.226	32%	0.321	C	S	.	.	S	Bend	trans	-56.8	-44.6	169.4	-67.3	171.8	-175.8	-156.1	-9.8	111.4	E243 L262 L263 I279 P280 L281	E243-R290 IonicContact OE1-CZ 2.66Å; E243-R290 VanDerWaalsContact OE1-CZ 3.27Å; E243-R290 IonicContact OE1-NH1 3.7Å; E243-R290 PolarHBondContact OE1-NH1 3.31Å; E243-R290 IonicContact OE1-NH2 3.27Å; E243-R290 PolarHBondContact OE1-NH2 2.96Å; E243-R290 IonicContact OE2-CZ 3.67Å; E243-R290 IonicContact OE2-NH1 2.98Å; E243-R290 IonicContact OE2-NH2 3.84Å; E243-R290 PolarHBondContact OE2-NH2 3.35Å; L262-R290 WeakPolarHBondContact O-CD 3.49Å; L262-R290 PolarHBondContact O-NH1 2.78Å; L263-R290 HydrophobicContact CD2-CB 3.78Å; I279-R290 PolarHBondContact O-N 3.47Å; P280-R290 PolarHBondContact O-NE 3.06Å; L281-R290 HydrophobicContact CD2-CB 4.42Å; L281-R290 HydrophobicContact CD2-CG 3.93Å
291	L	94.7	Very high	89.4	Confident	20 Å²	20	68.7 Å²	68.7	11%	0.105	35%	0.346	C	S	.	.	S	Bend	trans	-143.9	99.3	171.2	-177	57.9	0	0	0	109.5	L263 F264 A278 Q289 T339 I340 K343	L263-L291 HydrophobicContact CD1-CB 4.4Å; L263-L291 HydrophobicContact CD1-CD2 3.86Å; L263-L291 HydrophobicContact CD2-CB 3.9Å; F264-L291 WeakPolarHBondContact CE1-O 3.43Å; F264-L291 HydrophobicContact CE2-CD2 4.04Å; F264-L291 HydrophobicContact CZ-CB 4.12Å; F264-L291 HydrophobicContact CZ-CD2 3.97Å; F264-L291 HydrophobicContact CZ-CG 3.98Å; F264-L291 WeakPolarHBondContact CZ-O 3.44Å; A278-L291 WeakPolarHBondContact CB-O 3.34Å; Q289-L291 VanDerWaalsContact C-N 3.26Å; Q289-L291 PolarHBondContact O-N 3.47Å; L291-T339 HydrophobicContact CD1-CG2 4.45Å; L291-T339 HydrophobicContact CD2-CG2 3.88Å; L291-T339 HydrophobicContact CG-CG2 3.85Å; L291-I340 HydrophobicContact CD2-CG1 4.18Å; L291-K343 HydrophobicContact CD1-CB 3.92Å; L291-K343 HydrophobicContact CD1-CD 4.17Å; L291-K343 HydrophobicContact CD1-CG 3.91Å; L291-K343 HydrophobicContact CD2-CB 4.17Å
292	P	96	Very high	89.8	Confident	38 Å²	38	68.2 Å²	68.2	25%	0.247	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-68.1	153.6	174.4	29.6	-34.5	0	0	0	110.5	Q289	Q289-P292 HydrophobicContact CB-CB 4.08Å; Q289-P292 HydrophobicContact CG-CB 4.37Å
293	L	97.8	Very high	90.5	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-58.2	148.4	172.2	-62.6	173	0	0	0	110.7	F264 I276 W297 R298 V317 G321 T339	F264-L293 HydrophobicContact CE1-CD2 4.05Å; I276-L293 HydrophobicContact CD1-CD2 3.93Å; I276-L293 HydrophobicContact CG1-CD2 4.48Å; I276-L293 HydrophobicContact CG2-CD1 4.25Å; L293-W297 HydrophobicContact CB-CE3 4.4Å; L293-W297 HydrophobicContact CD2-CE3 4.47Å; L293-W297 HydrophobicContact CD2-CZ3 4.22Å; L293-R298 PolarHBondContact O-NE 2.8Å; L293-R298 PolarHBondContact O-NH2 3.26Å; L293-V317 HydrophobicContact CB-CG1 4.03Å; L293-V317 HydrophobicContact CD1-CG1 3.71Å; L293-V317 HydrophobicContact CD1-CG2 4.05Å; L293-G321 WeakPolarHBondContact CB-O 3.31Å; L293-G321 WeakPolarHBondContact CG-O 3.39Å; L293-G321 PolarHBondContact N-O 3.3Å; L293-T339 HydrophobicContact CD2-CG2 4.47Å
294	P	97.6	Very high	91.4	Very high	19 Å²	19	72.6 Å²	72.6	12%	0.123	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-53.3	140.5	-173.3	-28.4	36.9	0	0	0	112.9	S296 W297 R298 T339 M342	P294-S296 PolarHBondContact O-N 3.4Å; P294-W297 HydrophobicContact CB-CD2 4.06Å; P294-W297 HydrophobicContact CB-CG 4.11Å; P294-W297 VanDerWaalsContact CD-CE3 3.47Å; P294-W297 HydrophobicContact CG-CD2 3.83Å; P294-W297 HydrophobicContact CG-CE3 4.07Å; P294-W297 HydrophobicContact CG-CG 4.4Å; P294-W297 HydrophobicContact CG-CH2 4.01Å; P294-W297 HydrophobicContact CG-CZ2 3.81Å; P294-W297 HydrophobicContact CG-CZ3 4.14Å; P294-W297 WeakPolarHBondContact O-CB 3.15Å; P294-W297 PolarHBondContact O-N 2.9Å; P294-R298 WeakPolarHBondContact O-CG 3.44Å; P294-T339 WeakPolarHBondContact CD-OG1 3.08Å; P294-T339 HydrophobicContact CG-CG2 4.14Å; P294-M342 HydrophobicContact CB-SD 4.01Å; P294-M342 HydrophobicContact CG-SD 3.59Å; P294-M342 VanDerWaalsContact CG-SD 3.59Å
295	E	96.8	Very high	92.6	Very high	156 Å²	156	65 Å²	65	73%	0.729	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-56.5	-37.7	-178.1	-172.9	174.5	-175.3	0	0	112.6	W297 R298	E295-W297 PolarHBondContact O-N 2.9Å; E295-W297 VanDerWaalsContact O-N 3.12Å; E295-R298 PolarHBondContact O-N 2.68Å; E295-R298 VanDerWaalsContact O-N 3.16Å
296	S	97.2	Very high	93.7	Very high	71 Å²	71	61.9 Å²	61.9	50%	0.497	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-60.8	-19.8	176.5	54.9	0	0	0	0	114.2	P294 L300	P294-S296 PolarHBondContact O-N 3.4Å; S296-L300 WeakPolarHBondContact O-CD1 3.45Å
297	W	98.3	Very high	95.1	Very high	1 Å²	1	63.2 Å²	63.2	0%	0.004	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-92.9	-22	-179.7	-57.4	0.1	0	0	0	112.4	L293 P294 E295 G299 L300 L305 V309 V317 M335 L338 T339 M342	L293-W297 HydrophobicContact CB-CE3 4.4Å; L293-W297 HydrophobicContact CD2-CE3 4.47Å; L293-W297 HydrophobicContact CD2-CZ3 4.22Å; P294-W297 HydrophobicContact CB-CD2 4.06Å; P294-W297 HydrophobicContact CB-CG 4.11Å; P294-W297 VanDerWaalsContact CD-CE3 3.47Å; P294-W297 HydrophobicContact CG-CD2 3.83Å; P294-W297 HydrophobicContact CG-CE3 4.07Å; P294-W297 HydrophobicContact CG-CG 4.4Å; P294-W297 HydrophobicContact CG-CH2 4.01Å; P294-W297 HydrophobicContact CG-CZ2 3.81Å; P294-W297 HydrophobicContact CG-CZ3 4.14Å; P294-W297 WeakPolarHBondContact O-CB 3.15Å; P294-W297 PolarHBondContact O-N 2.9Å; E295-W297 PolarHBondContact O-N 2.9Å; E295-W297 VanDerWaalsContact O-N 3.12Å; W297-G299 PolarHBondContact O-N 3.25Å; W297-L300 WeakPolarHBondContact O-CB 3.42Å; W297-L300 WeakPolarHBondContact O-CG 3.22Å; W297-L300 PolarHBondContact O-N 2.83Å; W297-L305 HydrophobicContact CB-CD1 3.78Å; W297-L305 HydrophobicContact CG-CD1 4.23Å; W297-V309 HydrophobicContact CD2-CG2 3.71Å; W297-V309 HydrophobicContact CE3-CG2 4.2Å; W297-V309 HydrophobicContact CG-CG2 3.92Å; W297-V309 HydrophobicContact CH2-CG1 4.25Å; W297-V309 HydrophobicContact CZ2-CG1 4.01Å; W297-V309 HydrophobicContact CZ2-CG2 4.27Å; W297-V317 HydrophobicContact CB-CB 4.36Å; W297-V317 HydrophobicContact CB-CG1 4.37Å; W297-V317 HydrophobicContact CB-CG2 4.15Å; W297-V317 WeakPolarHBondContact O-CB 3.11Å; W297-M335 HydrophobicContact CE3-CE 3.88Å; W297-M335 HydrophobicContact CH2-CB 4.4Å; W297-M335 WeakPolarHBondContact CH2-O 3.35Å; W297-M335 HydrophobicContact CZ3-CB 3.98Å; W297-M335 HydrophobicContact CZ3-CE 3.98Å; W297-M335 HydrophobicContact CZ3-CG 4.32Å; W297-L338 HydrophobicContact CH2-CB 3.84Å; W297-L338 HydrophobicContact CZ2-CB 4.12Å; W297-L338 HydrophobicContact CZ2-CD1 4.5Å; W297-T339 WeakPolarHBondContact CH2-OG1 3.44Å; W297-T339 WeakPolarHBondContact CZ3-OG1 3.38Å; W297-M342 HydrophobicContact CZ2-CE 3.95Å; W297-M342 HydrophobicContact CZ2-SD 4.21Å
298	R	97.7	Very high	96.3	Very high	77 Å²	77	60.8 Å²	60.8	29%	0.291	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	132	-165.6	-66.7	178.3	-165.1	169.8	3.2	112.1	L293 P294 E295 L300 V317 S319	L293-R298 PolarHBondContact O-NE 2.8Å; L293-R298 PolarHBondContact O-NH2 3.26Å; P294-R298 WeakPolarHBondContact O-CG 3.44Å; E295-R298 PolarHBondContact O-N 2.68Å; E295-R298 VanDerWaalsContact O-N 3.16Å; R298-L300 PolarHBondContact O-N 3.25Å; R298-V317 HydrophobicContact CG-CG1 4.35Å; R298-S319 WeakPolarHBondContact CB-O 3.39Å; R298-S319 VanDerWaalsContact CD-O 3.28Å; R298-S319 WeakPolarHBondContact CD-O 3.33Å
299	G	97.9	Very high	97	Very high	48 Å²	48	60.3 Å²	60.3	50%	0.495	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-1.9	-179.3	0	0	0	0	0	114.3	W297 V317	W297-G299 PolarHBondContact O-N 3.25Å; G299-V317 WeakPolarHBondContact CA-O 3.49Å; G299-V317 PolarHBondContact N-O 3.25Å
300	L	98.3	Very high	97.4	Very high	29 Å²	29	62.1 Å²	62.1	15%	0.152	33%	0.331	C	S	.	.			trans	-85.3	157	176.6	-53.1	-171.3	0	0	0	111.6	S296 W297 R298 Q304 L305 I308 F316 V317	S296-L300 WeakPolarHBondContact O-CD1 3.45Å; W297-L300 WeakPolarHBondContact O-CB 3.42Å; W297-L300 WeakPolarHBondContact O-CG 3.22Å; W297-L300 PolarHBondContact O-N 2.83Å; R298-L300 PolarHBondContact O-N 3.25Å; L300-Q304 HydrophobicContact CD1-CG 4.4Å; L300-Q304 HydrophobicContact CD2-CG 4.29Å; L300-L305 HydrophobicContact CB-CB 3.86Å; L300-L305 HydrophobicContact CB-CD1 4.07Å; L300-I308 HydrophobicContact CD1-CB 4.13Å; L300-I308 HydrophobicContact CD1-CG1 3.83Å; L300-I308 HydrophobicContact CD1-CG2 4.3Å; L300-F316 WeakPolarHBondContact O-CA 3.47Å; L300-V317 PolarHBondContact O-N 3.16Å; L300-V317 VanDerWaalsContact O-N 3.14Å
301	R	98.5	Very high	97.7	Very high	151 Å²	151	60.1 Å²	60.1	57%	0.57	33%	0.325	S	S	*	.	B	Isolated β-bridge	trans	-138.3	156.8	-178.2	-65.9	-178.9	171.2	-104.1	-0.5	111.8	E303 Q304 L305 V315 F316	R301-E303 PolarHBondContact O-N 3.3Å; R301-Q304 WeakPolarHBondContact O-CB 3.48Å; R301-Q304 PolarHBondContact O-N 2.9Å; R301-L305 PolarHBondContact O-N 3.07Å; R301-V315 CarbonylContact C-O 3.57Å; R301-V315 VanDerWaalsContact CA-O 3.29Å; R301-V315 WeakPolarHBondContact CA-O 3.44Å; R301-F316 HydrophobicContact CG-CB 3.78Å
302	D	98.2	Very high	97.8	Very high	88 Å²	88	63.6 Å²	63.6	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	47.4	-129.9	165.8	-53.2	-56.8	0	0	0	113.4	Q304 L305 S306 C314 V315	D302-Q304 VanDerWaalsContact C-N 3.3Å; D302-Q304 PolarHBondContact O-N 3.28Å; D302-L305 PolarHBondContact O-N 2.81Å; D302-S306 WeakPolarHBondContact O-CB 3.4Å; D302-S306 PolarHBondContact O-N 3.29Å; D302-S306 PolarHBondContact O-OG 2.68Å; D302-C314 VanDerWaalsContact CA-O 3.29Å; D302-C314 WeakPolarHBondContact CA-O 3.3Å; D302-V315 PolarHBondContact N-O 3.24Å
303	E	98.3	Very high	97.9	Very high	126 Å²	126	64.8 Å²	64.8	59%	0.589	35%	0.353	S	S	*	.	H	α-helix	trans	-61	-35.6	-177.9	-66.3	-56.9	140	0	0	113	R301 L305 S306 N307	R301-E303 PolarHBondContact O-N 3.3Å; E303-L305 VanDerWaalsContact C-N 3.35Å; E303-L305 PolarHBondContact O-N 3.21Å; E303-S306 PolarHBondContact O-N 2.85Å; E303-N307 WeakPolarHBondContact O-CB 3.42Å; E303-N307 PolarHBondContact O-N 3.02Å; E303-N307 PolarHBondContact O-ND2 3.13Å
304	Q	98.4	Very high	98	Very high	125 Å²	125	64.9 Å²	64.9	58%	0.584	35%	0.354	S	S	*	.	H	α-helix	trans	-63.9	-44.1	178.2	-173.2	-178.2	1.3	0	0	110.8	L300 R301 D302 I308	L300-Q304 HydrophobicContact CD1-CG 4.4Å; L300-Q304 HydrophobicContact CD2-CG 4.29Å; R301-Q304 WeakPolarHBondContact O-CB 3.48Å; R301-Q304 PolarHBondContact O-N 2.9Å; D302-Q304 VanDerWaalsContact C-N 3.3Å; D302-Q304 PolarHBondContact O-N 3.28Å; Q304-I308 VanDerWaalsContact O-CG1 3.31Å; Q304-I308 WeakPolarHBondContact O-CG1 3.38Å; Q304-I308 PolarHBondContact O-N 3.31Å
305	L	98.7	Very high	98	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66.3	-45.6	174.7	177.3	61.7	0	0	0	110.8	W297 L300 R301 D302 E303 N307 I308 V309 C314 V317	W297-L305 HydrophobicContact CB-CD1 3.78Å; W297-L305 HydrophobicContact CG-CD1 4.23Å; L300-L305 HydrophobicContact CB-CB 3.86Å; L300-L305 HydrophobicContact CB-CD1 4.07Å; R301-L305 PolarHBondContact O-N 3.07Å; D302-L305 PolarHBondContact O-N 2.81Å; E303-L305 VanDerWaalsContact C-N 3.35Å; E303-L305 PolarHBondContact O-N 3.21Å; L305-N307 VanDerWaalsContact C-N 3.29Å; L305-N307 PolarHBondContact O-N 3.05Å; L305-I308 PolarHBondContact O-N 2.86Å; L305-I308 VanDerWaalsContact O-N 3.11Å; L305-V309 HydrophobicContact CD1-CG2 3.49Å; L305-V309 VanDerWaalsContact CD1-CG2 3.49Å; L305-V309 HydrophobicContact CG-CG2 3.95Å; L305-V309 WeakPolarHBondContact O-CB 3.42Å; L305-V309 WeakPolarHBondContact O-CG2 3.48Å; L305-V309 PolarHBondContact O-N 2.87Å; L305-C314 HydrophobicContact CB-CB 4.14Å; L305-C314 HydrophobicContact CD2-CB 3.57Å; L305-C314 HydrophobicContact CG-CB 3.58Å; L305-V317 HydrophobicContact CD1-CG2 3.99Å; L305-V317 HydrophobicContact CD2-CG2 3.88Å
306	S	98.7	Very high	98.1	Very high	6 Å²	6	59.9 Å²	59.9	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-58.1	-42.4	-178.2	-59.7	0	0	0	0	111.8	D302 E303 G310 L311 C314	D302-S306 WeakPolarHBondContact O-CB 3.4Å; D302-S306 PolarHBondContact O-N 3.29Å; D302-S306 PolarHBondContact O-OG 2.68Å; E303-S306 PolarHBondContact O-N 2.85Å; S306-G310 WeakPolarHBondContact O-CA 3.31Å; S306-G310 PolarHBondContact O-N 2.98Å; S306-L311 WeakPolarHBondContact CA-O 3.49Å; S306-L311 WeakPolarHBondContact CB-O 3.44Å; S306-L311 PolarHBondContact O-N 3.43Å; S306-L311 VanDerWaalsContact O-N 3.13Å; S306-L311 PolarHBondContact OG-O 3.17Å; S306-C314 WeakPolarHBondContact OG-CB 3.29Å; S306-C314 PolarHBondContact OG-N 3.14Å; S306-C314 VanDerWaalsContact OG-N 3.14Å
307	N	98.2	Very high	98.1	Very high	123 Å²	123	56.7 Å²	56.7	66%	0.658	31%	0.308	S	S	*	.	H	α-helix	trans	-64.1	-41.2	175.8	-72.9	-35.2	0	0	0	113	E303 L305	E303-N307 WeakPolarHBondContact O-CB 3.42Å; E303-N307 PolarHBondContact O-N 3.02Å; E303-N307 PolarHBondContact O-ND2 3.13Å; L305-N307 VanDerWaalsContact C-N 3.29Å; L305-N307 PolarHBondContact O-N 3.05Å
308	I	97.8	Very high	98.1	Very high	93 Å²	93	59.7 Å²	59.7	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-74.7	-37.1	-179.2	-66.5	-66.1	0	0	0	112	L300 Q304 L305 G310	L300-I308 HydrophobicContact CD1-CB 4.13Å; L300-I308 HydrophobicContact CD1-CG1 3.83Å; L300-I308 HydrophobicContact CD1-CG2 4.3Å; Q304-I308 VanDerWaalsContact O-CG1 3.31Å; Q304-I308 WeakPolarHBondContact O-CG1 3.38Å; Q304-I308 PolarHBondContact O-N 3.31Å; L305-I308 PolarHBondContact O-N 2.86Å; L305-I308 VanDerWaalsContact O-N 3.11Å; I308-G310 VanDerWaalsContact C-N 3.33Å
309	V	97.5	Very high	98.1	Very high	12 Å²	12	59.8 Å²	59.8	7%	0.073	33%	0.334	C	S	.	.	H	α-helix	trans	-73.9	-30.4	176.8	-179.5	0	0	0	0	110.7	W297 L305 L311 M335 L338	W297-V309 HydrophobicContact CD2-CG2 3.71Å; W297-V309 HydrophobicContact CE3-CG2 4.2Å; W297-V309 HydrophobicContact CG-CG2 3.92Å; W297-V309 HydrophobicContact CH2-CG1 4.25Å; W297-V309 HydrophobicContact CZ2-CG1 4.01Å; W297-V309 HydrophobicContact CZ2-CG2 4.27Å; L305-V309 HydrophobicContact CD1-CG2 3.49Å; L305-V309 VanDerWaalsContact CD1-CG2 3.49Å; L305-V309 HydrophobicContact CG-CG2 3.95Å; L305-V309 WeakPolarHBondContact O-CB 3.42Å; L305-V309 WeakPolarHBondContact O-CG2 3.48Å; L305-V309 PolarHBondContact O-N 2.87Å; V309-L311 HydrophobicContact CB-CB 4.49Å; V309-L311 HydrophobicContact CG1-CB 3.88Å; V309-L311 HydrophobicContact CG1-CD1 3.66Å; V309-L311 HydrophobicContact CG1-CG 3.76Å; V309-M335 HydrophobicContact CG1-CG 4.29Å; V309-L338 HydrophobicContact CG1-CD1 3.99Å
310	G	97.6	Very high	97.9	Very high	61 Å²	61	59.9 Å²	59.9	63%	0.629	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	23.5	-170.1	0	0	0	0	0	112.8	S306 I308	S306-G310 WeakPolarHBondContact O-CA 3.31Å; S306-G310 PolarHBondContact O-N 2.98Å; I308-G310 VanDerWaalsContact C-N 3.33Å
311	L	97.1	Very high	97.8	Very high	18 Å²	18	58.5 Å²	58.5	9%	0.094	32%	0.318	C	S	.	.			trans	-130.4	125.3	179.5	-65.8	177.6	0	0	0	109.8	S306 V309 C314 Q334 M335 L338	S306-L311 WeakPolarHBondContact CA-O 3.49Å; S306-L311 WeakPolarHBondContact CB-O 3.44Å; S306-L311 PolarHBondContact O-N 3.43Å; S306-L311 VanDerWaalsContact O-N 3.13Å; S306-L311 PolarHBondContact OG-O 3.17Å; V309-L311 HydrophobicContact CB-CB 4.49Å; V309-L311 HydrophobicContact CG1-CB 3.88Å; V309-L311 HydrophobicContact CG1-CD1 3.66Å; V309-L311 HydrophobicContact CG1-CG 3.76Å; L311-C314 PolarHBondContact O-SG 3Å; L311-Q334 HydrophobicContact CD1-CB 3.55Å; L311-Q334 HydrophobicContact CD2-CB 4.32Å; L311-M335 HydrophobicContact CD1-CG 4.07Å; L311-L338 HydrophobicContact CD1-CD1 3.73Å; L311-L338 HydrophobicContact CG-CD1 4.14Å
312	P	98	Very high	97.7	Very high	94 Å²	94	53.5 Å²	53.5	61%	0.61	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	160.5	175.9	30.9	-35.5	0	0	0	110.9	C314 H326	P312-C314 VanDerWaalsContact C-N 3.3Å; P312-C314 PolarHBondContact O-N 2.68Å; P312-H326 PolarHBondContact O-CE1 2.95Å; P312-H326 PolarHBondContact O-NE2 3.11Å
313	D	98.2	Very high	97.7	Very high	62 Å²	62	50.4 Å²	50.4	33%	0.332	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	22.1	173.4	-62.7	-50	0	0	0	116.1	K327	D313-K327 HydrophobicContact CB-CB 4.01Å; D313-K327 HydrophobicContact CB-CD 3.78Å; D313-K327 HydrophobicContact CB-CG 3.98Å; D313-K327 WeakPolarHBondContact O-CG 3.5Å; D313-K327 PolarHBondContact O-N 3.14Å; D313-K327 VanDerWaalsContact O-N 3.09Å; D313-K327 WeakPolarHBondContact OD1-CD 3.39Å; D313-K327 WeakPolarHBondContact OD1-CE 3.29Å; D313-K327 IonicContact OD1-NZ 2.73Å; D313-K327 PolarHBondContact OD1-NZ 3.19Å
314	C	98.7	Very high	97.7	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.014	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	139.9	165	-63.6	0	0	0	0	109.8	D302 L305 S306 L311 P312	D302-C314 VanDerWaalsContact CA-O 3.29Å; D302-C314 WeakPolarHBondContact CA-O 3.3Å; L305-C314 HydrophobicContact CB-CB 4.14Å; L305-C314 HydrophobicContact CD2-CB 3.57Å; L305-C314 HydrophobicContact CG-CB 3.58Å; S306-C314 WeakPolarHBondContact OG-CB 3.29Å; S306-C314 PolarHBondContact OG-N 3.14Å; S306-C314 VanDerWaalsContact OG-N 3.14Å; L311-C314 PolarHBondContact O-SG 3Å; P312-C314 VanDerWaalsContact C-N 3.3Å; P312-C314 PolarHBondContact O-N 2.68Å
315	V	98.5	Very high	97.7	Very high	31 Å²	31	38.5 Å²	38.5	19%	0.188	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-57.7	-177.7	-177	0	0	0	0	110.9	R301 D302 V325 K327	R301-V315 CarbonylContact C-O 3.57Å; R301-V315 VanDerWaalsContact CA-O 3.29Å; R301-V315 WeakPolarHBondContact CA-O 3.44Å; D302-V315 PolarHBondContact N-O 3.24Å; V315-V325 HydrophobicContact CB-CB 4.06Å; V315-V325 HydrophobicContact CB-CG1 3.87Å; V315-V325 WeakPolarHBondContact CB-O 3.22Å; V315-V325 HydrophobicContact CG1-CG1 4.28Å; V315-V325 HydrophobicContact CG2-CG1 4.03Å; V315-V325 PolarHBondContact N-O 3.36Å; V315-K327 HydrophobicContact CG2-CG 3.89Å
316	F	98.2	Very high	97.7	Very high	40 Å²	40	38.9 Å²	38.9	18%	0.175	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	162.3	173.7	79.9	-84.7	0	0	0	112.8	L300 R301 L323 G324 V325	L300-F316 WeakPolarHBondContact O-CA 3.47Å; R301-F316 HydrophobicContact CG-CB 3.78Å; F316-L323 HydrophobicContact CE1-CD2 4.32Å; F316-L323 HydrophobicContact CE2-CD2 3.64Å; F316-L323 HydrophobicContact CZ-CD2 3.38Å; F316-G324 CarbonylContact O-C 3.6Å; F316-G324 VanDerWaalsContact O-CA 3.26Å; F316-G324 WeakPolarHBondContact O-CA 3.34Å; F316-V325 HydrophobicContact CD1-CB 3.81Å; F316-V325 HydrophobicContact CD1-CG2 3.85Å; F316-V325 HydrophobicContact CE1-CB 3.75Å; F316-V325 HydrophobicContact CE1-CG2 3.25Å; F316-V325 HydrophobicContact CZ-CG2 3.78Å; F316-V325 PolarHBondContact N-O 3.07Å; F316-V325 PolarHBondContact O-N 3.29Å
317	V	98.6	Very high	97.7	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.018	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132	164.5	173.3	0	0	0	0	109.5	L293 W297 R298 G299 L300 L305 M335	L293-V317 HydrophobicContact CB-CG1 4.03Å; L293-V317 HydrophobicContact CD1-CG1 3.71Å; L293-V317 HydrophobicContact CD1-CG2 4.05Å; W297-V317 HydrophobicContact CB-CB 4.36Å; W297-V317 HydrophobicContact CB-CG1 4.37Å; W297-V317 HydrophobicContact CB-CG2 4.15Å; W297-V317 WeakPolarHBondContact O-CB 3.11Å; R298-V317 HydrophobicContact CG-CG1 4.35Å; G299-V317 WeakPolarHBondContact CA-O 3.49Å; G299-V317 PolarHBondContact N-O 3.25Å; L300-V317 PolarHBondContact O-N 3.16Å; L300-V317 VanDerWaalsContact O-N 3.14Å; L305-V317 HydrophobicContact CD1-CG2 3.99Å; L305-V317 HydrophobicContact CD2-CG2 3.88Å; V317-M335 HydrophobicContact CG2-CE 3.76Å
318	H	97.6	Very high	97.7	Very high	65 Å²	65	40.5 Å²	40.5	30%	0.301	24%	0.235	S	C	.	.			trans	-60.3	146.8	177	-171.5	-91.9	0	0	0	111	T320 G321 F322 L323	H318-T320 PolarHBondContact CE1-OG1 3.21Å; H318-T320 PolarHBondContact ND1-N 2.91Å; H318-T320 PolarHBondContact ND1-OG1 3.09Å; H318-T320 PolarHBondContact O-N 2.94Å; H318-T320 VanDerWaalsContact O-N 3.11Å; H318-G321 PolarHBondContact O-N 2.9Å; H318-F322 HydrophobicContact CB-CD1 4.39Å; H318-F322 HydrophobicContact CB-CE1 4.13Å; H318-F322 HydrophobicContact CB-CZ 4.49Å; H318-F322 AromaticContact CD2-CE1 3.77Å; H318-F322 AromaticContact CE1-CE1 3.53Å; H318-F322 AromaticContact CG-CD1 3.96Å; H318-F322 AromaticContact CG-CE1 3.45Å; H318-F322 VanDerWaalsContact CG-CE1 3.45Å; H318-F322 AromaticContact ND1-CD1 3.54Å; H318-F322 AromaticContact ND1-CE1 3.27Å; H318-F322 VanDerWaalsContact ND1-CE1 3.27Å; H318-F322 WeakPolarHBondContact ND1-CE1 3.33Å; H318-F322 AromaticContact NE2-CE1 3.82Å; H318-L323 PolarHBondContact N-O 2.84Å
319	S	96.9	Very high	97.7	Very high	79 Å²	79	40.7 Å²	40.7	55%	0.552	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.6	-174.4	55.7	0	0	0	0	114.7	R298	R298-S319 WeakPolarHBondContact CB-O 3.39Å; R298-S319 VanDerWaalsContact CD-O 3.28Å; R298-S319 WeakPolarHBondContact CD-O 3.33Å
320	T	94.6	Very high	97.7	Very high	49 Å²	49	44.1 Å²	44.1	30%	0.301	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.9	174.7	63	0	0	0	0	113.4	H318 F322	H318-T320 PolarHBondContact CE1-OG1 3.21Å; H318-T320 PolarHBondContact ND1-N 2.91Å; H318-T320 PolarHBondContact ND1-OG1 3.09Å; H318-T320 PolarHBondContact O-N 2.94Å; H318-T320 VanDerWaalsContact O-N 3.11Å; T320-F322 WeakPolarHBondContact OG1-CD1 3.21Å
321	G	96.4	Very high	97.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	79.4	8.6	180	0	0	0	0	0	115.7	L293 H318 L323	L293-G321 WeakPolarHBondContact CB-O 3.31Å; L293-G321 WeakPolarHBondContact CG-O 3.39Å; L293-G321 PolarHBondContact N-O 3.3Å; H318-G321 PolarHBondContact O-N 2.9Å; G321-L323 VanDerWaalsContact C-N 3.31Å; G321-L323 PolarHBondContact O-N 2.81Å
322	F	96.1	Very high	97.8	Very high	47 Å²	47	40.5 Å²	40.5	21%	0.206	22%	0.215	C	C	.	.	S	Bend	trans	-73.1	-22.5	178.7	81.8	-105.4	0	0	0	113.8	Q277 A278 Q289 H318 T320	Q277-F322 WeakPolarHBondContact CA-O 3.35Å; A278-F322 PolarHBondContact N-O 2.81Å; Q289-F322 HydrophobicContact CG-CB 3.94Å; H318-F322 HydrophobicContact CB-CD1 4.39Å; H318-F322 HydrophobicContact CB-CE1 4.13Å; H318-F322 HydrophobicContact CB-CZ 4.49Å; H318-F322 AromaticContact CD2-CE1 3.77Å; H318-F322 AromaticContact CE1-CE1 3.53Å; H318-F322 AromaticContact CG-CD1 3.96Å; H318-F322 AromaticContact CG-CE1 3.45Å; H318-F322 VanDerWaalsContact CG-CE1 3.45Å; H318-F322 AromaticContact ND1-CD1 3.54Å; H318-F322 AromaticContact ND1-CE1 3.27Å; H318-F322 VanDerWaalsContact ND1-CE1 3.27Å; H318-F322 WeakPolarHBondContact ND1-CE1 3.33Å; H318-F322 AromaticContact NE2-CE1 3.82Å; T320-F322 WeakPolarHBondContact OG1-CD1 3.21Å
323	L	97.2	Very high	97.8	Very high	22 Å²	22	36.2 Å²	36.2	12%	0.115	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	139.9	-173.8	-179.7	150.8	0	0	0	111.1	T275 I276 F316 H318 G321 V325	T275-L323 HydrophobicContact CG2-CD1 3.68Å; T275-L323 HydrophobicContact CG2-CD2 4.32Å; T275-L323 HydrophobicContact CG2-CG 3.68Å; I276-L323 CarbonylContact O-C 3.59Å; I276-L323 WeakPolarHBondContact O-CA 3.47Å; F316-L323 HydrophobicContact CE1-CD2 4.32Å; F316-L323 HydrophobicContact CE2-CD2 3.64Å; F316-L323 HydrophobicContact CZ-CD2 3.38Å; H318-L323 PolarHBondContact N-O 2.84Å; G321-L323 VanDerWaalsContact C-N 3.31Å; G321-L323 PolarHBondContact O-N 2.81Å; L323-V325 HydrophobicContact CD2-CG2 3.92Å
324	G	98.2	Very high	97.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	160.7	169.8	0	0	0	0	0	111.2	T275 I276 F316	T275-G324 WeakPolarHBondContact CA-O 3.47Å; I276-G324 WeakPolarHBondContact CG2-O 3.48Å; I276-G324 PolarHBondContact N-O 2.74Å; I276-G324 PolarHBondContact O-N 3.22Å; F316-G324 CarbonylContact O-C 3.6Å; F316-G324 VanDerWaalsContact O-CA 3.26Å; F316-G324 WeakPolarHBondContact O-CA 3.34Å
325	V	98.6	Very high	97.8	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.9	179	179.6	0	0	0	0	110.5	W274 V315 F316 L323	W274-V325 CarbonylContact O-C 3.52Å; W274-V325 VanDerWaalsContact O-CA 3.23Å; W274-V325 WeakPolarHBondContact O-CA 3.26Å; W274-V325 WeakPolarHBondContact O-CG1 3.35Å; V315-V325 HydrophobicContact CB-CB 4.06Å; V315-V325 HydrophobicContact CB-CG1 3.87Å; V315-V325 WeakPolarHBondContact CB-O 3.22Å; V315-V325 HydrophobicContact CG1-CG1 4.28Å; V315-V325 HydrophobicContact CG2-CG1 4.03Å; V315-V325 PolarHBondContact N-O 3.36Å; F316-V325 HydrophobicContact CD1-CB 3.81Å; F316-V325 HydrophobicContact CD1-CG2 3.85Å; F316-V325 HydrophobicContact CE1-CB 3.75Å; F316-V325 HydrophobicContact CE1-CG2 3.25Å; F316-V325 HydrophobicContact CZ-CG2 3.78Å; F316-V325 PolarHBondContact N-O 3.07Å; F316-V325 PolarHBondContact O-N 3.29Å; L323-V325 HydrophobicContact CD2-CG2 3.92Å
326	H	98.7	Very high	97.8	Very high	7 Å²	7	35 Å²	35	3%	0.032	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	154.7	173.9	-159.6	-80.4	0	0	0	109.8	W274 P312 T328 V332 M335	W274-H326 PolarHBondContact N-O 2.88Å; W274-H326 PolarHBondContact O-N 3.4Å; P312-H326 PolarHBondContact O-CE1 2.95Å; P312-H326 PolarHBondContact O-NE2 3.11Å; H326-T328 PolarHBondContact CE1-OG1 3.34Å; H326-T328 PolarHBondContact ND1-N 2.78Å; H326-T328 PolarHBondContact ND1-OG1 3.32Å; H326-T328 VanDerWaalsContact ND1-OG1 3.14Å; H326-T328 PolarHBondContact O-N 3.39Å; H326-V332 HydrophobicContact CB-CB 4.47Å; H326-V332 HydrophobicContact CB-CG1 3.52Å; H326-M335 HydrophobicContact CB-SD 4.24Å
327	K	98.4	Very high	97.8	Very high	107 Å²	107	37.9 Å²	37.9	47%	0.465	19%	0.186	S	C	.	.	S	Bend	trans	-68.3	-14.4	176.1	-62.3	-175.4	-163	159.5	0	114.2	D313 V315	D313-K327 HydrophobicContact CB-CB 4.01Å; D313-K327 HydrophobicContact CB-CD 3.78Å; D313-K327 HydrophobicContact CB-CG 3.98Å; D313-K327 WeakPolarHBondContact O-CG 3.5Å; D313-K327 PolarHBondContact O-N 3.14Å; D313-K327 VanDerWaalsContact O-N 3.09Å; D313-K327 WeakPolarHBondContact OD1-CD 3.39Å; D313-K327 WeakPolarHBondContact OD1-CE 3.29Å; D313-K327 IonicContact OD1-NZ 2.73Å; D313-K327 PolarHBondContact OD1-NZ 3.19Å; V315-K327 HydrophobicContact CG2-CG 3.89Å
328	T	98.2	Very high	97.7	Very high	57 Å²	57	40.2 Å²	40.2	35%	0.35	20%	0.199	S	C	.	.	S	Bend	trans	-138.4	152.1	-168.5	68.8	0	0	0	0	111.9	W274 H326 D330 G331 V332	W274-T328 VanDerWaalsContact CD1-C 3.45Å; H326-T328 PolarHBondContact CE1-OG1 3.34Å; H326-T328 PolarHBondContact ND1-N 2.78Å; H326-T328 PolarHBondContact ND1-OG1 3.32Å; H326-T328 VanDerWaalsContact ND1-OG1 3.14Å; H326-T328 PolarHBondContact O-N 3.39Å; T328-D330 VanDerWaalsContact C-N 3.33Å; T328-D330 PolarHBondContact O-N 3.42Å; T328-G331 PolarHBondContact O-N 3.22Å; T328-G331 PolarHBondContact OG1-N 3.33Å; T328-G331 VanDerWaalsContact OG1-N 3.11Å; T328-V332 PolarHBondContact O-N 2.96Å
329	R	97.8	Very high	97.7	Very high	96 Å²	96	37.3 Å²	37.3	36%	0.362	19%	0.185	S	C	.	.	H	α-helix	trans	-59.4	-44.2	174.8	-174.8	176.5	179.5	-89.5	-0.3	112.1	W274 G331 V332 L333	W274-R329 VanDerWaalsContact CD1-N 3.35Å; W274-R329 HydrophobicContact CD2-CB 3.72Å; W274-R329 HydrophobicContact CD2-CG 4.2Å; W274-R329 HydrophobicContact CE3-CB 3.96Å; W274-R329 HydrophobicContact CE3-CG 3.89Å; W274-R329 HydrophobicContact CG-CB 4.34Å; W274-R329 HydrophobicContact CH2-CB 3.98Å; W274-R329 HydrophobicContact CH2-CG 3.79Å; W274-R329 HydrophobicContact CZ2-CB 3.73Å; W274-R329 HydrophobicContact CZ2-CG 4.09Å; W274-R329 HydrophobicContact CZ3-CB 4.08Å; W274-R329 HydrophobicContact CZ3-CG 3.68Å; R329-G331 VanDerWaalsContact C-N 3.32Å; R329-G331 PolarHBondContact O-N 2.92Å; R329-V332 WeakPolarHBondContact O-CG2 3.4Å; R329-V332 PolarHBondContact O-N 2.95Å; R329-L333 HydrophobicContact CG-CD1 4.25Å; R329-L333 WeakPolarHBondContact O-CG 3.45Å; R329-L333 PolarHBondContact O-N 3.38Å; R329-L333 VanDerWaalsContact O-N 3.17Å
330	D	98.2	Very high	97.7	Very high	85 Å²	85	34.6 Å²	34.6	46%	0.455	17%	0.165	S	C	.	.	H	α-helix	trans	-64.5	-40.6	-179.3	-175.3	61.8	0	0	0	111	T328 V332 L333 Q334	T328-D330 VanDerWaalsContact C-N 3.33Å; T328-D330 PolarHBondContact O-N 3.42Å; D330-V332 PolarHBondContact O-N 3.21Å; D330-L333 WeakPolarHBondContact O-CB 3.43Å; D330-L333 PolarHBondContact O-N 3.02Å; D330-Q334 WeakPolarHBondContact O-CG 3.46Å; D330-Q334 PolarHBondContact O-N 3.03Å; D330-Q334 PolarHBondContact OD2-NE2 3.34Å
331	G	98.5	Very high	97.7	Very high	2 Å²	2	38.3 Å²	38.3	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-43	177.3	0	0	0	0	0	114.1	T328 R329 L333 Q334 M335	T328-G331 PolarHBondContact O-N 3.22Å; T328-G331 PolarHBondContact OG1-N 3.33Å; T328-G331 VanDerWaalsContact OG1-N 3.11Å; R329-G331 VanDerWaalsContact C-N 3.32Å; R329-G331 PolarHBondContact O-N 2.92Å; G331-L333 VanDerWaalsContact C-N 3.31Å; G331-L333 PolarHBondContact O-N 2.92Å; G331-Q334 PolarHBondContact O-N 3.17Å; G331-M335 VanDerWaalsContact O-CG 3.31Å; G331-M335 WeakPolarHBondContact O-CG 3.4Å; G331-M335 PolarHBondContact O-N 2.9Å
332	V	98.2	Very high	97.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-34.9	173.9	-71.5	0	0	0	0	112.7	I266 W274 I276 H326 T328 R329 D330 M335 A336	I266-V332 HydrophobicContact CB-CG2 4.26Å; I266-V332 HydrophobicContact CD1-CG2 4.31Å; I266-V332 HydrophobicContact CG2-CB 4.35Å; I266-V332 HydrophobicContact CG2-CG2 4.18Å; W274-V332 HydrophobicContact CB-CB 4.36Å; W274-V332 HydrophobicContact CB-CG1 3.63Å; W274-V332 HydrophobicContact CB-CG2 3.73Å; W274-V332 HydrophobicContact CE3-CG2 4.24Å; W274-V332 HydrophobicContact CG-CG2 4.38Å; W274-V332 VanDerWaalsContact O-CG1 3.23Å; W274-V332 WeakPolarHBondContact O-CG1 3.44Å; I276-V332 HydrophobicContact CB-CB 4.19Å; I276-V332 HydrophobicContact CB-CG1 4.28Å; I276-V332 HydrophobicContact CG2-CG1 4.29Å; H326-V332 HydrophobicContact CB-CB 4.47Å; H326-V332 HydrophobicContact CB-CG1 3.52Å; T328-V332 PolarHBondContact O-N 2.96Å; R329-V332 WeakPolarHBondContact O-CG2 3.4Å; R329-V332 PolarHBondContact O-N 2.95Å; D330-V332 PolarHBondContact O-N 3.21Å; V332-M335 PolarHBondContact O-N 3.03Å; V332-A336 PolarHBondContact O-N 2.68Å
333	L	98.4	Very high	97.2	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-42.6	174	-76.2	167.8	0	0	0	111.2	V219 I225 I266 R329 D330 G331 A336 R337	V219-L333 HydrophobicContact CG1-CD2 3.95Å; I225-L333 HydrophobicContact CD1-CD2 4.29Å; I225-L333 HydrophobicContact CG2-CD2 4.1Å; I266-L333 HydrophobicContact CD1-CD1 4.43Å; I266-L333 HydrophobicContact CD1-CD2 3.59Å; I266-L333 HydrophobicContact CD1-CG 3.79Å; R329-L333 HydrophobicContact CG-CD1 4.25Å; R329-L333 WeakPolarHBondContact O-CG 3.45Å; R329-L333 PolarHBondContact O-N 3.38Å; R329-L333 VanDerWaalsContact O-N 3.17Å; D330-L333 WeakPolarHBondContact O-CB 3.43Å; D330-L333 PolarHBondContact O-N 3.02Å; G331-L333 VanDerWaalsContact C-N 3.31Å; G331-L333 PolarHBondContact O-N 2.92Å; L333-A336 WeakPolarHBondContact O-CB 3.43Å; L333-A336 PolarHBondContact O-N 2.81Å; L333-R337 VanDerWaalsContact O-CG 3.28Å; L333-R337 WeakPolarHBondContact O-CG 2.89Å; L333-R337 PolarHBondContact O-N 2.85Å
334	Q	98.4	Very high	96.7	Very high	68 Å²	68	50.4 Å²	50.4	32%	0.318	23%	0.232	S	C	.	.	H	α-helix	trans	-64.5	-41.8	175.8	-69.6	-168	53.6	0	0	111.6	L311 D330 G331 A336 R337 L338	L311-Q334 HydrophobicContact CD1-CB 3.55Å; L311-Q334 HydrophobicContact CD2-CB 4.32Å; D330-Q334 WeakPolarHBondContact O-CG 3.46Å; D330-Q334 PolarHBondContact O-N 3.03Å; D330-Q334 PolarHBondContact OD2-NE2 3.34Å; G331-Q334 PolarHBondContact O-N 3.17Å; Q334-A336 VanDerWaalsContact C-N 3.33Å; Q334-A336 PolarHBondContact O-N 2.8Å; Q334-R337 PolarHBondContact O-N 2.75Å; Q334-L338 WeakPolarHBondContact O-CB 3.32Å; Q334-L338 VanDerWaalsContact O-CG 3.28Å; Q334-L338 WeakPolarHBondContact O-CG 3.2Å; Q334-L338 PolarHBondContact O-N 2.81Å
335	M	98.6	Very high	96.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.6	-43.2	173.2	-71	-179.8	80.5	0	0	112.1	I276 W297 V309 L311 V317 H326 G331 V332 T339	I276-M335 HydrophobicContact CD1-CB 4.46Å; W297-M335 HydrophobicContact CE3-CE 3.88Å; W297-M335 HydrophobicContact CH2-CB 4.4Å; W297-M335 WeakPolarHBondContact CH2-O 3.35Å; W297-M335 HydrophobicContact CZ3-CB 3.98Å; W297-M335 HydrophobicContact CZ3-CE 3.98Å; W297-M335 HydrophobicContact CZ3-CG 4.32Å; V309-M335 HydrophobicContact CG1-CG 4.29Å; L311-M335 HydrophobicContact CD1-CG 4.07Å; V317-M335 HydrophobicContact CG2-CE 3.76Å; H326-M335 HydrophobicContact CB-SD 4.24Å; G331-M335 VanDerWaalsContact O-CG 3.31Å; G331-M335 WeakPolarHBondContact O-CG 3.4Å; G331-M335 PolarHBondContact O-N 2.9Å; V332-M335 PolarHBondContact O-N 3.03Å; M335-T339 WeakPolarHBondContact O-CB 3.1Å; M335-T339 PolarHBondContact O-N 3.04Å; M335-T339 PolarHBondContact O-OG1 3.28Å
336	A	98.2	Very high	95.2	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-52.1	175	0	0	0	0	0	111.4	I225 F264 I276 V332 L333 Q334 L338 T339 I340	I225-A336 HydrophobicContact CD1-CB 3.43Å; I225-A336 VanDerWaalsContact CD1-CB 3.43Å; I225-A336 HydrophobicContact CG1-CB 4.09Å; F264-A336 HydrophobicContact CD2-CB 3.98Å; F264-A336 HydrophobicContact CG-CB 4.29Å; I276-A336 VanDerWaalsContact CD1-CA 3.48Å; I276-A336 HydrophobicContact CD1-CB 3.48Å; I276-A336 VanDerWaalsContact CD1-CB 3.48Å; V332-A336 PolarHBondContact O-N 2.68Å; L333-A336 WeakPolarHBondContact O-CB 3.43Å; L333-A336 PolarHBondContact O-N 2.81Å; Q334-A336 VanDerWaalsContact C-N 3.33Å; Q334-A336 PolarHBondContact O-N 2.8Å; A336-L338 PolarHBondContact O-N 3.41Å; A336-T339 WeakPolarHBondContact O-CB 3.18Å; A336-T339 PolarHBondContact O-N 3.19Å; A336-T339 VanDerWaalsContact O-N 3.11Å; A336-I340 WeakPolarHBondContact O-CG1 3.29Å; A336-I340 PolarHBondContact O-N 3.14Å
337	R	97.6	Very high	95	Very high	101 Å²	101	68.8 Å²	68.8	38%	0.381	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-43.4	-179.7	-71.2	166.8	177.4	156.7	2.2	112.6	D220 L333 Q334 T339 I340 K341	D220-R337 IonicContact OD1-CZ 3.79Å; D220-R337 IonicContact OD1-NE 2.71Å; D220-R337 PolarHBondContact OD1-NE 2.75Å; D220-R337 IonicContact OD1-NH2 3.11Å; D220-R337 PolarHBondContact OD1-NH2 3.47Å; L333-R337 VanDerWaalsContact O-CG 3.28Å; L333-R337 WeakPolarHBondContact O-CG 2.89Å; L333-R337 PolarHBondContact O-N 2.85Å; Q334-R337 PolarHBondContact O-N 2.75Å; R337-T339 VanDerWaalsContact C-N 3.31Å; R337-T339 PolarHBondContact O-N 2.56Å; R337-I340 PolarHBondContact O-N 2.97Å; R337-K341 WeakPolarHBondContact O-CB 3.49Å; R337-K341 PolarHBondContact O-N 2.61Å
338	L	97.8	Very high	94.8	Very high	53 Å²	53	66.7 Å²	66.7	28%	0.277	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-42.1	175.6	-75.9	173.8	0	0	0	111	W297 V309 L311 Q334 A336 K341 M342	W297-L338 HydrophobicContact CH2-CB 3.84Å; W297-L338 HydrophobicContact CZ2-CB 4.12Å; W297-L338 HydrophobicContact CZ2-CD1 4.5Å; V309-L338 HydrophobicContact CG1-CD1 3.99Å; L311-L338 HydrophobicContact CD1-CD1 3.73Å; L311-L338 HydrophobicContact CG-CD1 4.14Å; Q334-L338 WeakPolarHBondContact O-CB 3.32Å; Q334-L338 VanDerWaalsContact O-CG 3.28Å; Q334-L338 WeakPolarHBondContact O-CG 3.2Å; Q334-L338 PolarHBondContact O-N 2.81Å; A336-L338 PolarHBondContact O-N 3.41Å; L338-K341 PolarHBondContact O-N 2.82Å; L338-M342 WeakPolarHBondContact O-CB 3.41Å; L338-M342 VanDerWaalsContact O-CG 3.23Å; L338-M342 WeakPolarHBondContact O-CG 3.34Å; L338-M342 PolarHBondContact O-N 3.27Å
339	T	97.6	Very high	94.6	Very high	3 Å²	3	67.3 Å²	67.3	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-46.3	177.2	-55.5	0	0	0	0	111.5	F264 L291 L293 P294 W297 M335 A336 R337 M342 K343	F264-T339 HydrophobicContact CE2-CG2 4.42Å; F264-T339 HydrophobicContact CZ-CG2 3.68Å; L291-T339 HydrophobicContact CD1-CG2 4.45Å; L291-T339 HydrophobicContact CD2-CG2 3.88Å; L291-T339 HydrophobicContact CG-CG2 3.85Å; L293-T339 HydrophobicContact CD2-CG2 4.47Å; P294-T339 WeakPolarHBondContact CD-OG1 3.08Å; P294-T339 HydrophobicContact CG-CG2 4.14Å; W297-T339 WeakPolarHBondContact CH2-OG1 3.44Å; W297-T339 WeakPolarHBondContact CZ3-OG1 3.38Å; M335-T339 WeakPolarHBondContact O-CB 3.1Å; M335-T339 PolarHBondContact O-N 3.04Å; M335-T339 PolarHBondContact O-OG1 3.28Å; A336-T339 WeakPolarHBondContact O-CB 3.18Å; A336-T339 PolarHBondContact O-N 3.19Å; A336-T339 VanDerWaalsContact O-N 3.11Å; R337-T339 VanDerWaalsContact C-N 3.31Å; R337-T339 PolarHBondContact O-N 2.56Å; T339-M342 PolarHBondContact O-N 2.98Å; T339-K343 PolarHBondContact O-N 2.93Å; T339-K343 VanDerWaalsContact O-N 3.13Å
340	I	95.5	Very high	94.4	Very high	23 Å²	23	65.6 Å²	65.6	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-50.6	177.1	-64.2	169.9	0	0	0	110.2	I225 L263 F264 L291 A336 R337 M342 K343 E344	I225-I340 HydrophobicContact CD1-CD1 4.49Å; I225-I340 HydrophobicContact CG1-CD1 4.44Å; L263-I340 HydrophobicContact CD1-CD1 4.12Å; L263-I340 HydrophobicContact CD1-CG1 3.82Å; F264-I340 HydrophobicContact CD2-CD1 4.3Å; F264-I340 HydrophobicContact CD2-CG1 4.42Å; F264-I340 HydrophobicContact CE2-CD1 4.21Å; F264-I340 HydrophobicContact CE2-CG1 3.82Å; L291-I340 HydrophobicContact CD2-CG1 4.18Å; A336-I340 WeakPolarHBondContact O-CG1 3.29Å; A336-I340 PolarHBondContact O-N 3.14Å; R337-I340 PolarHBondContact O-N 2.97Å; I340-M342 VanDerWaalsContact C-N 3.32Å; I340-M342 PolarHBondContact O-N 2.69Å; I340-K343 WeakPolarHBondContact O-CB 3.47Å; I340-K343 PolarHBondContact O-N 2.97Å; I340-E344 PolarHBondContact O-N 3.09Å; I340-E344 VanDerWaalsContact O-N 3.09Å
341	K	95	Very high	94.2	Very high	126 Å²	126	64.4 Å²	64.4	55%	0.548	30%	0.301	S	S	.	.	H	α-helix	trans	-61	-38	178.9	-173.2	-179.9	-179	-179.2	0	112.8	R337 L338 K343 E344 N345	R337-K341 WeakPolarHBondContact O-CB 3.49Å; R337-K341 PolarHBondContact O-N 2.61Å; L338-K341 PolarHBondContact O-N 2.82Å; K341-K343 VanDerWaalsContact C-N 3.28Å; K341-K343 PolarHBondContact O-N 2.71Å; K341-E344 PolarHBondContact O-N 3.44Å; K341-N345 PolarHBondContact O-N 3.14Å; K341-N345 PolarHBondContact O-ND2 3.17Å
342	M	94.2	Very high	93.9	Very high	75 Å²	75	68.5 Å²	68.5	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-64	-35.5	175.6	-76.8	178.6	-176.4	0	0	111.7	P294 W297 L338 T339 I340 N345 Q346	P294-M342 HydrophobicContact CB-SD 4.01Å; P294-M342 HydrophobicContact CG-SD 3.59Å; P294-M342 VanDerWaalsContact CG-SD 3.59Å; W297-M342 HydrophobicContact CZ2-CE 3.95Å; W297-M342 HydrophobicContact CZ2-SD 4.21Å; L338-M342 WeakPolarHBondContact O-CB 3.41Å; L338-M342 VanDerWaalsContact O-CG 3.23Å; L338-M342 WeakPolarHBondContact O-CG 3.34Å; L338-M342 PolarHBondContact O-N 3.27Å; T339-M342 PolarHBondContact O-N 2.98Å; I340-M342 VanDerWaalsContact C-N 3.32Å; I340-M342 PolarHBondContact O-N 2.69Å; M342-N345 PolarHBondContact O-N 3.32Å; M342-Q346 WeakPolarHBondContact O-CG 3.18Å
343	K	88.8	Confident	93.6	Very high	108 Å²	108	73.4 Å²	73.4	47%	0.47	34%	0.342	S	S	.	.	H	α-helix	trans	-69.9	-36.5	176.5	179.8	57.7	-174.6	154.5	0	112.7	L291 T339 I340 K341 N345 Q346	L291-K343 HydrophobicContact CD1-CB 3.92Å; L291-K343 HydrophobicContact CD1-CD 4.17Å; L291-K343 HydrophobicContact CD1-CG 3.91Å; L291-K343 HydrophobicContact CD2-CB 4.17Å; T339-K343 PolarHBondContact O-N 2.93Å; T339-K343 VanDerWaalsContact O-N 3.13Å; I340-K343 WeakPolarHBondContact O-CB 3.47Å; I340-K343 PolarHBondContact O-N 2.97Å; K341-K343 VanDerWaalsContact C-N 3.28Å; K341-K343 PolarHBondContact O-N 2.71Å; K343-N345 VanDerWaalsContact C-N 3.29Å; K343-N345 PolarHBondContact O-N 2.67Å; K343-Q346 PolarHBondContact O-N 3.16Å
344	E	86.6	Confident	93.2	Very high	141 Å²	141	78.7 Å²	78.7	66%	0.659	37%	0.366	S	S	*	.	H	α-helix	trans	-69	-24.8	176.9	-68.2	170.8	167.3	0	0	113.4	I340 K341	I340-E344 PolarHBondContact O-N 3.09Å; I340-E344 VanDerWaalsContact O-N 3.09Å; K341-E344 PolarHBondContact O-N 3.44Å
345	N	85.5	Confident	92.8	Very high	128 Å²	128	79.6 Å²	79.6	68%	0.684	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.2	178.8	-67.6	-45.2	0	0	0	114	K341 M342 K343	K341-N345 PolarHBondContact O-N 3.14Å; K341-N345 PolarHBondContact O-ND2 3.17Å; M342-N345 PolarHBondContact O-N 3.32Å; K343-N345 VanDerWaalsContact C-N 3.29Å; K343-N345 PolarHBondContact O-N 2.67Å
346	Q	78.3	Confident	92.3	Very high	197 Å²	197	86.8 Å²	86.8	92%	0.921	40%	0.404	S	S	*	.			trans	-95.6	0	174.2	-73.7	177.7	-7.4	0	0	110.2	M342 K343	M342-Q346 WeakPolarHBondContact O-CG 3.18Å; K343-Q346 PolarHBondContact O-N 3.16Å

Retrieved 346 of 346 residues in 231.9 ms (Link to these results)

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