A0A096MXY8_PAPAN Loading...

Ras-related protein Rab-30

The small GTPases Rab are key regulators of intracellular membrane trafficking, from the formation of transport vesicles to their fusion with membranes. Rabs cycle between an inactive GDP-bound form and an active GTP-bound form that is able to recruit to membranes different sets of downstream effectors directly responsible for vesicle formation, movement, tethering and fusion. RAB30 is required for maintaining the structural integrity of the Golgi apparatus, possibly by mediating interactions with cytoplasmic scaffolding proteins. Facilitates lipid homeostasis during fasting by regulating hepatic protein and lipid trafficking in a PPAR-alpha-dependent manner. Promotes autophagosome biogenesis during bacterial infection such as group A Streptococcus infection.

AlphaFold DB (Q923S9), UniProt , Accession A0A096MXY8, Species PAPAN (Papio anubis, Olive baboon), Gene RAB30, Length 203 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.4	Very low	79.8	Confident	242 Å²	242	95.9 Å²	95.9	100%	1.192	49%	0.492	S	S	*	.				0	104	0	-156.5	162.2	86.3	0	0	105.6	M3	M1-M3 PolarHBondContact O-N 3.36Å; M1-M3 VanDerWaalsContact O-N 3.17Å
2	S	49.7	Very low	81.4	Confident	113 Å²	113	87.9 Å²	87.9	79%	0.79	45%	0.451	S	S	*	.			trans	-59	119.2	179.1	47.8	0	0	0	0	107.5	E4	S2-E4 PolarHBondContact O-N 3.18Å; S2-E4 VanDerWaalsContact O-N 3.13Å
3	M	57.5	Low	82.5	Confident	134 Å²	134	81.2 Å²	81.2	66%	0.66	42%	0.416	S	S	*	.			trans	-50.6	124.5	161.4	-105.8	176.2	169.8	0	0	105.5	M1 D5 Y6	M1-M3 PolarHBondContact O-N 3.36Å; M1-M3 VanDerWaalsContact O-N 3.17Å; M3-D5 PolarHBondContact O-N 3.05Å; M3-Y6 HydrophobicContact SD-CE1 4.28Å
4	E	66.6	Low	83.6	Confident	142 Å²	142	75.4 Å²	75.4	66%	0.664	39%	0.387	S	S	*	.			trans	-52.4	115.6	165	-70.2	175.7	165.9	0	0	106.8	S2 Y6 K59	S2-E4 PolarHBondContact O-N 3.18Å; S2-E4 VanDerWaalsContact O-N 3.13Å; E4-Y6 WeakPolarHBondContact O-CD1 3.2Å; E4-Y6 PolarHBondContact O-N 3.45Å; E4-K59 PolarHBondContact O-NZ 3.09Å
5	D	87.2	Confident	84.4	Confident	138 Å²	138	70.3 Å²	70.3	74%	0.738	36%	0.361	S	S	*	.			trans	-57.6	127.7	-177.1	-70.6	-35.9	0	0	0	109.1	M3 K57	M3-D5 PolarHBondContact O-N 3.05Å; D5-K57 VanDerWaalsContact O-CD 3.25Å; D5-K57 WeakPolarHBondContact O-CD 3.31Å
6	Y	93.7	Very high	85.2	Confident	68 Å²	68	65.9 Å²	65.9	27%	0.267	34%	0.338	S	S	.	.			trans	-129.4	148.2	174.4	59.8	-95.5	0	0	0	108.5	M3 E4 F8 L9 K59	M3-Y6 HydrophobicContact SD-CE1 4.28Å; E4-Y6 WeakPolarHBondContact O-CD1 3.2Å; E4-Y6 PolarHBondContact O-N 3.45Å; Y6-F8 VanDerWaalsContact CD2-C 3.46Å; Y6-F8 VanDerWaalsContact CD2-O 3.31Å; Y6-F8 WeakPolarHBondContact CD2-O 3.35Å; Y6-L9 HydrophobicContact CD2-CB 4.03Å; Y6-L9 HydrophobicContact CE2-CB 3.42Å; Y6-L9 VanDerWaalsContact CE2-CB 3.42Å; Y6-L9 HydrophobicContact CE2-CG 4.42Å; Y6-K59 HydrophobicContact CD1-CB 4.37Å; Y6-K59 HydrophobicContact CD1-CD 3.94Å; Y6-K59 VanDerWaalsContact CD1-NZ 3.27Å; Y6-K59 HydrophobicContact CD2-CB 4.48Å; Y6-K59 HydrophobicContact CE1-CD 4.16Å; Y6-K59 HydrophobicContact CG-CB 4.06Å; Y6-K59 HydrophobicContact CG-CD 4.48Å
7	D	96	Very high	85.8	Confident	96 Å²	96	63.9 Å²	63.9	51%	0.513	33%	0.328	S	S	.	.	S	Bend	trans	-84.1	-34.7	178.7	-56.3	-68.4	0	0	0	111	E56 K57	D7-E56 HydrophobicContact CB-CB 4.13Å; D7-E56 VanDerWaalsContact OD2-CA 3.31Å; D7-E56 WeakPolarHBondContact OD2-CA 3.19Å; D7-K57 PolarHBondContact N-O 3.38Å; D7-K57 PolarHBondContact OD2-N 3.12Å
8	F	97.3	Very high	86.2	Confident	31 Å²	31	62.3 Å²	62.3	14%	0.136	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.3	178.6	-63.7	-85	0	0	0	112.4	Y6 F10 E56 K57 V58 K59 I171 A174 R175	Y6-F8 VanDerWaalsContact CD2-C 3.46Å; Y6-F8 VanDerWaalsContact CD2-O 3.31Å; Y6-F8 WeakPolarHBondContact CD2-O 3.35Å; F8-F10 HydrophobicContact CB-CD2 4.23Å; F8-F10 HydrophobicContact CB-CE1 4.47Å; F8-F10 HydrophobicContact CB-CE2 3.55Å; F8-F10 HydrophobicContact CB-CZ 3.69Å; F8-F10 HydrophobicContact CD1-CE1 4.29Å; F8-F10 HydrophobicContact CD1-CE2 4.21Å; F8-F10 AromaticContact CD1-CZ 3.55Å; F8-F10 HydrophobicContact CD1-CZ 3.55Å; F8-F10 HydrophobicContact CE1-CZ 4.48Å; F8-F10 HydrophobicContact CG-CE2 4.01Å; F8-F10 AromaticContact CG-CZ 3.84Å; F8-F10 HydrophobicContact CG-CZ 3.84Å; F8-E56 HydrophobicContact CE2-CB 4.47Å; F8-E56 WeakPolarHBondContact CE2-OE1 3.41Å; F8-K57 PolarHBondContact N-O 3.38Å; F8-V58 HydrophobicContact CB-CG1 4.19Å; F8-V58 HydrophobicContact CB-CG2 4.37Å; F8-V58 HydrophobicContact CD2-CG2 4.32Å; F8-K59 PolarHBondContact O-N 2.96Å; F8-I171 HydrophobicContact CD2-CG1 4.01Å; F8-I171 HydrophobicContact CE1-CG2 4.42Å; F8-I171 HydrophobicContact CE2-CG1 4.19Å; F8-I171 HydrophobicContact CE2-CG2 3.92Å; F8-I171 HydrophobicContact CG-CG1 4.22Å; F8-I171 HydrophobicContact CZ-CG2 3.84Å; F8-A174 HydrophobicContact CD1-CB 4.13Å; F8-A174 HydrophobicContact CE1-CB 3.85Å; F8-R175 HydrophobicContact CZ-CG 4.4Å
9	L	96.9	Very high	86.7	Confident	62 Å²	62	62.2 Å²	62.2	33%	0.325	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.2	169.4	178.6	68.3	0	0	0	108.7	Y6 K59 Q61	Y6-L9 HydrophobicContact CD2-CB 4.03Å; Y6-L9 HydrophobicContact CE2-CB 3.42Å; Y6-L9 VanDerWaalsContact CE2-CB 3.42Å; Y6-L9 HydrophobicContact CE2-CG 4.42Å; L9-K59 WeakPolarHBondContact CA-O 3.41Å; L9-K59 HydrophobicContact CD1-CB 3.89Å; L9-K59 HydrophobicContact CD1-CD 4.01Å; L9-K59 HydrophobicContact CD1-CG 3.83Å; L9-Q61 HydrophobicContact CD1-CG 3.75Å
10	F	97.8	Very high	87.2	Confident	11 Å²	11	59.2 Å²	59.2	5%	0.048	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.8	178.1	-61	-53.8	0	0	0	112.2	F8 V58 K59 L60 Q61 N83 L170 I171 A174	F8-F10 HydrophobicContact CB-CD2 4.23Å; F8-F10 HydrophobicContact CB-CE1 4.47Å; F8-F10 HydrophobicContact CB-CE2 3.55Å; F8-F10 HydrophobicContact CB-CZ 3.69Å; F8-F10 HydrophobicContact CD1-CE1 4.29Å; F8-F10 HydrophobicContact CD1-CE2 4.21Å; F8-F10 AromaticContact CD1-CZ 3.55Å; F8-F10 HydrophobicContact CD1-CZ 3.55Å; F8-F10 HydrophobicContact CE1-CZ 4.48Å; F8-F10 HydrophobicContact CG-CE2 4.01Å; F8-F10 AromaticContact CG-CZ 3.84Å; F8-F10 HydrophobicContact CG-CZ 3.84Å; F10-V58 HydrophobicContact CD2-CG1 3.66Å; F10-V58 HydrophobicContact CE2-CG1 3.86Å; F10-K59 PolarHBondContact N-O 3.29Å; F10-L60 HydrophobicContact CB-CD2 4.08Å; F10-L60 HydrophobicContact CD2-CD2 4.15Å; F10-Q61 WeakPolarHBondContact O-CB 3.34Å; F10-Q61 PolarHBondContact O-N 3.38Å; F10-N83 WeakPolarHBondContact CA-OD1 3.46Å; F10-N83 HydrophobicContact CB-CB 4.45Å; F10-N83 HydrophobicContact CD1-CB 4.22Å; F10-L170 HydrophobicContact CB-CD1 3.85Å; F10-L170 HydrophobicContact CD1-CB 3.95Å; F10-L170 HydrophobicContact CD1-CD1 4.32Å; F10-L170 HydrophobicContact CD1-CD2 4.44Å; F10-L170 HydrophobicContact CD1-CG 4.49Å; F10-L170 HydrophobicContact CD2-CB 3.77Å; F10-L170 HydrophobicContact CD2-CD1 4.05Å; F10-L170 HydrophobicContact CE1-CB 3.82Å; F10-L170 HydrophobicContact CE2-CB 3.62Å; F10-L170 HydrophobicContact CG-CB 3.93Å; F10-L170 HydrophobicContact CG-CD1 3.82Å; F10-L170 HydrophobicContact CG-CG 4.39Å; F10-L170 VanDerWaalsContact CZ-C 3.45Å; F10-L170 HydrophobicContact CZ-CB 3.65Å; F10-L170 WeakPolarHBondContact CZ-O 3.31Å; F10-I171 HydrophobicContact CE2-CG1 3.84Å; F10-I171 HydrophobicContact CZ-CG1 4.2Å; F10-A174 HydrophobicContact CE1-CB 4.22Å; F10-A174 HydrophobicContact CZ-CB 4.26Å
11	K	97.1	Very high	87.6	Confident	18 Å²	18	56.9 Å²	56.9	8%	0.078	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	116.6	170.2	-174.2	-179.5	-178	-162.1	0	110.1	V13 Q61 Y78 S81 N83 A84	K11-V13 HydrophobicContact CG-CG2 4.28Å; K11-Q61 WeakPolarHBondContact CA-O 3.42Å; K11-Y78 PolarHBondContact NZ-O 3.17Å; K11-S81 WeakPolarHBondContact CD-O 3.38Å; K11-S81 WeakPolarHBondContact CD-OG 3.5Å; K11-S81 PolarHBondContact NZ-OG 2.96Å; K11-N83 PolarHBondContact N-OD1 3.43Å; K11-N83 PolarHBondContact O-N 3.1Å; K11-A84 PolarHBondContact O-N 3.06Å
12	I	98.1	Very high	90.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130	175.1	-58.9	175.8	0	0	0	107.9	L14 L60 Q61 I62 W63 A84 I86 F163 L166 L170	I12-L14 HydrophobicContact CG2-CD1 4.44Å; I12-L60 HydrophobicContact CD1-CD1 4.33Å; I12-L60 HydrophobicContact CD1-CD2 3.97Å; I12-Q61 PolarHBondContact N-O 3.3Å; I12-I62 WeakPolarHBondContact O-CA 3.41Å; I12-W63 PolarHBondContact O-N 3.23Å; I12-A84 WeakPolarHBondContact CA-O 3.37Å; I12-A84 HydrophobicContact CG1-CB 4.39Å; I12-I86 HydrophobicContact CG2-CD1 3.53Å; I12-I86 HydrophobicContact CG2-CG1 3.86Å; I12-F163 HydrophobicContact CD1-CD1 4.31Å; I12-L166 HydrophobicContact CD1-CD2 4.02Å; I12-L166 HydrophobicContact CD1-CG 4.43Å; I12-L166 HydrophobicContact CG1-CD2 4.37Å; I12-L166 HydrophobicContact CG2-CD2 4.12Å; I12-L170 HydrophobicContact CD1-CD1 4.49Å; I12-L170 HydrophobicContact CG1-CD1 4.39Å
13	V	96.9	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.8	177.9	-174.6	0	0	0	0	108.9	K11 I15 W63 T65 A82 A84 L85 I86	K11-V13 HydrophobicContact CG-CG2 4.28Å; V13-I15 HydrophobicContact CG1-CG2 4.07Å; V13-W63 HydrophobicContact CB-CB 4.4Å; V13-W63 HydrophobicContact CG1-CB 4.24Å; V13-W63 HydrophobicContact CG2-CB 4.08Å; V13-W63 HydrophobicContact CG2-CG 4.36Å; V13-T65 HydrophobicContact CG1-CG2 3.6Å; V13-A82 HydrophobicContact CG2-CB 3.83Å; V13-A84 PolarHBondContact N-O 3.22Å; V13-L85 HydrophobicContact CB-CD2 3.78Å; V13-L85 HydrophobicContact CG1-CD2 4.32Å; V13-L85 WeakPolarHBondContact O-CA 3.4Å; V13-I86 PolarHBondContact O-N 3.24Å
14	L	97.7	Very high	94.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.1	173.4	-72.7	78.1	0	0	0	109.1	I12 K22 L25 V26 I62 W63 T65 I86 F163	I12-L14 HydrophobicContact CG2-CD1 4.44Å; L14-K22 HydrophobicContact CB-CB 4.11Å; L14-K22 HydrophobicContact CB-CD 4.11Å; L14-K22 HydrophobicContact CB-CG 4.26Å; L14-K22 HydrophobicContact CD2-CB 4.02Å; L14-L25 HydrophobicContact CD2-CB 4.25Å; L14-V26 HydrophobicContact CD1-CG2 3.67Å; L14-V26 HydrophobicContact CD2-CG2 3.57Å; L14-V26 HydrophobicContact CG-CG2 4.2Å; L14-I62 HydrophobicContact CD1-CG2 3.46Å; L14-I62 VanDerWaalsContact CD1-CG2 3.46Å; L14-W63 PolarHBondContact N-O 2.73Å; L14-T65 WeakPolarHBondContact O-CB 3.3Å; L14-T65 WeakPolarHBondContact O-CG2 3.36Å; L14-T65 PolarHBondContact O-OG1 2.97Å; L14-I86 WeakPolarHBondContact CA-O 3.37Å; L14-I86 HydrophobicContact CD1-CD1 4.28Å; L14-I86 HydrophobicContact CG-CB 4.06Å; L14-I86 HydrophobicContact CG-CD1 4.29Å; L14-I86 HydrophobicContact CG-CG2 4.33Å; L14-F163 HydrophobicContact CD1-CE1 4.37Å; L14-F163 HydrophobicContact CD1-CZ 4.43Å
15	I	95.9	Very high	96	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	169.1	179.4	66	174.2	0	0	0	111	V13 K22 T75 Y79 L85 I86 L87 T88 W103 I107	V13-I15 HydrophobicContact CG1-CG2 4.07Å; I15-K22 VanDerWaalsContact C-CD 3.47Å; I15-K22 WeakPolarHBondContact O-CD 3.17Å; I15-T75 HydrophobicContact CG2-CG2 4.03Å; I15-Y79 HydrophobicContact CD1-CE1 3.88Å; I15-Y79 HydrophobicContact CG2-CE1 3.85Å; I15-L85 HydrophobicContact CD1-CD2 4.43Å; I15-L85 HydrophobicContact CG2-CD2 4.27Å; I15-I86 PolarHBondContact N-O 3.32Å; I15-L87 HydrophobicContact CD1-CB 4.39Å; I15-L87 HydrophobicContact CD1-CD1 3.96Å; I15-L87 HydrophobicContact CG1-CB 4.2Å; I15-L87 HydrophobicContact CG1-CD1 3.79Å; I15-T88 PolarHBondContact O-N 2.79Å; I15-W103 HydrophobicContact CB-CE3 4.08Å; I15-W103 HydrophobicContact CB-CZ3 4.21Å; I15-W103 HydrophobicContact CD1-CE3 4.38Å; I15-I107 HydrophobicContact CD1-CD1 3.51Å; I15-I107 HydrophobicContact CD1-CG1 3.77Å
16	G	96.1	Very high	96.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	125.6	171.2	-175.1	0	0	0	0	0	112.2	K22 G67 W103	G16-K22 PolarHBondContact O-NZ 3.49Å; G16-G67 VanDerWaalsContact O-CA 3.22Å; G16-G67 WeakPolarHBondContact O-CA 3.42Å; G16-W103 VanDerWaalsContact CA-CE2 3.47Å; G16-W103 VanDerWaalsContact O-CZ2 3.31Å; G16-W103 WeakPolarHBondContact O-CZ2 3.47Å
17	N	95.4	Very high	96.6	Very high	31 Å²	31	22.1 Å²	22.1	17%	0.166	13%	0.133	C	C	.	.	S	Bend	trans	-56.9	160.2	-174.4	-72.8	25.2	0	0	0	113.2	V20 K22 C99 W103	N17-V20 HydrophobicContact CB-CG1 3.96Å; N17-V20 VanDerWaalsContact O-CG2 3.26Å; N17-V20 WeakPolarHBondContact O-CG2 3.34Å; N17-K22 PolarHBondContact O-NZ 3.17Å; N17-C99 PolarHBondContact ND2-SG 3.19Å; N17-C99 WeakPolarHBondContact OD1-CB 3.34Å; N17-W103 PolarHBondContact OD1-NE1 3.48Å
18	A	94.1	Very high	96.7	Very high	36 Å²	36	20 Å²	20	30%	0.298	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	145.2	171	0	0	0	0	0	110.8	V20 G67 Q68	A18-V20 VanDerWaalsContact C-N 3.27Å; A18-V20 PolarHBondContact O-N 3.43Å; A18-G67 PolarHBondContact N-O 3.23Å; A18-Q68 VanDerWaalsContact CB-CD 3.45Å; A18-Q68 HydrophobicContact CB-CG 3.97Å
19	G	94.3	Very high	96.7	Very high	60 Å²	60	18.9 Å²	18.9	62%	0.619	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	-5	174.7	0	0	0	0	0	116.3	G21 K123	G19-G21 PolarHBondContact O-N 3.17Å; G19-K123 WeakPolarHBondContact O-CE 3.15Å; G19-K123 PolarHBondContact O-NZ 3.08Å
20	V	96.9	Very high	96.7	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.006	11%	0.106	C	C	.	.	S	Bend	trans	-69.3	-16.7	178.6	-56.1	0	0	0	0	113.9	N17 A18 K22 T88 D90 N122	N17-V20 HydrophobicContact CB-CG1 3.96Å; N17-V20 VanDerWaalsContact O-CG2 3.26Å; N17-V20 WeakPolarHBondContact O-CG2 3.34Å; A18-V20 VanDerWaalsContact C-N 3.27Å; A18-V20 PolarHBondContact O-N 3.43Å; V20-K22 HydrophobicContact CG2-CD 4.39Å; V20-K22 HydrophobicContact CG2-CG 3.73Å; V20-T88 HydrophobicContact CB-CG2 4.33Å; V20-T88 HydrophobicContact CG2-CG2 3.84Å; V20-D90 HydrophobicContact CB-CB 4.27Å; V20-D90 HydrophobicContact CG1-CB 4.22Å; V20-N122 PolarHBondContact O-ND2 2.85Å
21	G	97	Very high	96.6	Very high	11 Å²	11	20.7 Å²	20.7	11%	0.113	12%	0.122	C	C	.	.	S	Bend	trans	104.3	19.6	173.7	0	0	0	0	0	116.1	G19 T23 C24 L25	G19-G21 PolarHBondContact O-N 3.17Å; G21-T23 PolarHBondContact O-N 3.15Å; G21-C24 WeakPolarHBondContact O-CA 3.25Å; G21-C24 WeakPolarHBondContact O-CB 3.31Å; G21-C24 PolarHBondContact O-N 2.96Å; G21-L25 PolarHBondContact O-N 2.97Å
22	K	96.9	Very high	96.6	Very high	8 Å²	8	21.9 Å²	21.9	4%	0.035	14%	0.14	C	C	.	.	H	α-helix	trans	-49	-55	175.3	-58.9	-174.2	-61.8	-76.4	0	112.9	L14 I15 G16 N17 V20 C24 L25 V26 D64 T65	L14-K22 HydrophobicContact CB-CB 4.11Å; L14-K22 HydrophobicContact CB-CD 4.11Å; L14-K22 HydrophobicContact CB-CG 4.26Å; L14-K22 HydrophobicContact CD2-CB 4.02Å; I15-K22 VanDerWaalsContact C-CD 3.47Å; I15-K22 WeakPolarHBondContact O-CD 3.17Å; G16-K22 PolarHBondContact O-NZ 3.49Å; N17-K22 PolarHBondContact O-NZ 3.17Å; V20-K22 HydrophobicContact CG2-CD 4.39Å; V20-K22 HydrophobicContact CG2-CG 3.73Å; K22-C24 VanDerWaalsContact C-N 3.27Å; K22-C24 PolarHBondContact O-N 3.43Å; K22-L25 WeakPolarHBondContact O-CB 3.12Å; K22-L25 PolarHBondContact O-N 3.35Å; K22-L25 VanDerWaalsContact O-N 3.08Å; K22-V26 WeakPolarHBondContact O-CG2 3.47Å; K22-V26 PolarHBondContact O-N 2.7Å; K22-D64 VanDerWaalsContact CB-OD1 3.3Å; K22-D64 WeakPolarHBondContact CB-OD1 3.42Å; K22-T65 WeakPolarHBondContact CE-O 3.46Å
23	T	96.2	Very high	96.3	Very high	15 Å²	15	26.1 Å²	26.1	9%	0.092	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-39.9	176.4	-44.9	0	0	0	0	112.6	G21 V26 R27 Q38 T41 D64	G21-T23 PolarHBondContact O-N 3.15Å; T23-V26 PolarHBondContact O-N 3.42Å; T23-R27 HydrophobicContact CG2-CG 4.32Å; T23-R27 WeakPolarHBondContact O-CB 3.29Å; T23-R27 VanDerWaalsContact O-CG 3.27Å; T23-R27 WeakPolarHBondContact O-CG 3.42Å; T23-R27 PolarHBondContact O-N 2.85Å; T23-Q38 HydrophobicContact CG2-CG 4.22Å; T23-T41 PolarHBondContact OG1-OG1 3.02Å; T23-D64 VanDerWaalsContact CA-OD2 3.29Å; T23-D64 WeakPolarHBondContact CA-OD2 3.4Å; T23-D64 WeakPolarHBondContact CB-OD2 3.29Å; T23-D64 WeakPolarHBondContact CG2-OD2 3.41Å; T23-D64 PolarHBondContact N-OD1 2.82Å; T23-D64 PolarHBondContact OG1-OD1 3.35Å; T23-D64 PolarHBondContact OG1-OD2 3.01Å
24	C	97	Very high	96.2	Very high	14 Å²	14	29.7 Å²	29.7	10%	0.095	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-40.5	178	-59.6	0	0	0	0	111.3	G21 K22 R28 F34 A153	G21-C24 WeakPolarHBondContact O-CA 3.25Å; G21-C24 WeakPolarHBondContact O-CB 3.31Å; G21-C24 PolarHBondContact O-N 2.96Å; K22-C24 VanDerWaalsContact C-N 3.27Å; K22-C24 PolarHBondContact O-N 3.43Å; C24-R28 WeakPolarHBondContact O-CB 3.45Å; C24-R28 PolarHBondContact O-N 3.13Å; C24-F34 HydrophobicContact CB-CD2 3.9Å; C24-F34 HydrophobicContact CB-CE2 3.73Å; C24-A153 HydrophobicContact CB-CB 3.58Å
25	L	98.2	Very high	95.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-48.5	173.8	-70.9	170.2	0	0	0	111.2	L14 G21 K22 R27 R28 F29 T88 V120 N122 T151 A153 V159	L14-L25 HydrophobicContact CD2-CB 4.25Å; G21-L25 PolarHBondContact O-N 2.97Å; K22-L25 WeakPolarHBondContact O-CB 3.12Å; K22-L25 PolarHBondContact O-N 3.35Å; K22-L25 VanDerWaalsContact O-N 3.08Å; L25-R27 PolarHBondContact O-N 3.04Å; L25-R28 PolarHBondContact O-N 2.76Å; L25-F29 WeakPolarHBondContact O-CB 3.49Å; L25-F29 PolarHBondContact O-N 3.02Å; L25-T88 HydrophobicContact CD1-CG2 3.99Å; L25-V120 HydrophobicContact CD1-CG1 4.28Å; L25-N122 HydrophobicContact CD1-CB 4.43Å; L25-T151 HydrophobicContact CD2-CG2 4.47Å; L25-A153 HydrophobicContact CD2-CB 3.88Å; L25-A153 HydrophobicContact CG-CB 4.15Å; L25-V159 HydrophobicContact CD2-CG1 4.43Å; L25-V159 HydrophobicContact CD2-CG2 3.87Å
26	V	97.4	Very high	94.9	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-58.1	-50.7	178.1	177.6	0	0	0	0	110.6	L14 K22 T23 F29 T30 M47 I62 D64	L14-V26 HydrophobicContact CD1-CG2 3.67Å; L14-V26 HydrophobicContact CD2-CG2 3.57Å; L14-V26 HydrophobicContact CG-CG2 4.2Å; K22-V26 WeakPolarHBondContact O-CG2 3.47Å; K22-V26 PolarHBondContact O-N 2.7Å; T23-V26 PolarHBondContact O-N 3.42Å; V26-F29 PolarHBondContact O-N 2.84Å; V26-T30 HydrophobicContact CG1-CG2 4.19Å; V26-T30 WeakPolarHBondContact O-CB 3.4Å; V26-T30 VanDerWaalsContact O-CG2 3.27Å; V26-T30 WeakPolarHBondContact O-CG2 3.37Å; V26-T30 PolarHBondContact O-N 3.38Å; V26-T30 PolarHBondContact O-OG1 3.24Å; V26-M47 HydrophobicContact CG1-CB 4.19Å; V26-M47 HydrophobicContact CG1-CG 4.13Å; V26-M47 HydrophobicContact CG1-SD 4.4Å; V26-I62 HydrophobicContact CB-CG2 4.43Å; V26-I62 HydrophobicContact CG1-CG2 3.96Å; V26-I62 HydrophobicContact CG2-CG2 3.73Å; V26-D64 HydrophobicContact CG2-CB 3.94Å
27	R	95.8	Very high	94.2	Very high	67 Å²	67	41.2 Å²	41.2	25%	0.253	27%	0.266	S	S	.	.	H	α-helix	trans	-68.9	-37	-178.1	-68.2	-176.6	72	172	6.1	112.6	T23 L25 Q31 G32 L33 P35	T23-R27 HydrophobicContact CG2-CG 4.32Å; T23-R27 WeakPolarHBondContact O-CB 3.29Å; T23-R27 VanDerWaalsContact O-CG 3.27Å; T23-R27 WeakPolarHBondContact O-CG 3.42Å; T23-R27 PolarHBondContact O-N 2.85Å; L25-R27 PolarHBondContact O-N 3.04Å; R27-Q31 WeakPolarHBondContact O-CA 3.31Å; R27-Q31 VanDerWaalsContact O-CB 3.31Å; R27-Q31 WeakPolarHBondContact O-CB 3.14Å; R27-Q31 PolarHBondContact O-N 2.91Å; R27-G32 PolarHBondContact O-N 3.15Å; R27-L33 CarbonylContact C-O 3.48Å; R27-L33 PolarHBondContact O-N 3.2Å; R27-P35 VanDerWaalsContact NH1-CG 3.33Å
28	R	97.5	Very high	93.6	Very high	51 Å²	51	43 Å²	43	19%	0.192	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-46.4	174.5	178	59.9	72.1	-178.6	17.8	110.3	C24 L25 G32 L33 A153 K154 V159	C24-R28 WeakPolarHBondContact O-CB 3.45Å; C24-R28 PolarHBondContact O-N 3.13Å; L25-R28 PolarHBondContact O-N 2.76Å; R28-G32 PolarHBondContact NH1-O 3.02Å; R28-G32 WeakPolarHBondContact O-CA 3.4Å; R28-G32 PolarHBondContact O-N 3.3Å; R28-L33 WeakPolarHBondContact CA-O 3.49Å; R28-L33 PolarHBondContact N-O 3.19Å; R28-A153 PolarHBondContact NE-O 3.27Å; R28-K154 PolarHBondContact NH2-O 3.38Å; R28-V159 HydrophobicContact CB-CG1 4.14Å; R28-V159 HydrophobicContact CG-CB 4.2Å; R28-V159 HydrophobicContact CG-CG1 3.9Å; R28-V159 HydrophobicContact CG-CG2 4.06Å
29	F	98.2	Very high	93.2	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.035	28%	0.283	C	S	.	.	H	α-helix	trans	-67.4	-47.2	178.9	178.7	-117.2	0	0	0	113	L25 V26 K49 V51 L60 I62 V159 F163	L25-F29 WeakPolarHBondContact O-CB 3.49Å; L25-F29 PolarHBondContact O-N 3.02Å; V26-F29 PolarHBondContact O-N 2.84Å; F29-K49 HydrophobicContact CD1-CD 3.86Å; F29-K49 HydrophobicContact CD2-CD 4.44Å; F29-K49 HydrophobicContact CE1-CB 4.1Å; F29-K49 HydrophobicContact CE1-CD 3.42Å; F29-K49 VanDerWaalsContact CE1-CD 3.42Å; F29-K49 HydrophobicContact CE1-CG 4.32Å; F29-K49 HydrophobicContact CE2-CD 4.05Å; F29-K49 HydrophobicContact CG-CD 4.36Å; F29-K49 HydrophobicContact CZ-CD 3.53Å; F29-K49 WeakPolarHBondContact O-CE 3.49Å; F29-K49 PolarHBondContact O-NZ 3.18Å; F29-V51 HydrophobicContact CZ-CG1 4.04Å; F29-L60 HydrophobicContact CE1-CD1 4.03Å; F29-L60 HydrophobicContact CZ-CD1 4.1Å; F29-I62 HydrophobicContact CD1-CD1 3.59Å; F29-I62 HydrophobicContact CE1-CD1 3.71Å; F29-V159 HydrophobicContact CB-CG1 3.89Å; F29-F163 HydrophobicContact CB-CD2 3.61Å; F29-F163 HydrophobicContact CB-CE2 3.55Å; F29-F163 HydrophobicContact CB-CG 4.48Å; F29-F163 HydrophobicContact CB-CZ 4.37Å; F29-F163 HydrophobicContact CD1-CB 4.06Å; F29-F163 AromaticContact CD1-CD1 4Å; F29-F163 HydrophobicContact CD1-CD1 4Å; F29-F163 AromaticContact CD1-CD2 3.61Å; F29-F163 HydrophobicContact CD1-CD2 3.61Å; F29-F163 HydrophobicContact CD1-CE1 4.35Å; F29-F163 HydrophobicContact CD1-CE2 4.02Å; F29-F163 AromaticContact CD1-CG 3.62Å; F29-F163 HydrophobicContact CD1-CG 3.62Å; F29-F163 HydrophobicContact CD1-CZ 4.37Å; F29-F163 HydrophobicContact CD2-CB 3.95Å; F29-F163 AromaticContact CD2-CD2 3.62Å; F29-F163 HydrophobicContact CD2-CD2 3.62Å; F29-F163 HydrophobicContact CD2-CE2 4.45Å; F29-F163 HydrophobicContact CD2-CG 4.01Å; F29-F163 HydrophobicContact CE1-CB 3.66Å; F29-F163 HydrophobicContact CE1-CD1 4.04Å; F29-F163 HydrophobicContact CE1-CD2 4.13Å; F29-F163 AromaticContact CE1-CG 3.69Å; F29-F163 HydrophobicContact CE1-CG 3.69Å; F29-F163 HydrophobicContact CE2-CB 3.55Å; F29-F163 HydrophobicContact CE2-CD2 4.15Å; F29-F163 HydrophobicContact CE2-CG 4.09Å; F29-F163 HydrophobicContact CG-CB 4.18Å; F29-F163 AromaticContact CG-CD2 3.31Å; F29-F163 HydrophobicContact CG-CD2 3.31Å; F29-F163 AromaticContact CG-CE2 3.76Å; F29-F163 HydrophobicContact CG-CE2 3.76Å; F29-F163 AromaticContact CG-CG 3.77Å; F29-F163 HydrophobicContact CG-CG 3.77Å; F29-F163 HydrophobicContact CZ-CB 3.38Å; F29-F163 HydrophobicContact CZ-CD2 4.37Å; F29-F163 AromaticContact CZ-CG 3.92Å; F29-F163 HydrophobicContact CZ-CG 3.92Å
30	T	96.7	Very high	92.8	Very high	29 Å²	29	44.2 Å²	44.2	18%	0.178	28%	0.283	C	S	.	.	H	α-helix	trans	-82.6	-35.1	-170.9	55.6	0	0	0	0	113.5	V26 M47 K49 I62	V26-T30 HydrophobicContact CG1-CG2 4.19Å; V26-T30 WeakPolarHBondContact O-CB 3.4Å; V26-T30 VanDerWaalsContact O-CG2 3.27Å; V26-T30 WeakPolarHBondContact O-CG2 3.37Å; V26-T30 PolarHBondContact O-N 3.38Å; V26-T30 PolarHBondContact O-OG1 3.24Å; T30-M47 HydrophobicContact CG2-CB 3.98Å; T30-M47 HydrophobicContact CG2-SD 4.29Å; T30-M47 PolarHBondContact OG1-SD 3.33Å; T30-K49 HydrophobicContact CG2-CB 4.28Å; T30-I62 HydrophobicContact CG2-CD1 3.9Å
31	Q	95.5	Very high	92.1	Very high	82 Å²	82	45.4 Å²	45.4	38%	0.383	29%	0.29	S	S	.	.	H	α-helix	trans	-117.9	-11	-172.2	-57.5	167.6	-0.5	0	0	112.6	R27 L33 M47	R27-Q31 WeakPolarHBondContact O-CA 3.31Å; R27-Q31 VanDerWaalsContact O-CB 3.31Å; R27-Q31 WeakPolarHBondContact O-CB 3.14Å; R27-Q31 PolarHBondContact O-N 2.91Å; Q31-L33 HydrophobicContact CB-CB 4.21Å; Q31-L33 HydrophobicContact CB-CD1 3.99Å; Q31-L33 HydrophobicContact CB-CG 3.89Å; Q31-L33 PolarHBondContact O-N 2.97Å; Q31-M47 HydrophobicContact CG-CE 4.2Å; Q31-M47 HydrophobicContact CG-SD 4.3Å; Q31-M47 VanDerWaalsContact NE2-CE 3.32Å; Q31-M47 PolarHBondContact NE2-SD 3.31Å
32	G	95.9	Very high	91.3	Very high	43 Å²	43	51.5 Å²	51.5	44%	0.443	32%	0.319	S	S	.	.	S	Bend	trans	71.1	16.7	-171.5	0	0	0	0	0	113.3	R27 R28	R27-G32 PolarHBondContact O-N 3.15Å; R28-G32 PolarHBondContact NH1-O 3.02Å; R28-G32 WeakPolarHBondContact O-CA 3.4Å; R28-G32 PolarHBondContact O-N 3.3Å
33	L	93.7	Very high	90.6	Very high	88 Å²	88	51.8 Å²	51.8	46%	0.461	32%	0.324	S	S	.	.			trans	-111.4	144.9	-170.7	-62.5	179.7	0	0	0	113.3	R27 R28 Q31	R27-L33 CarbonylContact C-O 3.48Å; R27-L33 PolarHBondContact O-N 3.2Å; R28-L33 WeakPolarHBondContact CA-O 3.49Å; R28-L33 PolarHBondContact N-O 3.19Å; Q31-L33 HydrophobicContact CB-CB 4.21Å; Q31-L33 HydrophobicContact CB-CD1 3.99Å; Q31-L33 HydrophobicContact CB-CG 3.89Å; Q31-L33 PolarHBondContact O-N 2.97Å
34	F	93.3	Very high	90.1	Very high	76 Å²	76	53 Å²	53	33%	0.333	33%	0.331	S	S	.	.			trans	-134.3	91.5	165.5	-174.9	-90.3	0	0	0	109	C24 A153 K154	C24-F34 HydrophobicContact CB-CD2 3.9Å; C24-F34 HydrophobicContact CB-CE2 3.73Å; F34-A153 HydrophobicContact CD2-CB 4.09Å; F34-A153 WeakPolarHBondContact CD2-O 3.49Å; F34-A153 HydrophobicContact CE2-CB 4.04Å; F34-K154 HydrophobicContact CD1-CB 4.33Å; F34-K154 HydrophobicContact CD1-CG 4.04Å; F34-K154 HydrophobicContact CD2-CB 4.22Å; F34-K154 HydrophobicContact CE1-CB 3.99Å; F34-K154 HydrophobicContact CE1-CD 4.46Å; F34-K154 HydrophobicContact CE1-CG 3.76Å; F34-K154 HydrophobicContact CE2-CB 3.86Å; F34-K154 HydrophobicContact CG-CB 4.44Å; F34-K154 HydrophobicContact CZ-CB 3.74Å; F34-K154 HydrophobicContact CZ-CG 4.02Å
35	P	84.4	Confident	89.8	Confident	34 Å²	34	56.4 Å²	56.4	22%	0.221	35%	0.348	C	S	.	.			trans	-75.2	139.6	-178.5	26.1	-27.4	0	0	0	111	R27	R27-P35 VanDerWaalsContact NH1-CG 3.33Å
36	P	82.2	Confident	89.5	Confident	127 Å²	127	60 Å²	60	83%	0.825	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	141.2	173.7	27.9	-33.7	0	0	0	110.2
37	G	81	Confident	89.4	Confident	80 Å²	80	62 Å²	62	83%	0.825	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	31.9	173.5	0	0	0	0	0	115.1	G39	G37-G39 PolarHBondContact O-N 3.41Å
38	Q	84	Confident	89.4	Confident	69 Å²	69	62.7 Å²	62.7	32%	0.322	38%	0.382	S	S	.	.			trans	-51	113.3	173.6	-179.5	60.6	64.4	0	0	110.6	T23	T23-Q38 HydrophobicContact CG2-CG 4.22Å
39	G	84.5	Confident	89.4	Confident	48 Å²	48	62.9 Å²	62.9	50%	0.495	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-72.2	170	178.9	0	0	0	0	0	112.6	G37 T41	G37-G39 PolarHBondContact O-N 3.41Å; G39-T41 PolarHBondContact O-N 3Å
40	A	85.6	Confident	89.3	Confident	73 Å²	73	65.4 Å²	65.4	60%	0.603	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-63	131.2	175.3	0	0	0	0	0	111.1	I42	A40-I42 PolarHBondContact O-N 3.4Å
41	T	83.7	Confident	89.4	Confident	27 Å²	27	64.8 Å²	64.8	17%	0.166	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-63.4	132.1	171.1	-43.7	0	0	0	0	109.9	T23 G39 A66	T23-T41 PolarHBondContact OG1-OG1 3.02Å; G39-T41 PolarHBondContact O-N 3Å; T41-A66 VanDerWaalsContact O-CB 3.23Å; T41-A66 WeakPolarHBondContact O-CB 3.38Å
42	I	79.7	Confident	89.4	Confident	139 Å²	139	67.7 Å²	67.7	71%	0.713	41%	0.41	S	S	*	.			trans	-106.1	122.6	173.2	-62.2	175.8	0	0	0	106.9	A40 V44 F71	A40-I42 PolarHBondContact O-N 3.4Å; I42-V44 PolarHBondContact O-N 2.86Å; I42-F71 HydrophobicContact CG2-CE1 4.43Å; I42-F71 HydrophobicContact CG2-CE2 4.34Å; I42-F71 HydrophobicContact CG2-CZ 3.84Å
43	G	81.8	Confident	89.5	Confident	14 Å²	14	66.2 Å²	66.2	14%	0.144	39%	0.392	C	S	.	.	S	Bend	trans	71.1	-126.4	-177.5	0	0	0	0	0	112.7	A66	G43-A66 WeakPolarHBondContact O-CB 3.35Å; G43-A66 PolarHBondContact O-N 2.64Å
44	V	86.8	Confident	89.5	Confident	39 Å²	39	69.1 Å²	69.1	24%	0.236	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	132.8	-175.7	-177.9	0	0	0	0	109.5	I42 W63 D64 T65 I74 Y78	I42-V44 PolarHBondContact O-N 2.86Å; V44-W63 HydrophobicContact CG1-CB 4.41Å; V44-W63 HydrophobicContact CG1-CE3 3.72Å; V44-W63 HydrophobicContact CG1-CZ3 4.47Å; V44-D64 CarbonylContact C-O 3.44Å; V44-D64 VanDerWaalsContact CA-O 3.31Å; V44-D64 WeakPolarHBondContact CA-O 3.4Å; V44-D64 WeakPolarHBondContact CG1-O 3.37Å; V44-T65 HydrophobicContact CG1-CG2 4.34Å; V44-T65 HydrophobicContact CG2-CG2 4.28Å; V44-I74 HydrophobicContact CG2-CG2 3.8Å; V44-Y78 HydrophobicContact CB-CE2 4.21Å; V44-Y78 HydrophobicContact CG1-CE1 4.3Å; V44-Y78 HydrophobicContact CG1-CE2 4.29Å; V44-Y78 HydrophobicContact CG2-CD2 4.08Å; V44-Y78 HydrophobicContact CG2-CE2 3.56Å
45	D	90.7	Very high	89.5	Confident	87 Å²	87	68.1 Å²	68.1	47%	0.465	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	151.6	172.2	-162	1.6	0	0	0	110.1	D64	D45-D64 HydrophobicContact CB-CB 4.32Å; D45-D64 PolarHBondContact N-O 2.8Å; D45-D64 PolarHBondContact O-N 2.96Å
46	F	92.1	Very high	90.1	Very high	76 Å²	76	68.3 Å²	68.3	33%	0.333	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	124.4	-172.5	173.3	-109.9	0	0	0	111.1	I48 Q61 W63	F46-I48 HydrophobicContact CE1-CD1 3.7Å; F46-I48 HydrophobicContact CE1-CG1 3.59Å; F46-I48 HydrophobicContact CE2-CG1 4.15Å; F46-I48 HydrophobicContact CZ-CD1 3.58Å; F46-I48 HydrophobicContact CZ-CG1 3.32Å; F46-Q61 HydrophobicContact CE2-CB 3.8Å; F46-Q61 HydrophobicContact CE2-CG 3.9Å; F46-Q61 HydrophobicContact CZ-CB 4.34Å; F46-Q61 HydrophobicContact CZ-CG 3.93Å; F46-W63 HydrophobicContact CB-CE3 4.11Å; F46-W63 HydrophobicContact CB-CZ3 4.07Å; F46-W63 AromaticContact CD2-CD2 3.68Å; F46-W63 HydrophobicContact CD2-CD2 3.68Å; F46-W63 AromaticContact CD2-CE2 3.45Å; F46-W63 VanDerWaalsContact CD2-CE2 3.45Å; F46-W63 AromaticContact CD2-CE3 3.98Å; F46-W63 HydrophobicContact CD2-CE3 3.98Å; F46-W63 HydrophobicContact CD2-CG 4.22Å; F46-W63 AromaticContact CD2-CH2 3.99Å; F46-W63 HydrophobicContact CD2-CH2 3.99Å; F46-W63 AromaticContact CD2-CZ2 3.66Å; F46-W63 HydrophobicContact CD2-CZ2 3.66Å; F46-W63 HydrophobicContact CD2-CZ3 4.11Å; F46-W63 AromaticContact CD2-NE1 3.78Å; F46-W63 HydrophobicContact CE2-CD2 4.35Å; F46-W63 AromaticContact CE2-CE2 3.68Å; F46-W63 HydrophobicContact CE2-CH2 4.45Å; F46-W63 AromaticContact CE2-CZ2 3.78Å; F46-W63 HydrophobicContact CE2-CZ2 3.78Å; F46-W63 AromaticContact CE2-NE1 3.71Å; F46-W63 HydrophobicContact CG-CE3 4.41Å; F46-W63 HydrophobicContact CG-CH2 4.3Å; F46-W63 HydrophobicContact CG-CZ2 4.39Å; F46-W63 HydrophobicContact CG-CZ3 4.28Å
47	M	94.6	Very high	90.8	Very high	44 Å²	44	67.2 Å²	67.2	22%	0.217	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.2	175.4	-65.9	-140.4	73.8	0	0	111.2	V26 T30 Q31 I62	V26-M47 HydrophobicContact CG1-CB 4.19Å; V26-M47 HydrophobicContact CG1-CG 4.13Å; V26-M47 HydrophobicContact CG1-SD 4.4Å; T30-M47 HydrophobicContact CG2-CB 3.98Å; T30-M47 HydrophobicContact CG2-SD 4.29Å; T30-M47 PolarHBondContact OG1-SD 3.33Å; Q31-M47 HydrophobicContact CG-CE 4.2Å; Q31-M47 HydrophobicContact CG-SD 4.3Å; Q31-M47 VanDerWaalsContact NE2-CE 3.32Å; Q31-M47 PolarHBondContact NE2-SD 3.31Å; M47-I62 PolarHBondContact N-O 2.84Å; M47-I62 PolarHBondContact O-N 2.81Å
48	I	95.8	Very high	91.6	Very high	82 Å²	82	63.4 Å²	63.4	42%	0.421	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.4	171.8	-59.1	178.9	0	0	0	108.6	F46 K59 L60 Q61	F46-I48 HydrophobicContact CE1-CD1 3.7Å; F46-I48 HydrophobicContact CE1-CG1 3.59Å; F46-I48 HydrophobicContact CE2-CG1 4.15Å; F46-I48 HydrophobicContact CZ-CD1 3.58Å; F46-I48 HydrophobicContact CZ-CG1 3.32Å; I48-K59 HydrophobicContact CG2-CD 4.07Å; I48-K59 HydrophobicContact CG2-CG 3.58Å; I48-L60 VanDerWaalsContact CA-O 3.3Å; I48-L60 WeakPolarHBondContact CA-O 3.31Å; I48-Q61 HydrophobicContact CG1-CG 4.41Å
49	K	97	Very high	92.3	Very high	55 Å²	55	61.3 Å²	61.3	24%	0.239	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.5	165.1	-165.3	-175.9	-171.1	179.8	0	109.3	F29 T30 V51 L60	F29-K49 HydrophobicContact CD1-CD 3.86Å; F29-K49 HydrophobicContact CD2-CD 4.44Å; F29-K49 HydrophobicContact CE1-CB 4.1Å; F29-K49 HydrophobicContact CE1-CD 3.42Å; F29-K49 VanDerWaalsContact CE1-CD 3.42Å; F29-K49 HydrophobicContact CE1-CG 4.32Å; F29-K49 HydrophobicContact CE2-CD 4.05Å; F29-K49 HydrophobicContact CG-CD 4.36Å; F29-K49 HydrophobicContact CZ-CD 3.53Å; F29-K49 WeakPolarHBondContact O-CE 3.49Å; F29-K49 PolarHBondContact O-NZ 3.18Å; T30-K49 HydrophobicContact CG2-CB 4.28Å; K49-V51 HydrophobicContact CD-CG1 4.07Å; K49-V51 HydrophobicContact CG-CG1 4.22Å; K49-L60 PolarHBondContact N-O 2.94Å; K49-L60 WeakPolarHBondContact O-CB 3.12Å; K49-L60 PolarHBondContact O-N 3.42Å
50	T	97.2	Very high	92.9	Very high	62 Å²	62	59 Å²	59	38%	0.38	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	128.9	168	-54.4	0	0	0	0	108.3	K57 V58	T50-K57 HydrophobicContact CG2-CB 4.47Å; T50-V58 WeakPolarHBondContact CA-O 3.32Å
51	V	97.3	Very high	93.5	Very high	16 Å²	16	58 Å²	58	10%	0.097	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	158.4	173.8	-60.6	0	0	0	0	109.3	F29 K49 I53 V58 L60 L164	F29-V51 HydrophobicContact CZ-CG1 4.04Å; K49-V51 HydrophobicContact CD-CG1 4.07Å; K49-V51 HydrophobicContact CG-CG1 4.22Å; V51-I53 HydrophobicContact CG2-CD1 4.04Å; V51-I53 HydrophobicContact CG2-CG1 4.25Å; V51-V58 HydrophobicContact CG2-CB 3.97Å; V51-V58 PolarHBondContact N-O 2.9Å; V51-V58 PolarHBondContact O-N 3.45Å; V51-L60 HydrophobicContact CG2-CD1 4.27Å; V51-L164 HydrophobicContact CB-CD2 4.16Å; V51-L164 HydrophobicContact CG1-CD2 4.17Å; V51-L164 HydrophobicContact CG2-CD2 4.1Å
52	E	97	Very high	94.1	Very high	142 Å²	142	56.7 Å²	56.7	66%	0.664	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.4	175	-169.1	177.9	151.5	0	0	109.2	E56	E52-E56 WeakPolarHBondContact CA-O 3.45Å
53	I	96.6	Very high	94.9	Very high	13 Å²	13	52.7 Å²	52.7	7%	0.067	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.1	-179.6	-66.6	171.8	0	0	0	107.2	V51 G55 E56 V58 L164 A167 I171	V51-I53 HydrophobicContact CG2-CD1 4.04Å; V51-I53 HydrophobicContact CG2-CG1 4.25Å; I53-G55 PolarHBondContact O-N 3.02Å; I53-E56 PolarHBondContact N-O 2.86Å; I53-E56 WeakPolarHBondContact O-CB 3.38Å; I53-E56 PolarHBondContact O-N 3.26Å; I53-V58 HydrophobicContact CB-CG2 4.35Å; I53-V58 HydrophobicContact CD1-CG2 4.32Å; I53-L164 HydrophobicContact CD1-CD2 4.37Å; I53-A167 HydrophobicContact CD1-CB 3.43Å; I53-A167 VanDerWaalsContact CD1-CB 3.43Å; I53-I171 HydrophobicContact CB-CD1 4.11Å; I53-I171 HydrophobicContact CD1-CD1 4.26Å; I53-I171 HydrophobicContact CG2-CD1 3.87Å
54	N	93.9	Very high	95.4	Very high	149 Å²	149	52.1 Å²	52.1	80%	0.797	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	37.3	-179.1	-57.2	-39.9	0	0	0	114.1	E56	N54-E56 VanDerWaalsContact C-N 3.27Å; N54-E56 PolarHBondContact O-N 2.97Å
55	G	94.4	Very high	95.5	Very high	55 Å²	55	50.3 Å²	50.3	57%	0.567	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-1.3	-178	0	0	0	0	0	114.9	I53	I53-G55 PolarHBondContact O-N 3.02Å
56	E	95.7	Very high	95.3	Very high	37 Å²	37	46.2 Å²	46.2	17%	0.173	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.3	178	-61.7	175.8	119	0	0	110.6	D7 F8 E52 I53 N54 R175	D7-E56 HydrophobicContact CB-CB 4.13Å; D7-E56 VanDerWaalsContact OD2-CA 3.31Å; D7-E56 WeakPolarHBondContact OD2-CA 3.19Å; F8-E56 HydrophobicContact CE2-CB 4.47Å; F8-E56 WeakPolarHBondContact CE2-OE1 3.41Å; E52-E56 WeakPolarHBondContact CA-O 3.45Å; I53-E56 PolarHBondContact N-O 2.86Å; I53-E56 WeakPolarHBondContact O-CB 3.38Å; I53-E56 PolarHBondContact O-N 3.26Å; N54-E56 VanDerWaalsContact C-N 3.27Å; N54-E56 PolarHBondContact O-N 2.97Å; E56-R175 IonicContact OE1-CZ 3.68Å; E56-R175 IonicContact OE1-NH2 2.64Å; E56-R175 PolarHBondContact OE1-NH2 2.91Å; E56-R175 IonicContact OE2-CZ 3.49Å; E56-R175 IonicContact OE2-NH1 3.92Å; E56-R175 IonicContact OE2-NH2 2.65Å; E56-R175 PolarHBondContact OE2-NH2 3.1Å
57	K	97.2	Very high	94.6	Very high	104 Å²	104	43.1 Å²	43.1	45%	0.452	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	116.1	175.6	-71.6	178.5	-178.2	176.1	0	109.9	D5 D7 F8 T50	D5-K57 VanDerWaalsContact O-CD 3.25Å; D5-K57 WeakPolarHBondContact O-CD 3.31Å; D7-K57 PolarHBondContact N-O 3.38Å; D7-K57 PolarHBondContact OD2-N 3.12Å; F8-K57 PolarHBondContact N-O 3.38Å; T50-K57 HydrophobicContact CG2-CB 4.47Å
58	V	98.1	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.1	-178.2	-175.3	0	0	0	0	109.1	F8 F10 T50 V51 I53 L60 A167 I171	F8-V58 HydrophobicContact CB-CG1 4.19Å; F8-V58 HydrophobicContact CB-CG2 4.37Å; F8-V58 HydrophobicContact CD2-CG2 4.32Å; F10-V58 HydrophobicContact CD2-CG1 3.66Å; F10-V58 HydrophobicContact CE2-CG1 3.86Å; T50-V58 WeakPolarHBondContact CA-O 3.32Å; V51-V58 HydrophobicContact CG2-CB 3.97Å; V51-V58 PolarHBondContact N-O 2.9Å; V51-V58 PolarHBondContact O-N 3.45Å; I53-V58 HydrophobicContact CB-CG2 4.35Å; I53-V58 HydrophobicContact CD1-CG2 4.32Å; V58-L60 HydrophobicContact CG1-CD2 3.73Å; V58-L60 HydrophobicContact CG1-CG 4.37Å; V58-A167 HydrophobicContact CG1-CB 4.4Å; V58-I171 HydrophobicContact CG2-CD1 3.75Å; V58-I171 HydrophobicContact CG2-CG1 4.33Å
59	K	97.7	Very high	93	Very high	26 Å²	26	47.1 Å²	47.1	11%	0.113	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112	176.3	-169.2	169.4	-70.3	174.9	0	109.6	E4 Y6 F8 L9 F10 I48	E4-K59 PolarHBondContact O-NZ 3.09Å; Y6-K59 HydrophobicContact CD1-CB 4.37Å; Y6-K59 HydrophobicContact CD1-CD 3.94Å; Y6-K59 VanDerWaalsContact CD1-NZ 3.27Å; Y6-K59 HydrophobicContact CD2-CB 4.48Å; Y6-K59 HydrophobicContact CE1-CD 4.16Å; Y6-K59 HydrophobicContact CG-CB 4.06Å; Y6-K59 HydrophobicContact CG-CD 4.48Å; F8-K59 PolarHBondContact O-N 2.96Å; L9-K59 WeakPolarHBondContact CA-O 3.41Å; L9-K59 HydrophobicContact CD1-CB 3.89Å; L9-K59 HydrophobicContact CD1-CD 4.01Å; L9-K59 HydrophobicContact CD1-CG 3.83Å; F10-K59 PolarHBondContact N-O 3.29Å; I48-K59 HydrophobicContact CG2-CD 4.07Å; I48-K59 HydrophobicContact CG2-CG 3.58Å
60	L	98.2	Very high	92.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.4	177.2	-57.1	-178.8	0	0	0	109.9	F10 I12 F29 I48 K49 V51 V58 I62 A167	F10-L60 HydrophobicContact CB-CD2 4.08Å; F10-L60 HydrophobicContact CD2-CD2 4.15Å; I12-L60 HydrophobicContact CD1-CD1 4.33Å; I12-L60 HydrophobicContact CD1-CD2 3.97Å; F29-L60 HydrophobicContact CE1-CD1 4.03Å; F29-L60 HydrophobicContact CZ-CD1 4.1Å; I48-L60 VanDerWaalsContact CA-O 3.3Å; I48-L60 WeakPolarHBondContact CA-O 3.31Å; K49-L60 PolarHBondContact N-O 2.94Å; K49-L60 WeakPolarHBondContact O-CB 3.12Å; K49-L60 PolarHBondContact O-N 3.42Å; V51-L60 HydrophobicContact CG2-CD1 4.27Å; V58-L60 HydrophobicContact CG1-CD2 3.73Å; V58-L60 HydrophobicContact CG1-CG 4.37Å; L60-I62 HydrophobicContact CB-CD1 4.37Å; L60-I62 HydrophobicContact CB-CG1 4.14Å; L60-A167 HydrophobicContact CD1-CB 4.46Å; L60-A167 HydrophobicContact CD2-CB 4.17Å
61	Q	97.5	Very high	91.3	Very high	51 Å²	51	53.6 Å²	53.6	24%	0.238	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	102	169.7	-77.9	-174.6	-29.1	0	0	108.9	L9 F10 K11 I12 F46 I48	L9-Q61 HydrophobicContact CD1-CG 3.75Å; F10-Q61 WeakPolarHBondContact O-CB 3.34Å; F10-Q61 PolarHBondContact O-N 3.38Å; K11-Q61 WeakPolarHBondContact CA-O 3.42Å; I12-Q61 PolarHBondContact N-O 3.3Å; F46-Q61 HydrophobicContact CE2-CB 3.8Å; F46-Q61 HydrophobicContact CE2-CG 3.9Å; F46-Q61 HydrophobicContact CZ-CB 4.34Å; F46-Q61 HydrophobicContact CZ-CG 3.93Å; I48-Q61 HydrophobicContact CG1-CG 4.41Å
62	I	97.6	Very high	90.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.7	-173.2	-53.1	173.8	0	0	0	108.9	I12 L14 V26 F29 T30 M47 L60 F163	I12-I62 WeakPolarHBondContact O-CA 3.41Å; L14-I62 HydrophobicContact CD1-CG2 3.46Å; L14-I62 VanDerWaalsContact CD1-CG2 3.46Å; V26-I62 HydrophobicContact CB-CG2 4.43Å; V26-I62 HydrophobicContact CG1-CG2 3.96Å; V26-I62 HydrophobicContact CG2-CG2 3.73Å; F29-I62 HydrophobicContact CD1-CD1 3.59Å; F29-I62 HydrophobicContact CE1-CD1 3.71Å; T30-I62 HydrophobicContact CG2-CD1 3.9Å; M47-I62 PolarHBondContact N-O 2.84Å; M47-I62 PolarHBondContact O-N 2.81Å; L60-I62 HydrophobicContact CB-CD1 4.37Å; L60-I62 HydrophobicContact CB-CG1 4.14Å; I62-F163 HydrophobicContact CD1-CD1 4.05Å; I62-F163 HydrophobicContact CD1-CE1 3.86Å; I62-F163 HydrophobicContact CG1-CE1 4.39Å; I62-F163 HydrophobicContact CG2-CE1 4.18Å
63	W	95.4	Very high	89.7	Confident	54 Å²	54	52.5 Å²	52.5	21%	0.205	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	111.5	179.1	-61.8	79.7	0	0	0	109.1	I12 V13 L14 V44 F46 Y78	I12-W63 PolarHBondContact O-N 3.23Å; V13-W63 HydrophobicContact CB-CB 4.4Å; V13-W63 HydrophobicContact CG1-CB 4.24Å; V13-W63 HydrophobicContact CG2-CB 4.08Å; V13-W63 HydrophobicContact CG2-CG 4.36Å; L14-W63 PolarHBondContact N-O 2.73Å; V44-W63 HydrophobicContact CG1-CB 4.41Å; V44-W63 HydrophobicContact CG1-CE3 3.72Å; V44-W63 HydrophobicContact CG1-CZ3 4.47Å; F46-W63 HydrophobicContact CB-CE3 4.11Å; F46-W63 HydrophobicContact CB-CZ3 4.07Å; F46-W63 AromaticContact CD2-CD2 3.68Å; F46-W63 HydrophobicContact CD2-CD2 3.68Å; F46-W63 AromaticContact CD2-CE2 3.45Å; F46-W63 VanDerWaalsContact CD2-CE2 3.45Å; F46-W63 AromaticContact CD2-CE3 3.98Å; F46-W63 HydrophobicContact CD2-CE3 3.98Å; F46-W63 HydrophobicContact CD2-CG 4.22Å; F46-W63 AromaticContact CD2-CH2 3.99Å; F46-W63 HydrophobicContact CD2-CH2 3.99Å; F46-W63 AromaticContact CD2-CZ2 3.66Å; F46-W63 HydrophobicContact CD2-CZ2 3.66Å; F46-W63 HydrophobicContact CD2-CZ3 4.11Å; F46-W63 AromaticContact CD2-NE1 3.78Å; F46-W63 HydrophobicContact CE2-CD2 4.35Å; F46-W63 AromaticContact CE2-CE2 3.68Å; F46-W63 HydrophobicContact CE2-CH2 4.45Å; F46-W63 AromaticContact CE2-CZ2 3.78Å; F46-W63 HydrophobicContact CE2-CZ2 3.78Å; F46-W63 AromaticContact CE2-NE1 3.71Å; F46-W63 HydrophobicContact CG-CE3 4.41Å; F46-W63 HydrophobicContact CG-CH2 4.3Å; F46-W63 HydrophobicContact CG-CZ2 4.39Å; F46-W63 HydrophobicContact CG-CZ3 4.28Å; W63-Y78 AromaticContact CD2-CD1 3.91Å; W63-Y78 HydrophobicContact CD2-CD1 3.91Å; W63-Y78 HydrophobicContact CD2-CE1 4.06Å; W63-Y78 AromaticContact CE3-CD1 3.65Å; W63-Y78 HydrophobicContact CE3-CD1 3.65Å; W63-Y78 AromaticContact CE3-CE1 3.34Å; W63-Y78 HydrophobicContact CE3-CE1 3.34Å; W63-Y78 HydrophobicContact CG-CD1 4.46Å; W63-Y78 AromaticContact CH2-CE1 3.95Å; W63-Y78 HydrophobicContact CH2-CE1 3.95Å; W63-Y78 HydrophobicContact CZ3-CD1 4.01Å; W63-Y78 AromaticContact CZ3-CE1 3.3Å; W63-Y78 HydrophobicContact CZ3-CE1 3.3Å
64	D	93	Very high	88.8	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.2	173	179.2	37	0	0	0	109.3	K22 T23 V26 V44 D45	K22-D64 VanDerWaalsContact CB-OD1 3.3Å; K22-D64 WeakPolarHBondContact CB-OD1 3.42Å; T23-D64 VanDerWaalsContact CA-OD2 3.29Å; T23-D64 WeakPolarHBondContact CA-OD2 3.4Å; T23-D64 WeakPolarHBondContact CB-OD2 3.29Å; T23-D64 WeakPolarHBondContact CG2-OD2 3.41Å; T23-D64 PolarHBondContact N-OD1 2.82Å; T23-D64 PolarHBondContact OG1-OD1 3.35Å; T23-D64 PolarHBondContact OG1-OD2 3.01Å; V26-D64 HydrophobicContact CG2-CB 3.94Å; V44-D64 CarbonylContact C-O 3.44Å; V44-D64 VanDerWaalsContact CA-O 3.31Å; V44-D64 WeakPolarHBondContact CA-O 3.4Å; V44-D64 WeakPolarHBondContact CG1-O 3.37Å; D45-D64 HydrophobicContact CB-CB 4.32Å; D45-D64 PolarHBondContact N-O 2.8Å; D45-D64 PolarHBondContact O-N 2.96Å
65	T	89.2	Confident	88.2	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	148.7	-174.7	69.1	0	0	0	0	111.9	V13 L14 K22 V44 G67 T75	V13-T65 HydrophobicContact CG1-CG2 3.6Å; L14-T65 WeakPolarHBondContact O-CB 3.3Å; L14-T65 WeakPolarHBondContact O-CG2 3.36Å; L14-T65 PolarHBondContact O-OG1 2.97Å; K22-T65 WeakPolarHBondContact CE-O 3.46Å; V44-T65 HydrophobicContact CG1-CG2 4.34Å; V44-T65 HydrophobicContact CG2-CG2 4.28Å; T65-G67 PolarHBondContact O-N 2.79Å; T65-T75 HydrophobicContact CG2-CG2 4.11Å
66	A	85.9	Confident	87.7	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.008	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-65	129	168	0	0	0	0	0	110.3	T41 G43 Q68 F71	T41-A66 VanDerWaalsContact O-CB 3.23Å; T41-A66 WeakPolarHBondContact O-CB 3.38Å; G43-A66 WeakPolarHBondContact O-CB 3.35Å; G43-A66 PolarHBondContact O-N 2.64Å; A66-Q68 VanDerWaalsContact C-N 3.3Å; A66-Q68 PolarHBondContact O-N 2.65Å; A66-F71 HydrophobicContact CB-CB 3.86Å; A66-F71 HydrophobicContact CB-CD2 3.58Å; A66-F71 HydrophobicContact CB-CE2 4.48Å; A66-F71 HydrophobicContact CB-CG 4.01Å
67	G	76.5	Confident	87.2	Confident	11 Å²	11	50 Å²	50	11%	0.113	24%	0.24	C	C	.	.			trans	-88.3	8.6	177	0	0	0	0	0	114.5	G16 A18 T65	G16-G67 VanDerWaalsContact O-CA 3.22Å; G16-G67 WeakPolarHBondContact O-CA 3.42Å; A18-G67 PolarHBondContact N-O 3.23Å; T65-G67 PolarHBondContact O-N 2.79Å
68	Q	80.2	Confident	86.8	Confident	83 Å²	83	47.5 Å²	47.5	39%	0.388	23%	0.229	S	C	.	.	S	Bend	trans	-84.9	139.5	179.4	-62.1	-70	13	0	0	110.2	A18 A66 R70 F71	A18-Q68 VanDerWaalsContact CB-CD 3.45Å; A18-Q68 HydrophobicContact CB-CG 3.97Å; A66-Q68 VanDerWaalsContact C-N 3.3Å; A66-Q68 PolarHBondContact O-N 2.65Å; Q68-R70 VanDerWaalsContact C-N 3.27Å; Q68-R70 PolarHBondContact O-N 2.79Å; Q68-F71 HydrophobicContact CB-CD2 3.93Å; Q68-F71 HydrophobicContact CB-CE2 4.45Å; Q68-F71 PolarHBondContact O-N 3.17Å
69	E	77.1	Confident	86.4	Confident	127 Å²	127	47.5 Å²	47.5	59%	0.593	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-51.5	-44.3	-178.2	178.3	-80.6	163.3	0	0	112.7	F71 R72	E69-F71 PolarHBondContact O-N 2.83Å; E69-R72 WeakPolarHBondContact O-CB 3.42Å; E69-R72 WeakPolarHBondContact O-CG 3.23Å; E69-R72 PolarHBondContact O-N 3.14Å
70	R	79.3	Confident	86	Confident	203 Å²	203	56.4 Å²	56.4	77%	0.766	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-61.8	-11.9	-179.4	-64.3	-175.4	-68.9	162	-1.6	114.6	Q68	Q68-R70 VanDerWaalsContact C-N 3.27Å; Q68-R70 PolarHBondContact O-N 2.79Å
71	F	80.4	Confident	85.5	Confident	50 Å²	50	59.9 Å²	59.9	22%	0.219	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-109.8	3.3	176	-59.2	-55.6	0	0	0	113.4	I42 A66 Q68 E69 S73 I74 T75	I42-F71 HydrophobicContact CG2-CE1 4.43Å; I42-F71 HydrophobicContact CG2-CE2 4.34Å; I42-F71 HydrophobicContact CG2-CZ 3.84Å; A66-F71 HydrophobicContact CB-CB 3.86Å; A66-F71 HydrophobicContact CB-CD2 3.58Å; A66-F71 HydrophobicContact CB-CE2 4.48Å; A66-F71 HydrophobicContact CB-CG 4.01Å; Q68-F71 HydrophobicContact CB-CD2 3.93Å; Q68-F71 HydrophobicContact CB-CE2 4.45Å; Q68-F71 PolarHBondContact O-N 3.17Å; E69-F71 PolarHBondContact O-N 2.83Å; F71-S73 VanDerWaalsContact C-N 3.31Å; F71-S73 PolarHBondContact O-N 3.49Å; F71-I74 HydrophobicContact CD1-CD1 4Å; F71-I74 WeakPolarHBondContact O-CB 2.9Å; F71-I74 PolarHBondContact O-N 3.16Å; F71-T75 PolarHBondContact O-N 2.92Å; F71-T75 PolarHBondContact O-OG1 2.9Å
72	R	78.5	Confident	85.5	Confident	53 Å²	53	57.7 Å²	57.7	20%	0.2	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-38.6	-178.2	-80.1	-179.8	-177.3	-148.2	18.4	113.2	E69 I74 T75 Q76 E102 E106	E69-R72 WeakPolarHBondContact O-CB 3.42Å; E69-R72 WeakPolarHBondContact O-CG 3.23Å; E69-R72 PolarHBondContact O-N 3.14Å; R72-I74 PolarHBondContact O-N 3.34Å; R72-T75 WeakPolarHBondContact O-CB 3.48Å; R72-T75 PolarHBondContact O-N 3.47Å; R72-T75 VanDerWaalsContact O-N 3.16Å; R72-Q76 VanDerWaalsContact O-CG 3.31Å; R72-Q76 WeakPolarHBondContact O-CG 3.14Å; R72-Q76 PolarHBondContact O-N 3.45Å; R72-E102 IonicContact CZ-OE2 2.78Å; R72-E102 IonicContact NH1-OE2 3.44Å; R72-E102 PolarHBondContact NH1-OE2 3.04Å; R72-E102 IonicContact NH2-OE2 2.66Å; R72-E102 PolarHBondContact NH2-OE2 3.23Å; R72-E106 WeakPolarHBondContact CD-OE1 3.29Å; R72-E106 IonicContact CZ-OE1 3.73Å; R72-E106 IonicContact NE-OE1 2.84Å; R72-E106 IonicContact NH1-OE1 3.31Å; R72-E106 PolarHBondContact NH1-OE1 2.89Å
73	S	81.5	Confident	85.5	Confident	83 Å²	83	60.6 Å²	60.6	58%	0.58	29%	0.292	S	S	*	.	H	α-helix	trans	-62.3	-31.9	177.1	59.9	0	0	0	0	113.1	F71	F71-S73 VanDerWaalsContact C-N 3.31Å; F71-S73 PolarHBondContact O-N 3.49Å
74	I	78.2	Confident	85.6	Confident	67 Å²	67	58 Å²	58	34%	0.344	28%	0.282	S	S	.	.	H	α-helix	trans	-69.4	-49.3	174.5	-60.8	176.2	0	0	0	108.8	V44 F71 R72 Q76 S77 Y78	V44-I74 HydrophobicContact CG2-CG2 3.8Å; F71-I74 HydrophobicContact CD1-CD1 4Å; F71-I74 WeakPolarHBondContact O-CB 2.9Å; F71-I74 PolarHBondContact O-N 3.16Å; R72-I74 PolarHBondContact O-N 3.34Å; I74-Q76 PolarHBondContact O-N 2.9Å; I74-S77 PolarHBondContact O-N 3.49Å; I74-S77 VanDerWaalsContact O-N 3.15Å; I74-S77 PolarHBondContact O-OG 3.45Å; I74-Y78 HydrophobicContact CG2-CE2 3.87Å; I74-Y78 WeakPolarHBondContact O-CD2 3.28Å; I74-Y78 WeakPolarHBondContact O-CE2 3.29Å
75	T	80.7	Confident	85.8	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-53.8	-39.9	176.4	-56.3	0	0	0	0	111.9	I15 T65 F71 R72 S77 Y78 Y79 W103	I15-T75 HydrophobicContact CG2-CG2 4.03Å; T65-T75 HydrophobicContact CG2-CG2 4.11Å; F71-T75 PolarHBondContact O-N 2.92Å; F71-T75 PolarHBondContact O-OG1 2.9Å; R72-T75 WeakPolarHBondContact O-CB 3.48Å; R72-T75 PolarHBondContact O-N 3.47Å; R72-T75 VanDerWaalsContact O-N 3.16Å; T75-S77 PolarHBondContact O-N 2.94Å; T75-Y78 PolarHBondContact O-N 3.16Å; T75-Y79 HydrophobicContact CG2-CE2 4.21Å; T75-W103 HydrophobicContact CG2-CZ3 4.38Å
76	Q	84.1	Confident	86.3	Confident	52 Å²	52	57.9 Å²	57.9	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-55.2	-37.6	-180	-74.6	168.8	2.9	0	0	114	R72 I74 Y78 Y79 Y110	R72-Q76 VanDerWaalsContact O-CG 3.31Å; R72-Q76 WeakPolarHBondContact O-CG 3.14Å; R72-Q76 PolarHBondContact O-N 3.45Å; I74-Q76 PolarHBondContact O-N 2.9Å; Q76-Y78 PolarHBondContact O-N 3.19Å; Q76-Y79 VanDerWaalsContact CA-CD2 3.41Å; Q76-Y79 HydrophobicContact CB-CD2 4.35Å; Q76-Y79 HydrophobicContact CB-CE2 4.38Å; Q76-Y79 HydrophobicContact CG-CD2 4.44Å; Q76-Y79 HydrophobicContact CG-CE2 4.06Å; Q76-Y79 WeakPolarHBondContact O-CD2 3.42Å; Q76-Y79 PolarHBondContact O-N 2.96Å; Q76-Y110 HydrophobicContact CB-CD2 4.25Å; Q76-Y110 HydrophobicContact CB-CE2 4.37Å; Q76-Y110 HydrophobicContact CB-CG 4.44Å; Q76-Y110 VanDerWaalsContact CD-CE2 3.47Å; Q76-Y110 HydrophobicContact CG-CD2 3.72Å; Q76-Y110 HydrophobicContact CG-CE2 3.58Å; Q76-Y110 HydrophobicContact CG-CG 4.39Å
77	S	85.5	Confident	86.8	Confident	81 Å²	81	57.9 Å²	57.9	57%	0.566	28%	0.281	S	S	*	.	H	α-helix	trans	-65.6	-19.8	179.4	72.9	0	0	0	0	113.7	I74 T75	I74-S77 PolarHBondContact O-N 3.49Å; I74-S77 VanDerWaalsContact O-N 3.15Å; I74-S77 PolarHBondContact O-OG 3.45Å; T75-S77 PolarHBondContact O-N 2.94Å
78	Y	87.9	Confident	87.9	Confident	53 Å²	53	57.3 Å²	57.3	21%	0.208	28%	0.276	C	S	.	.	H	α-helix	trans	-89.2	-19.4	-176.8	-65.4	-86.1	0	0	0	113.9	K11 V44 W63 I74 T75 Q76	K11-Y78 PolarHBondContact NZ-O 3.17Å; V44-Y78 HydrophobicContact CB-CE2 4.21Å; V44-Y78 HydrophobicContact CG1-CE1 4.3Å; V44-Y78 HydrophobicContact CG1-CE2 4.29Å; V44-Y78 HydrophobicContact CG2-CD2 4.08Å; V44-Y78 HydrophobicContact CG2-CE2 3.56Å; W63-Y78 AromaticContact CD2-CD1 3.91Å; W63-Y78 HydrophobicContact CD2-CD1 3.91Å; W63-Y78 HydrophobicContact CD2-CE1 4.06Å; W63-Y78 AromaticContact CE3-CD1 3.65Å; W63-Y78 HydrophobicContact CE3-CD1 3.65Å; W63-Y78 AromaticContact CE3-CE1 3.34Å; W63-Y78 HydrophobicContact CE3-CE1 3.34Å; W63-Y78 HydrophobicContact CG-CD1 4.46Å; W63-Y78 AromaticContact CH2-CE1 3.95Å; W63-Y78 HydrophobicContact CH2-CE1 3.95Å; W63-Y78 HydrophobicContact CZ3-CD1 4.01Å; W63-Y78 AromaticContact CZ3-CE1 3.3Å; W63-Y78 HydrophobicContact CZ3-CE1 3.3Å; I74-Y78 HydrophobicContact CG2-CE2 3.87Å; I74-Y78 WeakPolarHBondContact O-CD2 3.28Å; I74-Y78 WeakPolarHBondContact O-CE2 3.29Å; T75-Y78 PolarHBondContact O-N 3.16Å; Q76-Y78 PolarHBondContact O-N 3.19Å
79	Y	91.1	Very high	88.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-45	-179.1	-66.9	-66.3	0	0	0	113	I15 T75 Q76 S81 A82 L85 E106 I107 Y110	I15-Y79 HydrophobicContact CD1-CE1 3.88Å; I15-Y79 HydrophobicContact CG2-CE1 3.85Å; T75-Y79 HydrophobicContact CG2-CE2 4.21Å; Q76-Y79 VanDerWaalsContact CA-CD2 3.41Å; Q76-Y79 HydrophobicContact CB-CD2 4.35Å; Q76-Y79 HydrophobicContact CB-CE2 4.38Å; Q76-Y79 HydrophobicContact CG-CD2 4.44Å; Q76-Y79 HydrophobicContact CG-CE2 4.06Å; Q76-Y79 WeakPolarHBondContact O-CD2 3.42Å; Q76-Y79 PolarHBondContact O-N 2.96Å; Y79-S81 PolarHBondContact O-N 3.07Å; Y79-A82 WeakPolarHBondContact O-CB 3.28Å; Y79-A82 PolarHBondContact O-N 2.93Å; Y79-L85 HydrophobicContact CD1-CD1 3.85Å; Y79-L85 HydrophobicContact CD1-CD2 3.57Å; Y79-L85 HydrophobicContact CD1-CG 4.38Å; Y79-L85 HydrophobicContact CE1-CD1 4.38Å; Y79-L85 HydrophobicContact CE1-CD2 3.86Å; Y79-E106 HydrophobicContact CE2-CB 4.07Å; Y79-E106 PolarHBondContact OH-OE2 2.92Å; Y79-I107 HydrophobicContact CE1-CG1 4.09Å; Y79-Y110 HydrophobicContact CD2-CD2 4.21Å; Y79-Y110 HydrophobicContact CD2-CG 4.32Å; Y79-Y110 HydrophobicContact CE2-CD2 4.41Å
80	R	88.2	Confident	89.8	Confident	212 Å²	212	48 Å²	48	80%	0.8	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-35.3	-167.9	-179.8	175.2	176.9	167.6	1.1	114.6	Y110	R80-Y110 WeakPolarHBondContact CA-O 3.22Å; R80-Y110 PolarHBondContact N-O 3.27Å
81	S	88.6	Confident	90.7	Very high	73 Å²	73	38.3 Å²	38.3	51%	0.51	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	8.8	-176.8	85.2	0	0	0	0	113.3	K11 Y79	K11-S81 WeakPolarHBondContact CD-O 3.38Å; K11-S81 WeakPolarHBondContact CD-OG 3.5Å; K11-S81 PolarHBondContact NZ-OG 2.96Å; Y79-S81 PolarHBondContact O-N 3.07Å
82	A	96.4	Very high	91.6	Very high	5 Å²	5	37.1 Å²	37.1	4%	0.041	19%	0.193	C	C	.	.			trans	-69	133.8	176.9	0	0	0	0	0	109.5	V13 Y79 L85 V115	V13-A82 HydrophobicContact CG2-CB 3.83Å; Y79-A82 WeakPolarHBondContact O-CB 3.28Å; Y79-A82 PolarHBondContact O-N 2.93Å; A82-L85 HydrophobicContact CB-CD2 4.28Å; A82-L85 HydrophobicContact CB-CG 4.29Å; A82-V115 HydrophobicContact CB-CG2 4.25Å
83	N	97.4	Very high	92.5	Very high	62 Å²	62	36.7 Å²	36.7	33%	0.332	20%	0.198	S	C	.	.	S	Bend	trans	-82.1	-33.2	167.6	-57.6	109.4	0	0	0	110.3	F10 K11 I116 L170	F10-N83 WeakPolarHBondContact CA-OD1 3.46Å; F10-N83 HydrophobicContact CB-CB 4.45Å; F10-N83 HydrophobicContact CD1-CB 4.22Å; K11-N83 PolarHBondContact N-OD1 3.43Å; K11-N83 PolarHBondContact O-N 3.1Å; N83-I116 PolarHBondContact O-N 2.95Å; N83-L170 HydrophobicContact CB-CD2 3.68Å; N83-L170 WeakPolarHBondContact O-CD2 3.41Å
84	A	98.1	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.9	172.7	0	0	0	0	0	113.4	K11 I12 V13 I116 L166 L170	K11-A84 PolarHBondContact O-N 3.06Å; I12-A84 WeakPolarHBondContact CA-O 3.37Å; I12-A84 HydrophobicContact CG1-CB 4.39Å; V13-A84 PolarHBondContact N-O 3.22Å; A84-I116 CarbonylContact C-O 3.43Å; A84-I116 WeakPolarHBondContact CA-O 3.47Å; A84-I116 HydrophobicContact CB-CB 4.23Å; A84-I116 WeakPolarHBondContact CB-O 3.34Å; A84-L166 HydrophobicContact CB-CD1 3.68Å; A84-L166 HydrophobicContact CB-CD2 3.73Å; A84-L166 HydrophobicContact CB-CG 3.95Å; A84-L170 HydrophobicContact CB-CD1 4.03Å; A84-L170 HydrophobicContact CB-CD2 4.24Å; A84-L170 HydrophobicContact CB-CG 4.49Å
85	L	97.6	Very high	94.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.7	175.2	-71.4	160.8	0	0	0	109.5	V13 I15 Y79 A82 I107 A111 V115 I116 T117 V118	V13-L85 HydrophobicContact CB-CD2 3.78Å; V13-L85 HydrophobicContact CG1-CD2 4.32Å; V13-L85 WeakPolarHBondContact O-CA 3.4Å; I15-L85 HydrophobicContact CD1-CD2 4.43Å; I15-L85 HydrophobicContact CG2-CD2 4.27Å; Y79-L85 HydrophobicContact CD1-CD1 3.85Å; Y79-L85 HydrophobicContact CD1-CD2 3.57Å; Y79-L85 HydrophobicContact CD1-CG 4.38Å; Y79-L85 HydrophobicContact CE1-CD1 4.38Å; Y79-L85 HydrophobicContact CE1-CD2 3.86Å; A82-L85 HydrophobicContact CB-CD2 4.28Å; A82-L85 HydrophobicContact CB-CG 4.29Å; L85-I107 HydrophobicContact CD1-CB 4.33Å; L85-I107 HydrophobicContact CD1-CD1 4.24Å; L85-I107 HydrophobicContact CD1-CG1 3.93Å; L85-I107 HydrophobicContact CD1-CG2 3.62Å; L85-A111 HydrophobicContact CD1-CB 3.89Å; L85-V115 HydrophobicContact CB-CG2 4.4Å; L85-V115 HydrophobicContact CD1-CB 4.42Å; L85-V115 HydrophobicContact CD1-CG1 3.97Å; L85-V115 HydrophobicContact CD1-CG2 3.63Å; L85-V115 HydrophobicContact CG-CG2 3.77Å; L85-I116 PolarHBondContact N-O 3.28Å; L85-T117 HydrophobicContact CB-CG2 4.34Å; L85-T117 WeakPolarHBondContact O-CA 3.43Å; L85-V118 PolarHBondContact O-N 3.09Å
86	I	98.5	Very high	95.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	102	173.8	-61.8	175.3	0	0	0	107.2	I12 V13 L14 I15 V120 L162 F163 L166	I12-I86 HydrophobicContact CG2-CD1 3.53Å; I12-I86 HydrophobicContact CG2-CG1 3.86Å; V13-I86 PolarHBondContact O-N 3.24Å; L14-I86 WeakPolarHBondContact CA-O 3.37Å; L14-I86 HydrophobicContact CD1-CD1 4.28Å; L14-I86 HydrophobicContact CG-CB 4.06Å; L14-I86 HydrophobicContact CG-CD1 4.29Å; L14-I86 HydrophobicContact CG-CG2 4.33Å; I15-I86 PolarHBondContact N-O 3.32Å; I86-V120 HydrophobicContact CG2-CB 4.26Å; I86-V120 HydrophobicContact CG2-CG2 3.58Å; I86-L162 HydrophobicContact CD1-CD1 4.26Å; I86-L162 HydrophobicContact CD1-CD2 4.23Å; I86-L162 HydrophobicContact CD1-CG 4.23Å; I86-L162 HydrophobicContact CG2-CD1 4.46Å; I86-L162 HydrophobicContact CG2-CD2 4.29Å; I86-F163 HydrophobicContact CD1-CD1 4.19Å; I86-F163 HydrophobicContact CD1-CE1 3.69Å; I86-F163 HydrophobicContact CD1-CZ 4.14Å; I86-L166 HydrophobicContact CD1-CD2 3.91Å; I86-L166 HydrophobicContact CG1-CD2 3.81Å
87	L	98	Very high	95.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	109.1	177.3	178.5	57.4	0	0	0	109.4	I15 L100 W103 L104 V118 L119 V120 M146	I15-L87 HydrophobicContact CD1-CB 4.39Å; I15-L87 HydrophobicContact CD1-CD1 3.96Å; I15-L87 HydrophobicContact CG1-CB 4.2Å; I15-L87 HydrophobicContact CG1-CD1 3.79Å; L87-L100 HydrophobicContact CD1-CD2 3.71Å; L87-L100 HydrophobicContact CD2-CB 4.49Å; L87-L100 HydrophobicContact CD2-CD2 3.7Å; L87-L100 HydrophobicContact CG-CD2 3.52Å; L87-W103 HydrophobicContact CD1-CB 3.51Å; L87-W103 HydrophobicContact CD1-CG 3.8Å; L87-W103 HydrophobicContact CD2-CB 4.45Å; L87-L104 HydrophobicContact CD2-CD2 3.97Å; L87-L104 HydrophobicContact CD2-CG 4.14Å; L87-V118 PolarHBondContact N-O 3.32Å; L87-L119 HydrophobicContact CD2-CD1 4.35Å; L87-L119 HydrophobicContact CG-CD1 4.22Å; L87-L119 WeakPolarHBondContact O-CA 3.39Å; L87-V120 PolarHBondContact O-N 3.42Å; L87-M146 HydrophobicContact CD2-SD 4.42Å
88	T	98.6	Very high	96.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134	-170.8	-45.6	0	0	0	0	111.6	I15 V20 L25 V120 N122	I15-T88 PolarHBondContact O-N 2.79Å; V20-T88 HydrophobicContact CB-CG2 4.33Å; V20-T88 HydrophobicContact CG2-CG2 3.84Å; L25-T88 HydrophobicContact CD1-CG2 3.99Å; T88-V120 WeakPolarHBondContact CA-O 3.39Å; T88-V120 HydrophobicContact CG2-CB 4.44Å; T88-V120 HydrophobicContact CG2-CG1 4.41Å; T88-N122 HydrophobicContact CG2-CB 3.96Å
89	Y	98.7	Very high	96.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	167.5	166.1	74.6	-83.4	0	0	0	110.8	I91 F97 L100 L119 V120 N122 V132 A137 Y148	Y89-I91 HydrophobicContact CE2-CG2 3.98Å; Y89-F97 AromaticContact CD1-CD2 3.98Å; Y89-F97 HydrophobicContact CD1-CD2 3.98Å; Y89-F97 HydrophobicContact CD2-CB 4.11Å; Y89-F97 AromaticContact CD2-CD2 3.76Å; Y89-F97 HydrophobicContact CD2-CD2 3.76Å; Y89-F97 HydrophobicContact CD2-CG 4.43Å; Y89-F97 AromaticContact CE1-CD2 3.97Å; Y89-F97 HydrophobicContact CE1-CD2 3.97Å; Y89-F97 HydrophobicContact CE1-CE2 4.17Å; Y89-F97 AromaticContact CE2-CD2 3.78Å; Y89-F97 HydrophobicContact CE2-CD2 3.78Å; Y89-F97 HydrophobicContact CE2-CE2 4.46Å; Y89-F97 HydrophobicContact CG-CB 4.44Å; Y89-F97 AromaticContact CG-CD2 3.88Å; Y89-F97 HydrophobicContact CG-CD2 3.88Å; Y89-F97 AromaticContact CZ-CD2 3.89Å; Y89-L100 HydrophobicContact CD1-CD1 4.23Å; Y89-L119 HydrophobicContact CD1-CD1 3.89Å; Y89-L119 HydrophobicContact CD1-CG 4.38Å; Y89-L119 HydrophobicContact CE1-CD1 4.12Å; Y89-L119 HydrophobicContact CE1-CD2 4.38Å; Y89-L119 HydrophobicContact CE1-CG 4.13Å; Y89-V120 VanDerWaalsContact CD1-O 3.31Å; Y89-V120 WeakPolarHBondContact CD1-O 3.15Å; Y89-V120 PolarHBondContact N-O 3.36Å; Y89-N122 PolarHBondContact O-N 3.21Å; Y89-V132 HydrophobicContact CD2-CG2 4.45Å; Y89-V132 HydrophobicContact CE2-CB 3.94Å; Y89-V132 HydrophobicContact CE2-CG1 3.8Å; Y89-V132 HydrophobicContact CE2-CG2 4.26Å; Y89-A137 HydrophobicContact CE1-CB 4.28Å; Y89-A137 WeakPolarHBondContact OH-CB 3.28Å; Y89-Y148 HydrophobicContact CE1-CE2 4.21Å; Y89-Y148 PolarHBondContact OH-OH 2.73Å; Y89-Y148 VanDerWaalsContact OH-OH 3.11Å
90	D	98.7	Very high	97.2	Very high	13 Å²	13	36 Å²	36	7%	0.07	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.9	175.4	175.8	-1.6	0	0	0	109.3	V20 T92 C93 S96 K123	V20-D90 HydrophobicContact CB-CB 4.27Å; V20-D90 HydrophobicContact CG1-CB 4.22Å; D90-T92 PolarHBondContact O-N 2.99Å; D90-T92 VanDerWaalsContact O-N 3.1Å; D90-T92 PolarHBondContact OD1-N 2.89Å; D90-T92 PolarHBondContact OD1-OG1 3.06Å; D90-T92 VanDerWaalsContact OD1-OG1 3.14Å; D90-C93 HydrophobicContact CB-CB 3.92Å; D90-C93 PolarHBondContact O-N 2.85Å; D90-S96 PolarHBondContact N-OG 3.5Å; D90-S96 PolarHBondContact O-OG 2.85Å; D90-K123 WeakPolarHBondContact OD1-CD 3.15Å; D90-K123 WeakPolarHBondContact OD2-CD 3.31Å; D90-K123 VanDerWaalsContact OD2-CE 3.24Å; D90-K123 WeakPolarHBondContact OD2-CE 3.39Å; D90-K123 IonicContact OD2-NZ 3.49Å; D90-K123 PolarHBondContact OD2-NZ 3.39Å
91	I	98.8	Very high	97.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.9	-178.4	65.4	146.6	0	0	0	113.3	Y89 N122 K123 I124 R130 E131 V132	Y89-I91 HydrophobicContact CE2-CG2 3.98Å; I91-N122 WeakPolarHBondContact CG1-O 3.39Å; I91-N122 PolarHBondContact N-O 2.64Å; I91-K123 WeakPolarHBondContact CD1-O 3.3Å; I91-K123 WeakPolarHBondContact CG1-O 3.25Å; I91-I124 HydrophobicContact CD1-CB 4.48Å; I91-I124 HydrophobicContact CD1-CG2 4.27Å; I91-I124 HydrophobicContact CG2-CG2 4.43Å; I91-R130 HydrophobicContact CD1-CB 4.21Å; I91-R130 HydrophobicContact CD1-CG 4.33Å; I91-E131 PolarHBondContact O-N 3.22Å; I91-V132 PolarHBondContact O-N 3.22Å; I91-V132 VanDerWaalsContact O-N 3.1Å
92	T	98.6	Very high	97.9	Very high	26 Å²	26	28.9 Å²	28.9	16%	0.16	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	14.6	177.9	81.2	0	0	0	0	112.6	D90 L126 R129 E131	D90-T92 PolarHBondContact O-N 2.99Å; D90-T92 VanDerWaalsContact O-N 3.1Å; D90-T92 PolarHBondContact OD1-N 2.89Å; D90-T92 PolarHBondContact OD1-OG1 3.06Å; D90-T92 VanDerWaalsContact OD1-OG1 3.14Å; T92-L126 HydrophobicContact CG2-CB 3.56Å; T92-L126 HydrophobicContact CG2-CD1 4.2Å; T92-R129 WeakPolarHBondContact CA-O 3.48Å; T92-R129 VanDerWaalsContact CB-O 3.23Å; T92-R129 WeakPolarHBondContact CB-O 3.36Å; T92-R129 HydrophobicContact CG2-CB 3.83Å; T92-R129 WeakPolarHBondContact CG2-O 3.23Å; T92-E131 VanDerWaalsContact O-CD 3.31Å
93	C	98.4	Very high	97.9	Very high	44 Å²	44	28.7 Å²	28.7	30%	0.297	14%	0.143	S	C	.	.			trans	-139.8	94.3	-179.2	-175.8	0	0	0	0	110.4	D90 E95 S96 E131	D90-C93 HydrophobicContact CB-CB 3.92Å; D90-C93 PolarHBondContact O-N 2.85Å; C93-E95 PolarHBondContact O-N 2.81Å; C93-S96 WeakPolarHBondContact O-CB 3.28Å; C93-S96 PolarHBondContact O-N 2.98Å; C93-S96 PolarHBondContact O-OG 2.87Å; C93-E131 WeakPolarHBondContact CA-OE2 3.32Å
94	E	98.5	Very high	97.8	Very high	31 Å²	31	26.5 Å²	26.5	15%	0.145	13%	0.131	C	C	.	.	H	α-helix	trans	-51.5	-40.2	177.2	174.3	58.7	-161.2	0	0	112.1	S96 F97 R98 E131 R136	E94-S96 VanDerWaalsContact C-N 3.31Å; E94-S96 PolarHBondContact O-N 3.23Å; E94-F97 PolarHBondContact O-N 3.02Å; E94-F97 VanDerWaalsContact O-N 3.13Å; E94-R98 HydrophobicContact CG-CG 4.33Å; E94-R98 WeakPolarHBondContact O-CG 3.48Å; E94-R98 PolarHBondContact O-N 2.89Å; E94-R98 WeakPolarHBondContact OE1-CG 3.33Å; E94-R98 IonicContact OE1-CZ 3.83Å; E94-R98 IonicContact OE1-NE 3.73Å; E94-R98 PolarHBondContact OE1-NE 2.93Å; E94-R98 IonicContact OE1-NH2 3.92Å; E94-E131 HydrophobicContact CB-CB 4.22Å; E94-E131 WeakPolarHBondContact CB-OE2 3.24Å; E94-E131 PolarHBondContact N-OE2 3.38Å; E94-R136 IonicContact OE1-CZ 3.96Å; E94-R136 VanDerWaalsContact OE1-CZ 3.31Å; E94-R136 IonicContact OE1-NH1 3.59Å; E94-R136 PolarHBondContact OE1-NH1 2.91Å; E94-R136 IonicContact OE1-NH2 2.85Å; E94-R136 PolarHBondContact OE1-NH2 3.07Å; E94-R136 IonicContact OE2-CZ 2.93Å; E94-R136 IonicContact OE2-NH1 2.69Å; E94-R136 PolarHBondContact OE2-NH1 2.78Å; E94-R136 IonicContact OE2-NH2 3.66Å
95	E	98.3	Very high	97.6	Very high	109 Å²	109	33.9 Å²	33.9	51%	0.509	16%	0.159	S	C	.	.	H	α-helix	trans	-62	-38.9	179.5	-172.9	59.5	-161.1	0	0	112.1	C93 F97 R98 C99	C93-E95 PolarHBondContact O-N 2.81Å; E95-F97 PolarHBondContact O-N 2.92Å; E95-R98 PolarHBondContact O-N 3.45Å; E95-C99 PolarHBondContact O-N 2.8Å; E95-C99 PolarHBondContact O-SG 2.84Å
96	S	98.2	Very high	97.3	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-63.3	-29.9	177.9	76.3	0	0	0	0	112.7	D90 C93 E94	D90-S96 PolarHBondContact N-OG 3.5Å; D90-S96 PolarHBondContact O-OG 2.85Å; C93-S96 WeakPolarHBondContact O-CB 3.28Å; C93-S96 PolarHBondContact O-N 2.98Å; C93-S96 PolarHBondContact O-OG 2.87Å; E94-S96 VanDerWaalsContact C-N 3.31Å; E94-S96 PolarHBondContact O-N 3.23Å
97	F	98.7	Very high	97.1	Very high	10 Å²	10	35.2 Å²	35.2	4%	0.044	17%	0.165	C	C	.	.	H	α-helix	trans	-80.3	-39.2	174.4	-171.5	-91.3	0	0	0	112	Y89 E94 E95 C99 L100 V132 R136 A137 F140	Y89-F97 AromaticContact CD1-CD2 3.98Å; Y89-F97 HydrophobicContact CD1-CD2 3.98Å; Y89-F97 HydrophobicContact CD2-CB 4.11Å; Y89-F97 AromaticContact CD2-CD2 3.76Å; Y89-F97 HydrophobicContact CD2-CD2 3.76Å; Y89-F97 HydrophobicContact CD2-CG 4.43Å; Y89-F97 AromaticContact CE1-CD2 3.97Å; Y89-F97 HydrophobicContact CE1-CD2 3.97Å; Y89-F97 HydrophobicContact CE1-CE2 4.17Å; Y89-F97 AromaticContact CE2-CD2 3.78Å; Y89-F97 HydrophobicContact CE2-CD2 3.78Å; Y89-F97 HydrophobicContact CE2-CE2 4.46Å; Y89-F97 HydrophobicContact CG-CB 4.44Å; Y89-F97 AromaticContact CG-CD2 3.88Å; Y89-F97 HydrophobicContact CG-CD2 3.88Å; Y89-F97 AromaticContact CZ-CD2 3.89Å; E94-F97 PolarHBondContact O-N 3.02Å; E94-F97 VanDerWaalsContact O-N 3.13Å; E95-F97 PolarHBondContact O-N 2.92Å; F97-C99 PolarHBondContact O-N 3.47Å; F97-L100 HydrophobicContact CB-CD1 4.45Å; F97-L100 HydrophobicContact CD1-CD1 4.48Å; F97-L100 HydrophobicContact CD2-CD1 3.36Å; F97-L100 HydrophobicContact CE2-CD1 3.57Å; F97-L100 HydrophobicContact CG-CD1 3.87Å; F97-L100 HydrophobicContact CZ-CD1 4.23Å; F97-L100 VanDerWaalsContact O-CB 3.29Å; F97-L100 WeakPolarHBondContact O-CB 3.46Å; F97-L100 WeakPolarHBondContact O-CD1 3.27Å; F97-L100 WeakPolarHBondContact O-CG 3.27Å; F97-L100 PolarHBondContact O-N 3.38Å; F97-L100 VanDerWaalsContact O-N 3.08Å; F97-V132 HydrophobicContact CB-CG1 4.35Å; F97-V132 HydrophobicContact CB-CG2 3.67Å; F97-V132 HydrophobicContact CD1-CG1 4.26Å; F97-V132 HydrophobicContact CD2-CG1 3.61Å; F97-V132 HydrophobicContact CD2-CG2 4.43Å; F97-V132 HydrophobicContact CE2-CG1 3.88Å; F97-V132 HydrophobicContact CG-CG1 3.81Å; F97-V132 HydrophobicContact CG-CG2 4.04Å; F97-V132 HydrophobicContact CZ-CG1 4.32Å; F97-R136 HydrophobicContact CE1-CG 3.99Å; F97-R136 HydrophobicContact CZ-CG 4.13Å; F97-A137 HydrophobicContact CE2-CB 3.8Å; F97-A137 HydrophobicContact CZ-CB 4.36Å; F97-F140 HydrophobicContact CZ-CB 3.8Å; F97-F140 HydrophobicContact CZ-CD1 4.4Å; F97-F140 HydrophobicContact CZ-CG 4.01Å
98	R	98.3	Very high	97	Very high	155 Å²	155	41.8 Å²	41.8	59%	0.585	20%	0.196	S	C	*	.	H	α-helix	trans	-62.6	-27.6	175.7	-73.1	179.6	-179	178.6	0.3	113.6	E94 E95 L100 P101	E94-R98 HydrophobicContact CG-CG 4.33Å; E94-R98 WeakPolarHBondContact O-CG 3.48Å; E94-R98 PolarHBondContact O-N 2.89Å; E94-R98 WeakPolarHBondContact OE1-CG 3.33Å; E94-R98 IonicContact OE1-CZ 3.83Å; E94-R98 IonicContact OE1-NE 3.73Å; E94-R98 PolarHBondContact OE1-NE 2.93Å; E94-R98 IonicContact OE1-NH2 3.92Å; E95-R98 PolarHBondContact O-N 3.45Å; R98-L100 VanDerWaalsContact C-N 3.32Å; R98-P101 VanDerWaalsContact O-CD 3.25Å; R98-P101 WeakPolarHBondContact O-CD 3.37Å
99	C	97.3	Very high	96.7	Very high	13 Å²	13	48.1 Å²	48.1	9%	0.088	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.6	175.2	-65.3	0	0	0	0	114.2	N17 E95 F97 P101 E102 W103	N17-C99 PolarHBondContact ND2-SG 3.19Å; N17-C99 WeakPolarHBondContact OD1-CB 3.34Å; E95-C99 PolarHBondContact O-N 2.8Å; E95-C99 PolarHBondContact O-SG 2.84Å; F97-C99 PolarHBondContact O-N 3.47Å; C99-P101 VanDerWaalsContact C-CD 3.45Å; C99-E102 WeakPolarHBondContact O-CB 3.36Å; C99-E102 PolarHBondContact O-N 2.93Å; C99-W103 VanDerWaalsContact O-CD1 3.28Å; C99-W103 PolarHBondContact O-N 2.94Å
100	L	97.9	Very high	96.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-53.9	-41.3	-177.4	-65.8	173.5	0	0	0	114	L87 Y89 F97 R98 E102 W103 L104 L119 F140	L87-L100 HydrophobicContact CD1-CD2 3.71Å; L87-L100 HydrophobicContact CD2-CB 4.49Å; L87-L100 HydrophobicContact CD2-CD2 3.7Å; L87-L100 HydrophobicContact CG-CD2 3.52Å; Y89-L100 HydrophobicContact CD1-CD1 4.23Å; F97-L100 HydrophobicContact CB-CD1 4.45Å; F97-L100 HydrophobicContact CD1-CD1 4.48Å; F97-L100 HydrophobicContact CD2-CD1 3.36Å; F97-L100 HydrophobicContact CE2-CD1 3.57Å; F97-L100 HydrophobicContact CG-CD1 3.87Å; F97-L100 HydrophobicContact CZ-CD1 4.23Å; F97-L100 VanDerWaalsContact O-CB 3.29Å; F97-L100 WeakPolarHBondContact O-CB 3.46Å; F97-L100 WeakPolarHBondContact O-CD1 3.27Å; F97-L100 WeakPolarHBondContact O-CG 3.27Å; F97-L100 PolarHBondContact O-N 3.38Å; F97-L100 VanDerWaalsContact O-N 3.08Å; R98-L100 VanDerWaalsContact C-N 3.32Å; L100-E102 PolarHBondContact O-N 2.85Å; L100-W103 PolarHBondContact O-N 2.96Å; L100-W103 VanDerWaalsContact O-N 3.12Å; L100-L104 WeakPolarHBondContact O-CG 3.35Å; L100-L104 PolarHBondContact O-N 3.22Å; L100-L119 HydrophobicContact CD1-CD1 3.76Å; L100-L119 HydrophobicContact CD2-CD1 3.97Å; L100-F140 HydrophobicContact CB-CE1 3.84Å; L100-F140 HydrophobicContact CB-CZ 3.61Å; L100-F140 HydrophobicContact CD1-CD1 4.11Å; L100-F140 HydrophobicContact CD1-CE1 3.74Å; L100-F140 HydrophobicContact CD1-CZ 4.24Å; L100-F140 HydrophobicContact CG-CE1 4.41Å
101	P	97.2	Very high	96.3	Very high	64 Å²	64	51.8 Å²	51.8	42%	0.416	24%	0.243	S	C	.	.	H	α-helix	trans	-61.3	-26.6	175.2	-24.4	36.2	0	0	0	114.2	R98 C99 R105 F140	R98-P101 VanDerWaalsContact O-CD 3.25Å; R98-P101 WeakPolarHBondContact O-CD 3.37Å; C99-P101 VanDerWaalsContact C-CD 3.45Å; P101-R105 WeakPolarHBondContact O-CG 3.47Å; P101-R105 PolarHBondContact O-N 3.43Å; P101-F140 HydrophobicContact CG-CE2 4.26Å
102	E	94.4	Very high	96	Very high	71 Å²	71	54.4 Å²	54.4	33%	0.332	26%	0.261	S	S	.	.	H	α-helix	trans	-71.3	-42.8	173.6	-50.4	-163.7	150.1	0	0	111.5	R72 C99 L100 L104 R105 E106	R72-E102 IonicContact CZ-OE2 2.78Å; R72-E102 IonicContact NH1-OE2 3.44Å; R72-E102 PolarHBondContact NH1-OE2 3.04Å; R72-E102 IonicContact NH2-OE2 2.66Å; R72-E102 PolarHBondContact NH2-OE2 3.23Å; C99-E102 WeakPolarHBondContact O-CB 3.36Å; C99-E102 PolarHBondContact O-N 2.93Å; L100-E102 PolarHBondContact O-N 2.85Å; E102-L104 VanDerWaalsContact C-N 3.35Å; E102-R105 PolarHBondContact O-N 3.06Å; E102-E106 PolarHBondContact O-N 3.41Å
103	W	94.8	Very high	95.5	Very high	1 Å²	1	61 Å²	61	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-42.4	175.6	-68.6	104	0	0	0	111.3	I15 G16 N17 T75 L87 C99 L100 R105 E106 I107	I15-W103 HydrophobicContact CB-CE3 4.08Å; I15-W103 HydrophobicContact CB-CZ3 4.21Å; I15-W103 HydrophobicContact CD1-CE3 4.38Å; G16-W103 VanDerWaalsContact CA-CE2 3.47Å; G16-W103 VanDerWaalsContact O-CZ2 3.31Å; G16-W103 WeakPolarHBondContact O-CZ2 3.47Å; N17-W103 PolarHBondContact OD1-NE1 3.48Å; T75-W103 HydrophobicContact CG2-CZ3 4.38Å; L87-W103 HydrophobicContact CD1-CB 3.51Å; L87-W103 HydrophobicContact CD1-CG 3.8Å; L87-W103 HydrophobicContact CD2-CB 4.45Å; C99-W103 VanDerWaalsContact O-CD1 3.28Å; C99-W103 PolarHBondContact O-N 2.94Å; L100-W103 PolarHBondContact O-N 2.96Å; L100-W103 VanDerWaalsContact O-N 3.12Å; W103-R105 VanDerWaalsContact C-N 3.34Å; W103-R105 PolarHBondContact O-N 2.91Å; W103-E106 WeakPolarHBondContact O-CB 3.18Å; W103-E106 PolarHBondContact O-N 2.91Å; W103-E106 VanDerWaalsContact O-N 3.09Å; W103-I107 WeakPolarHBondContact O-CG1 3.41Å; W103-I107 PolarHBondContact O-N 3.28Å
104	L	95.4	Very high	95.2	Very high	16 Å²	16	65.9 Å²	65.9	8%	0.084	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-41.9	176.7	-71.5	174.3	0	0	0	112.5	L87 L100 E102 E106 I107 E108 F140 Q144 M146	L87-L104 HydrophobicContact CD2-CD2 3.97Å; L87-L104 HydrophobicContact CD2-CG 4.14Å; L100-L104 WeakPolarHBondContact O-CG 3.35Å; L100-L104 PolarHBondContact O-N 3.22Å; E102-L104 VanDerWaalsContact C-N 3.35Å; L104-E106 VanDerWaalsContact C-N 3.26Å; L104-E106 PolarHBondContact O-N 3.2Å; L104-I107 HydrophobicContact CD2-CD1 4.09Å; L104-I107 WeakPolarHBondContact O-CB 3.3Å; L104-I107 PolarHBondContact O-N 2.84Å; L104-E108 WeakPolarHBondContact O-CG 3.4Å; L104-E108 PolarHBondContact O-N 2.87Å; L104-F140 HydrophobicContact CD1-CE1 4.04Å; L104-F140 HydrophobicContact CD1-CE2 4.44Å; L104-F140 HydrophobicContact CD1-CZ 3.52Å; L104-Q144 HydrophobicContact CD1-CB 4.43Å; L104-Q144 HydrophobicContact CD1-CG 3.8Å; L104-M146 HydrophobicContact CD1-CE 4.39Å; L104-M146 HydrophobicContact CD2-CE 4.15Å; L104-M146 HydrophobicContact CD2-SD 3.95Å
105	R	94.6	Very high	95.1	Very high	155 Å²	155	65.5 Å²	65.5	59%	0.585	31%	0.311	S	S	*	.	H	α-helix	trans	-59	-37.5	173.9	-75.5	-175.3	-69.3	156.4	-2.6	112.6	P101 E102 W103 Q109	P101-R105 WeakPolarHBondContact O-CG 3.47Å; P101-R105 PolarHBondContact O-N 3.43Å; E102-R105 PolarHBondContact O-N 3.06Å; W103-R105 VanDerWaalsContact C-N 3.34Å; W103-R105 PolarHBondContact O-N 2.91Å; R105-Q109 VanDerWaalsContact O-CB 3.29Å; R105-Q109 WeakPolarHBondContact O-CB 3.28Å; R105-Q109 PolarHBondContact O-N 2.81Å; R105-Q109 VanDerWaalsContact O-N 3.09Å
106	E	92.5	Very high	95	Very high	15 Å²	15	61.7 Å²	61.7	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-41.1	173.7	-66.1	-178.2	-162.5	0	0	111.8	R72 Y79 E102 W103 L104 Q109 Y110	R72-E106 WeakPolarHBondContact CD-OE1 3.29Å; R72-E106 IonicContact CZ-OE1 3.73Å; R72-E106 IonicContact NE-OE1 2.84Å; R72-E106 IonicContact NH1-OE1 3.31Å; R72-E106 PolarHBondContact NH1-OE1 2.89Å; Y79-E106 HydrophobicContact CE2-CB 4.07Å; Y79-E106 PolarHBondContact OH-OE2 2.92Å; E102-E106 PolarHBondContact O-N 3.41Å; W103-E106 WeakPolarHBondContact O-CB 3.18Å; W103-E106 PolarHBondContact O-N 2.91Å; W103-E106 VanDerWaalsContact O-N 3.09Å; L104-E106 VanDerWaalsContact C-N 3.26Å; L104-E106 PolarHBondContact O-N 3.2Å; E106-Q109 PolarHBondContact O-N 3.5Å; E106-Y110 HydrophobicContact CB-CD2 4.2Å; E106-Y110 HydrophobicContact CB-CE2 4.46Å; E106-Y110 WeakPolarHBondContact O-CD2 3.21Å; E106-Y110 PolarHBondContact O-N 2.62Å
107	I	94	Very high	94.9	Very high	13 Å²	13	62.7 Å²	62.7	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-50.5	176.8	-61.4	173	0	0	0	110.1	I15 Y79 L85 W103 L104 Q109 Y110 A111 V115 T117	I15-I107 HydrophobicContact CD1-CD1 3.51Å; I15-I107 HydrophobicContact CD1-CG1 3.77Å; Y79-I107 HydrophobicContact CE1-CG1 4.09Å; L85-I107 HydrophobicContact CD1-CB 4.33Å; L85-I107 HydrophobicContact CD1-CD1 4.24Å; L85-I107 HydrophobicContact CD1-CG1 3.93Å; L85-I107 HydrophobicContact CD1-CG2 3.62Å; W103-I107 WeakPolarHBondContact O-CG1 3.41Å; W103-I107 PolarHBondContact O-N 3.28Å; L104-I107 HydrophobicContact CD2-CD1 4.09Å; L104-I107 WeakPolarHBondContact O-CB 3.3Å; L104-I107 PolarHBondContact O-N 2.84Å; I107-Q109 PolarHBondContact O-N 2.85Å; I107-Y110 PolarHBondContact O-N 3.49Å; I107-A111 HydrophobicContact CG2-CB 3.86Å; I107-A111 WeakPolarHBondContact O-CA 3.26Å; I107-A111 WeakPolarHBondContact O-CB 3.31Å; I107-A111 PolarHBondContact O-N 2.93Å; I107-V115 HydrophobicContact CG2-CG1 4.16Å; I107-T117 HydrophobicContact CD1-CG2 3.96Å
108	E	94.4	Very high	94.9	Very high	138 Å²	138	62.2 Å²	62.2	65%	0.645	30%	0.298	S	S	*	.	H	α-helix	trans	-58.1	-36.9	177.8	-71	172.1	-174	0	0	112.5	L104	L104-E108 WeakPolarHBondContact O-CG 3.4Å; L104-E108 PolarHBondContact O-N 2.87Å
109	Q	93.9	Very high	94.9	Very high	134 Å²	134	54.9 Å²	54.9	63%	0.626	27%	0.27	S	S	*	.	H	α-helix	trans	-78.3	-35.5	-176.9	-172.6	176.7	1.3	0	0	113.4	R105 E106 I107	R105-Q109 VanDerWaalsContact O-CB 3.29Å; R105-Q109 WeakPolarHBondContact O-CB 3.28Å; R105-Q109 PolarHBondContact O-N 2.81Å; R105-Q109 VanDerWaalsContact O-N 3.09Å; E106-Q109 PolarHBondContact O-N 3.5Å; I107-Q109 PolarHBondContact O-N 2.85Å
110	Y	93.7	Very high	95	Very high	75 Å²	75	54.2 Å²	54.2	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-121.3	-19.8	-166	-57.9	-66	0	0	0	115.1	Q76 Y79 R80 E106 I107	Q76-Y110 HydrophobicContact CB-CD2 4.25Å; Q76-Y110 HydrophobicContact CB-CE2 4.37Å; Q76-Y110 HydrophobicContact CB-CG 4.44Å; Q76-Y110 VanDerWaalsContact CD-CE2 3.47Å; Q76-Y110 HydrophobicContact CG-CD2 3.72Å; Q76-Y110 HydrophobicContact CG-CE2 3.58Å; Q76-Y110 HydrophobicContact CG-CG 4.39Å; Y79-Y110 HydrophobicContact CD2-CD2 4.21Å; Y79-Y110 HydrophobicContact CD2-CG 4.32Å; Y79-Y110 HydrophobicContact CE2-CD2 4.41Å; R80-Y110 WeakPolarHBondContact CA-O 3.22Å; R80-Y110 PolarHBondContact N-O 3.27Å; E106-Y110 HydrophobicContact CB-CD2 4.2Å; E106-Y110 HydrophobicContact CB-CE2 4.46Å; E106-Y110 WeakPolarHBondContact O-CD2 3.21Å; E106-Y110 PolarHBondContact O-N 2.62Å; I107-Y110 PolarHBondContact O-N 3.49Å
111	A	94.6	Very high	95.1	Very high	15 Å²	15	54.2 Å²	54.2	12%	0.124	27%	0.266	C	S	.	.	S	Bend	trans	-86.5	165.3	-179.5	0	0	0	0	0	112	L85 I107 V115	L85-A111 HydrophobicContact CD1-CB 3.89Å; I107-A111 HydrophobicContact CG2-CB 3.86Å; I107-A111 WeakPolarHBondContact O-CA 3.26Å; I107-A111 WeakPolarHBondContact O-CB 3.31Å; I107-A111 PolarHBondContact O-N 2.93Å; A111-V115 HydrophobicContact CB-CB 4.33Å; A111-V115 HydrophobicContact CB-CG1 3.79Å
112	S	91.9	Very high	95.1	Very high	54 Å²	54	51.3 Å²	51.3	38%	0.378	25%	0.247	S	C	.	.			trans	-71.8	142.8	170.1	-177.8	0	0	0	0	110.2	K114 V115	S112-K114 PolarHBondContact O-N 3.12Å; S112-K114 PolarHBondContact OG-N 3.24Å; S112-V115 VanDerWaalsContact O-CB 3.29Å; S112-V115 WeakPolarHBondContact O-CB 3.42Å; S112-V115 WeakPolarHBondContact O-CG1 3.39Å; S112-V115 PolarHBondContact O-N 3.35Å
113	N	89.4	Confident	95.3	Very high	166 Å²	166	50.3 Å²	50.3	89%	0.888	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-13.7	171.8	-61.7	-4.3	0	0	0	113.9
114	K	91.1	Very high	95.5	Very high	145 Å²	145	51.9 Å²	51.9	63%	0.63	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	2.3	176.4	-60.9	-171.6	176.8	-167.3	0	113.5	S112 I116 N177	S112-K114 PolarHBondContact O-N 3.12Å; S112-K114 PolarHBondContact OG-N 3.24Å; K114-I116 PolarHBondContact O-N 2.95Å; K114-N177 PolarHBondContact NZ-OD1 2.71Å
115	V	95.6	Very high	95.6	Very high	23 Å²	23	53.4 Å²	53.4	14%	0.139	26%	0.257	C	S	.	.			trans	-67.1	130.5	-178.9	74.3	0	0	0	0	109.6	A82 L85 I107 A111 S112	A82-V115 HydrophobicContact CB-CG2 4.25Å; L85-V115 HydrophobicContact CB-CG2 4.4Å; L85-V115 HydrophobicContact CD1-CB 4.42Å; L85-V115 HydrophobicContact CD1-CG1 3.97Å; L85-V115 HydrophobicContact CD1-CG2 3.63Å; L85-V115 HydrophobicContact CG-CG2 3.77Å; I107-V115 HydrophobicContact CG2-CG1 4.16Å; A111-V115 HydrophobicContact CB-CB 4.33Å; A111-V115 HydrophobicContact CB-CG1 3.79Å; S112-V115 VanDerWaalsContact O-CB 3.29Å; S112-V115 WeakPolarHBondContact O-CB 3.42Å; S112-V115 WeakPolarHBondContact O-CG1 3.39Å; S112-V115 PolarHBondContact O-N 3.35Å
116	I	96.9	Very high	95.8	Very high	29 Å²	29	48.5 Å²	48.5	15%	0.149	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.2	171.4	-57.5	-176.1	0	0	0	107.9	N83 A84 L85 K114 V118 L166 R169 L170 E173	N83-I116 PolarHBondContact O-N 2.95Å; A84-I116 CarbonylContact C-O 3.43Å; A84-I116 WeakPolarHBondContact CA-O 3.47Å; A84-I116 HydrophobicContact CB-CB 4.23Å; A84-I116 WeakPolarHBondContact CB-O 3.34Å; L85-I116 PolarHBondContact N-O 3.28Å; K114-I116 PolarHBondContact O-N 2.95Å; I116-V118 HydrophobicContact CG2-CG2 4.48Å; I116-L166 HydrophobicContact CB-CD1 4.32Å; I116-L166 HydrophobicContact CG2-CD1 3.8Å; I116-R169 HydrophobicContact CD1-CB 3.93Å; I116-L170 HydrophobicContact CD1-CD2 3.68Å; I116-L170 HydrophobicContact CD1-CG 4.04Å; I116-L170 HydrophobicContact CG1-CD2 4.16Å; I116-E173 HydrophobicContact CD1-CG 3.73Å; I116-E173 HydrophobicContact CG1-CG 4.37Å
117	T	97	Very high	96	Very high	25 Å²	25	50.5 Å²	50.5	15%	0.153	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.8	176.2	-51	0	0	0	0	110.6	L85 I107 M146	L85-T117 HydrophobicContact CB-CG2 4.34Å; L85-T117 WeakPolarHBondContact O-CA 3.43Å; I107-T117 HydrophobicContact CD1-CG2 3.96Å; T117-M146 HydrophobicContact CG2-CG 4.14Å; T117-M146 HydrophobicContact CG2-SD 3.48Å; T117-M146 WeakPolarHBondContact CG2-SD 3.38Å
118	V	98.3	Very high	96.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.4	177.2	-177.4	0	0	0	0	108.8	L85 L87 I116 V120 Y147 L149 L162 L166	L85-V118 PolarHBondContact O-N 3.09Å; L87-V118 PolarHBondContact N-O 3.32Å; I116-V118 HydrophobicContact CG2-CG2 4.48Å; V118-V120 HydrophobicContact CG1-CG2 4Å; V118-Y147 CarbonylContact C-O 3.55Å; V118-Y147 WeakPolarHBondContact CA-O 3.43Å; V118-Y147 HydrophobicContact CG1-CD1 3.73Å; V118-Y147 HydrophobicContact CG1-CE1 4.46Å; V118-Y147 HydrophobicContact CG1-CG 4.49Å; V118-Y147 WeakPolarHBondContact CG1-O 3.47Å; V118-Y147 HydrophobicContact CG2-CD1 4.17Å; V118-L149 HydrophobicContact CG1-CD2 3.55Å; V118-L162 HydrophobicContact CG1-CD1 3.9Å; V118-L166 HydrophobicContact CG2-CD1 3.71Å; V118-L166 HydrophobicContact CG2-CD2 4.26Å; V118-L166 HydrophobicContact CG2-CG 4.47Å
119	L	98.8	Very high	96.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.9	169.9	-178.2	67.2	0	0	0	109.9	L87 Y89 L100 F140 M146 Y147 Y148 L149	L87-L119 HydrophobicContact CD2-CD1 4.35Å; L87-L119 HydrophobicContact CG-CD1 4.22Å; L87-L119 WeakPolarHBondContact O-CA 3.39Å; Y89-L119 HydrophobicContact CD1-CD1 3.89Å; Y89-L119 HydrophobicContact CD1-CG 4.38Å; Y89-L119 HydrophobicContact CE1-CD1 4.12Å; Y89-L119 HydrophobicContact CE1-CD2 4.38Å; Y89-L119 HydrophobicContact CE1-CG 4.13Å; L100-L119 HydrophobicContact CD1-CD1 3.76Å; L100-L119 HydrophobicContact CD2-CD1 3.97Å; L119-F140 HydrophobicContact CD2-CD1 3.83Å; L119-F140 HydrophobicContact CD2-CE1 4.46Å; L119-M146 HydrophobicContact CB-CB 4.45Å; L119-M146 HydrophobicContact CB-CE 4.09Å; L119-M146 HydrophobicContact CB-SD 4.31Å; L119-M146 HydrophobicContact CD2-CE 4.47Å; L119-Y147 PolarHBondContact N-O 2.86Å; L119-Y148 HydrophobicContact CB-CD2 4.04Å; L119-Y148 HydrophobicContact CD2-CD2 3.76Å; L119-Y148 HydrophobicContact CD2-CE2 4.22Å; L119-Y148 HydrophobicContact CG-CD2 3.82Å; L119-Y148 HydrophobicContact CG-CE2 4.33Å; L119-Y148 WeakPolarHBondContact O-CA 3.2Å; L119-Y148 WeakPolarHBondContact O-CD2 3.33Å; L119-L149 PolarHBondContact O-N 3.01Å
120	V	98.9	Very high	96.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	117.2	179.5	179.9	0	0	0	0	111.2	L25 I86 L87 T88 Y89 V118 L149 T151 L162	L25-V120 HydrophobicContact CD1-CG1 4.28Å; I86-V120 HydrophobicContact CG2-CB 4.26Å; I86-V120 HydrophobicContact CG2-CG2 3.58Å; L87-V120 PolarHBondContact O-N 3.42Å; T88-V120 WeakPolarHBondContact CA-O 3.39Å; T88-V120 HydrophobicContact CG2-CB 4.44Å; T88-V120 HydrophobicContact CG2-CG1 4.41Å; Y89-V120 VanDerWaalsContact CD1-O 3.31Å; Y89-V120 WeakPolarHBondContact CD1-O 3.15Å; Y89-V120 PolarHBondContact N-O 3.36Å; V118-V120 HydrophobicContact CG1-CG2 4Å; V120-L149 WeakPolarHBondContact CA-O 3.33Å; V120-L149 HydrophobicContact CG2-CD2 4.02Å; V120-T151 HydrophobicContact CG1-CG2 3.84Å; V120-T151 VanDerWaalsContact CG1-OG1 3.24Å; V120-T151 WeakPolarHBondContact CG1-OG1 3.45Å; V120-L162 HydrophobicContact CG1-CD2 4.43Å; V120-L162 HydrophobicContact CG2-CD1 3.54Å; V120-L162 HydrophobicContact CG2-CD2 3.95Å; V120-L162 HydrophobicContact CG2-CG 4.41Å
121	G	98.9	Very high	96.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	111.2	164.5	0	0	0	0	0	110.1	L149 E150 T151	G121-L149 PolarHBondContact N-O 3.2Å; G121-E150 CarbonylContact O-C 3.53Å; G121-E150 WeakPolarHBondContact O-CA 3.29Å; G121-E150 WeakPolarHBondContact O-CB 3.47Å; G121-T151 PolarHBondContact O-N 3.21Å
122	N	98.8	Very high	97.1	Very high	2 Å²	2	60 Å²	60	1%	0.011	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	164.1	-179.3	-174.2	38.4	0	0	0	111.9	V20 L25 T88 Y89 I91 T151 A153	V20-N122 PolarHBondContact O-ND2 2.85Å; L25-N122 HydrophobicContact CD1-CB 4.43Å; T88-N122 HydrophobicContact CG2-CB 3.96Å; Y89-N122 PolarHBondContact O-N 3.21Å; I91-N122 WeakPolarHBondContact CG1-O 3.39Å; I91-N122 PolarHBondContact N-O 2.64Å; N122-T151 CarbonylContact C-O 3.42Å; N122-T151 WeakPolarHBondContact CA-O 3.42Å; N122-T151 PolarHBondContact OD1-O 2.92Å; N122-T151 PolarHBondContact OD1-OG1 3.44Å; N122-A153 PolarHBondContact OD1-N 3.34Å
123	K	98.2	Very high	97.4	Very high	50 Å²	50	60 Å²	60	22%	0.217	30%	0.296	C	S	.	.			trans	74.8	37.1	178.4	-45.6	-169.5	-164.5	167.8	0	114.7	G19 D90 I91 D125 L126 T151	G19-K123 WeakPolarHBondContact O-CE 3.15Å; G19-K123 PolarHBondContact O-NZ 3.08Å; D90-K123 WeakPolarHBondContact OD1-CD 3.15Å; D90-K123 WeakPolarHBondContact OD2-CD 3.31Å; D90-K123 VanDerWaalsContact OD2-CE 3.24Å; D90-K123 WeakPolarHBondContact OD2-CE 3.39Å; D90-K123 IonicContact OD2-NZ 3.49Å; D90-K123 PolarHBondContact OD2-NZ 3.39Å; I91-K123 WeakPolarHBondContact CD1-O 3.3Å; I91-K123 WeakPolarHBondContact CG1-O 3.25Å; K123-D125 WeakPolarHBondContact CA-OD1 3.4Å; K123-D125 PolarHBondContact O-N 3.47Å; K123-D125 VanDerWaalsContact O-N 3.12Å; K123-L126 HydrophobicContact CB-CD1 4.26Å; K123-L126 HydrophobicContact CB-CG 4.46Å; K123-L126 HydrophobicContact CD-CD1 4.22Å; K123-L126 WeakPolarHBondContact O-CB 3.45Å; K123-L126 PolarHBondContact O-N 3.43Å; K123-T151 PolarHBondContact N-O 2.88Å
124	I	98.6	Very high	97.8	Very high	34 Å²	34	56.8 Å²	56.8	17%	0.174	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-62.1	-16.8	175	65	-178.7	0	0	0	114.2	I91 L126 A127 E150 T151 D157	I91-I124 HydrophobicContact CD1-CB 4.48Å; I91-I124 HydrophobicContact CD1-CG2 4.27Å; I91-I124 HydrophobicContact CG2-CG2 4.43Å; I124-L126 PolarHBondContact O-N 2.76Å; I124-L126 VanDerWaalsContact O-N 3.16Å; I124-A127 WeakPolarHBondContact O-CB 3.35Å; I124-A127 PolarHBondContact O-N 3.36Å; I124-A127 VanDerWaalsContact O-N 3.11Å; I124-E150 HydrophobicContact CG2-CB 3.51Å; I124-E150 HydrophobicContact CG2-CG 4.25Å; I124-E150 VanDerWaalsContact CG2-OE2 3.23Å; I124-E150 WeakPolarHBondContact CG2-OE2 3.14Å; I124-T151 PolarHBondContact N-O 3.05Å; I124-D157 HydrophobicContact CD1-CB 3.95Å
125	D	98.2	Very high	98.1	Very high	48 Å²	48	55.8 Å²	55.8	26%	0.257	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61.9	-15.4	168.5	59.4	-78.3	0	0	0	113.6	K123 S152 K154 E155	K123-D125 WeakPolarHBondContact CA-OD1 3.4Å; K123-D125 PolarHBondContact O-N 3.47Å; K123-D125 VanDerWaalsContact O-N 3.12Å; D125-S152 WeakPolarHBondContact CB-OG 3.49Å; D125-S152 VanDerWaalsContact CG-OG 3.3Å; D125-S152 WeakPolarHBondContact OD1-CB 3.38Å; D125-S152 PolarHBondContact OD1-OG 2.95Å; D125-K154 HydrophobicContact CB-CD 4.43Å; D125-K154 WeakPolarHBondContact OD2-CD 3.33Å; D125-E155 HydrophobicContact CB-CG 3.59Å
126	L	98	Very high	98.3	Very high	53 Å²	53	58.7 Å²	58.7	28%	0.277	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-104.1	31.9	174.6	-55.3	-179.4	0	0	0	112.1	T92 K123 I124 E128 R129	T92-L126 HydrophobicContact CG2-CB 3.56Å; T92-L126 HydrophobicContact CG2-CD1 4.2Å; K123-L126 HydrophobicContact CB-CD1 4.26Å; K123-L126 HydrophobicContact CB-CG 4.46Å; K123-L126 HydrophobicContact CD-CD1 4.22Å; K123-L126 WeakPolarHBondContact O-CB 3.45Å; K123-L126 PolarHBondContact O-N 3.43Å; I124-L126 PolarHBondContact O-N 2.76Å; I124-L126 VanDerWaalsContact O-N 3.16Å; L126-E128 PolarHBondContact O-N 2.56Å; L126-R129 WeakPolarHBondContact O-CA 3.42Å; L126-R129 PolarHBondContact O-N 3.48Å
127	A	97.5	Very high	98.4	Very high	57 Å²	57	57.3 Å²	57.3	47%	0.471	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-50.7	-33.6	-175.8	0	0	0	0	0	114.7	I124 R129 R130	I124-A127 WeakPolarHBondContact O-CB 3.35Å; I124-A127 PolarHBondContact O-N 3.36Å; I124-A127 VanDerWaalsContact O-N 3.11Å; A127-R129 PolarHBondContact O-N 3.29Å; A127-R130 WeakPolarHBondContact O-CB 3.26Å; A127-R130 PolarHBondContact O-N 3.08Å; A127-R130 VanDerWaalsContact O-N 3.16Å
128	E	98.2	Very high	98.4	Very high	204 Å²	204	59.4 Å²	59.4	95%	0.953	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-64.5	-19.5	176.7	-62.5	-174.2	171.8	0	0	113.7	L126	L126-E128 PolarHBondContact O-N 2.56Å
129	R	98.3	Very high	98.4	Very high	177 Å²	177	64.2 Å²	64.2	67%	0.668	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-106.8	14.2	178.7	-57.4	-178.5	-175.5	-179.2	1.2	112.3	T92 L126 A127 E131	T92-R129 WeakPolarHBondContact CA-O 3.48Å; T92-R129 VanDerWaalsContact CB-O 3.23Å; T92-R129 WeakPolarHBondContact CB-O 3.36Å; T92-R129 HydrophobicContact CG2-CB 3.83Å; T92-R129 WeakPolarHBondContact CG2-O 3.23Å; L126-R129 WeakPolarHBondContact O-CA 3.42Å; L126-R129 PolarHBondContact O-N 3.48Å; A127-R129 PolarHBondContact O-N 3.29Å; R129-E131 PolarHBondContact O-N 3.41Å
130	R	98.7	Very high	98.4	Very high	77 Å²	77	66.1 Å²	66.1	29%	0.291	31%	0.313	S	S	.	.			trans	-60.2	126.7	-178.4	179.4	178.9	-71.4	-90.7	9.2	110.8	I91 A127 V132 E150	I91-R130 HydrophobicContact CD1-CB 4.21Å; I91-R130 HydrophobicContact CD1-CG 4.33Å; A127-R130 WeakPolarHBondContact O-CB 3.26Å; A127-R130 PolarHBondContact O-N 3.08Å; A127-R130 VanDerWaalsContact O-N 3.16Å; R130-V132 VanDerWaalsContact CD-O 3.28Å; R130-V132 WeakPolarHBondContact CD-O 3.44Å; R130-V132 WeakPolarHBondContact CG-O 3.4Å; R130-V132 PolarHBondContact NH1-O 3.29Å; R130-E150 IonicContact CZ-OE1 3.62Å; R130-E150 IonicContact CZ-OE2 3.56Å; R130-E150 IonicContact NH1-OE1 3.66Å; R130-E150 PolarHBondContact NH1-OE1 3.22Å; R130-E150 IonicContact NH1-OE2 2.97Å; R130-E150 IonicContact NH2-OE1 2.71Å; R130-E150 PolarHBondContact NH2-OE1 2.84Å; R130-E150 IonicContact NH2-OE2 2.66Å; R130-E150 PolarHBondContact NH2-OE2 3.4Å
131	E	98.6	Very high	98.4	Very high	116 Å²	116	66.3 Å²	66.3	54%	0.542	31%	0.314	S	S	.	.			trans	-105.2	-29.2	173	-61.6	-175	174.4	0	0	111.2	I91 T92 C93 E94 R129	I91-E131 PolarHBondContact O-N 3.22Å; T92-E131 VanDerWaalsContact O-CD 3.31Å; C93-E131 WeakPolarHBondContact CA-OE2 3.32Å; E94-E131 HydrophobicContact CB-CB 4.22Å; E94-E131 WeakPolarHBondContact CB-OE2 3.24Å; E94-E131 PolarHBondContact N-OE2 3.38Å; R129-E131 PolarHBondContact O-N 3.41Å
132	V	98.6	Very high	98.4	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-106.8	116	-179.9	-174.7	0	0	0	0	109.9	Y89 I91 F97 R130	Y89-V132 HydrophobicContact CD2-CG2 4.45Å; Y89-V132 HydrophobicContact CE2-CB 3.94Å; Y89-V132 HydrophobicContact CE2-CG1 3.8Å; Y89-V132 HydrophobicContact CE2-CG2 4.26Å; I91-V132 PolarHBondContact O-N 3.22Å; I91-V132 VanDerWaalsContact O-N 3.1Å; F97-V132 HydrophobicContact CB-CG1 4.35Å; F97-V132 HydrophobicContact CB-CG2 3.67Å; F97-V132 HydrophobicContact CD1-CG1 4.26Å; F97-V132 HydrophobicContact CD2-CG1 3.61Å; F97-V132 HydrophobicContact CD2-CG2 4.43Å; F97-V132 HydrophobicContact CE2-CG1 3.88Å; F97-V132 HydrophobicContact CG-CG1 3.81Å; F97-V132 HydrophobicContact CG-CG2 4.04Å; F97-V132 HydrophobicContact CZ-CG1 4.32Å; R130-V132 VanDerWaalsContact CD-O 3.28Å; R130-V132 WeakPolarHBondContact CD-O 3.44Å; R130-V132 WeakPolarHBondContact CG-O 3.4Å; R130-V132 PolarHBondContact NH1-O 3.29Å
133	S	98.3	Very high	98.3	Very high	55 Å²	55	77 Å²	77	39%	0.385	38%	0.377	S	S	.	.			trans	-68.5	148.1	175.7	67.3	0	0	0	0	111.5	Q135 R136 A137	S133-Q135 VanDerWaalsContact C-N 3.29Å; S133-Q135 PolarHBondContact O-N 3.41Å; S133-R136 PolarHBondContact O-N 3.24Å; S133-R136 VanDerWaalsContact OG-CB 3.32Å; S133-R136 WeakPolarHBondContact OG-CB 3.46Å; S133-R136 PolarHBondContact OG-N 2.88Å; S133-A137 PolarHBondContact O-N 2.89Å
134	Q	98.2	Very high	98.2	Very high	97 Å²	97	78.6 Å²	78.6	45%	0.453	39%	0.385	S	S	.	.	H	α-helix	trans	-58.4	-44.2	175.4	-174.8	-177.6	-13.6	0	0	111.1	R136 A137 E138 Y148	Q134-R136 VanDerWaalsContact C-N 3.32Å; Q134-R136 PolarHBondContact O-N 3.32Å; Q134-A137 PolarHBondContact O-N 3.27Å; Q134-A137 VanDerWaalsContact O-N 3.1Å; Q134-E138 HydrophobicContact CG-CG 4.35Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.31Å; Q134-E138 PolarHBondContact NE2-OE1 3.44Å; Q134-E138 WeakPolarHBondContact O-CG 3.44Å; Q134-E138 PolarHBondContact O-N 2.82Å; Q134-Y148 HydrophobicContact CG-CE1 4.03Å
135	Q	98.5	Very high	98	Very high	124 Å²	124	84.4 Å²	84.4	58%	0.579	42%	0.417	S	S	*	.	H	α-helix	trans	-53.9	-46.1	177.1	-178.6	-173.3	-3.5	0	0	112.4	S133 A137 E138 E139	S133-Q135 VanDerWaalsContact C-N 3.29Å; S133-Q135 PolarHBondContact O-N 3.41Å; Q135-A137 VanDerWaalsContact C-N 3.29Å; Q135-A137 PolarHBondContact O-N 2.83Å; Q135-E138 PolarHBondContact O-N 3.3Å; Q135-E139 HydrophobicContact CG-CG 4.47Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.36Å; Q135-E139 PolarHBondContact NE2-OE1 3.28Å; Q135-E139 WeakPolarHBondContact O-CB 3.08Å; Q135-E139 WeakPolarHBondContact O-CG 3.45Å; Q135-E139 PolarHBondContact O-N 3.04Å
136	R	98.3	Very high	98	Very high	84 Å²	84	82.9 Å²	82.9	32%	0.317	41%	0.408	S	S	.	.	H	α-helix	trans	-65.4	-36	-179.3	178.5	175.2	170.1	-137.5	6.9	111.9	E94 F97 S133 Q134 F140	E94-R136 IonicContact OE1-CZ 3.96Å; E94-R136 VanDerWaalsContact OE1-CZ 3.31Å; E94-R136 IonicContact OE1-NH1 3.59Å; E94-R136 PolarHBondContact OE1-NH1 2.91Å; E94-R136 IonicContact OE1-NH2 2.85Å; E94-R136 PolarHBondContact OE1-NH2 3.07Å; E94-R136 IonicContact OE2-CZ 2.93Å; E94-R136 IonicContact OE2-NH1 2.69Å; E94-R136 PolarHBondContact OE2-NH1 2.78Å; E94-R136 IonicContact OE2-NH2 3.66Å; F97-R136 HydrophobicContact CE1-CG 3.99Å; F97-R136 HydrophobicContact CZ-CG 4.13Å; S133-R136 PolarHBondContact O-N 3.24Å; S133-R136 VanDerWaalsContact OG-CB 3.32Å; S133-R136 WeakPolarHBondContact OG-CB 3.46Å; S133-R136 PolarHBondContact OG-N 2.88Å; Q134-R136 VanDerWaalsContact C-N 3.32Å; Q134-R136 PolarHBondContact O-N 3.32Å; R136-F140 WeakPolarHBondContact O-CB 3.45Å; R136-F140 PolarHBondContact O-N 2.94Å; R136-F140 VanDerWaalsContact O-N 3.08Å
137	A	98.6	Very high	97.8	Very high	0 Å²	0	82.8 Å²	82.8	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-72.2	-36.8	176.4	0	0	0	0	0	112.3	Y89 F97 S133 Q134 Q135 F140 S141 Y148	Y89-A137 HydrophobicContact CE1-CB 4.28Å; Y89-A137 WeakPolarHBondContact OH-CB 3.28Å; F97-A137 HydrophobicContact CE2-CB 3.8Å; F97-A137 HydrophobicContact CZ-CB 4.36Å; S133-A137 PolarHBondContact O-N 2.89Å; Q134-A137 PolarHBondContact O-N 3.27Å; Q134-A137 VanDerWaalsContact O-N 3.1Å; Q135-A137 VanDerWaalsContact C-N 3.29Å; Q135-A137 PolarHBondContact O-N 2.83Å; A137-F140 PolarHBondContact O-N 2.8Å; A137-S141 WeakPolarHBondContact O-CB 3.36Å; A137-S141 PolarHBondContact O-N 3.19Å; A137-S141 PolarHBondContact O-OG 3.27Å; A137-Y148 HydrophobicContact CB-CD2 4.47Å; A137-Y148 HydrophobicContact CB-CE1 4.29Å; A137-Y148 HydrophobicContact CB-CE2 3.65Å; A137-Y148 WeakPolarHBondContact CB-OH 3.24Å
138	E	98.5	Very high	97.9	Very high	69 Å²	69	81.3 Å²	81.3	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-54.5	171.9	-73.8	169.2	174.5	0	0	110.8	Q134 Q135 F140 S141 E142 Y148	Q134-E138 HydrophobicContact CG-CG 4.35Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.31Å; Q134-E138 PolarHBondContact NE2-OE1 3.44Å; Q134-E138 WeakPolarHBondContact O-CG 3.44Å; Q134-E138 PolarHBondContact O-N 2.82Å; Q135-E138 PolarHBondContact O-N 3.3Å; E138-F140 VanDerWaalsContact C-N 3.26Å; E138-F140 PolarHBondContact O-N 3.08Å; E138-S141 WeakPolarHBondContact CA-OG 3.35Å; E138-S141 PolarHBondContact O-N 3.03Å; E138-S141 PolarHBondContact O-OG 3.14Å; E138-E142 WeakPolarHBondContact O-CG 3.43Å; E138-E142 PolarHBondContact O-N 3.45Å; E138-Y148 HydrophobicContact CG-CD1 3.52Å; E138-Y148 HydrophobicContact CG-CE1 3.53Å
139	E	98.6	Very high	97.9	Very high	102 Å²	102	72.2 Å²	72.2	48%	0.477	35%	0.345	S	S	.	.	H	α-helix	trans	-54.5	-42.7	176.8	-73	170.7	-173.7	0	0	111.9	Q135 A143	Q135-E139 HydrophobicContact CG-CG 4.47Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.36Å; Q135-E139 PolarHBondContact NE2-OE1 3.28Å; Q135-E139 WeakPolarHBondContact O-CB 3.08Å; Q135-E139 WeakPolarHBondContact O-CG 3.45Å; Q135-E139 PolarHBondContact O-N 3.04Å; E139-A143 VanDerWaalsContact O-CB 3.3Å; E139-A143 WeakPolarHBondContact O-CB 3.5Å; E139-A143 PolarHBondContact O-N 3.07Å; E139-A143 VanDerWaalsContact O-N 3.07Å
140	F	98.6	Very high	97.9	Very high	39 Å²	39	64.8 Å²	64.8	17%	0.171	32%	0.317	C	S	.	.	H	α-helix	trans	-65	-44.2	175.8	179.9	-94.6	0	0	0	112.1	F97 L100 P101 L104 L119 R136 A137 E138 A143 Q144 M146	F97-F140 HydrophobicContact CZ-CB 3.8Å; F97-F140 HydrophobicContact CZ-CD1 4.4Å; F97-F140 HydrophobicContact CZ-CG 4.01Å; L100-F140 HydrophobicContact CB-CE1 3.84Å; L100-F140 HydrophobicContact CB-CZ 3.61Å; L100-F140 HydrophobicContact CD1-CD1 4.11Å; L100-F140 HydrophobicContact CD1-CE1 3.74Å; L100-F140 HydrophobicContact CD1-CZ 4.24Å; L100-F140 HydrophobicContact CG-CE1 4.41Å; P101-F140 HydrophobicContact CG-CE2 4.26Å; L104-F140 HydrophobicContact CD1-CE1 4.04Å; L104-F140 HydrophobicContact CD1-CE2 4.44Å; L104-F140 HydrophobicContact CD1-CZ 3.52Å; L119-F140 HydrophobicContact CD2-CD1 3.83Å; L119-F140 HydrophobicContact CD2-CE1 4.46Å; R136-F140 WeakPolarHBondContact O-CB 3.45Å; R136-F140 PolarHBondContact O-N 2.94Å; R136-F140 VanDerWaalsContact O-N 3.08Å; A137-F140 PolarHBondContact O-N 2.8Å; E138-F140 VanDerWaalsContact C-N 3.26Å; E138-F140 PolarHBondContact O-N 3.08Å; F140-A143 PolarHBondContact O-N 2.87Å; F140-Q144 HydrophobicContact CE1-CG 4.37Å; F140-Q144 HydrophobicContact CE2-CG 4.45Å; F140-Q144 HydrophobicContact CZ-CG 4.27Å; F140-Q144 VanDerWaalsContact O-CG 3.28Å; F140-Q144 WeakPolarHBondContact O-CG 3.4Å; F140-Q144 PolarHBondContact O-N 3.41Å; F140-M146 HydrophobicContact CD1-CE 4.05Å; F140-M146 HydrophobicContact CE1-CE 3.65Å
141	S	98.1	Very high	97.9	Very high	5 Å²	5	61.1 Å²	61.1	4%	0.035	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-40.2	-180	66.9	0	0	0	0	113	A137 E138 Q144 D145 M146 Y148	A137-S141 WeakPolarHBondContact O-CB 3.36Å; A137-S141 PolarHBondContact O-N 3.19Å; A137-S141 PolarHBondContact O-OG 3.27Å; E138-S141 WeakPolarHBondContact CA-OG 3.35Å; E138-S141 PolarHBondContact O-N 3.03Å; E138-S141 PolarHBondContact O-OG 3.14Å; S141-Q144 CarbonylContact O-C 3.44Å; S141-Q144 PolarHBondContact O-N 2.89Å; S141-D145 PolarHBondContact O-N 2.88Å; S141-M146 PolarHBondContact O-N 3.01Å; S141-Y148 VanDerWaalsContact OG-CB 3.28Å; S141-Y148 WeakPolarHBondContact OG-CB 3.37Å
142	E	98	Very high	97.9	Very high	151 Å²	151	55.6 Å²	55.6	71%	0.706	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-44	176.1	-71.3	178	177.2	0	0	110.9	E138 Q144 D145	E138-E142 WeakPolarHBondContact O-CG 3.43Å; E138-E142 PolarHBondContact O-N 3.45Å; E142-Q144 PolarHBondContact O-N 3.36Å; E142-Q144 VanDerWaalsContact O-N 3.14Å; E142-D145 PolarHBondContact O-N 3.23Å
143	A	97.8	Very high	97.9	Very high	75 Å²	75	55.6 Å²	55.6	62%	0.62	28%	0.278	S	S	*	.	H	α-helix	trans	-62.9	-19.6	177	0	0	0	0	0	113.5	E139 F140	E139-A143 VanDerWaalsContact O-CB 3.3Å; E139-A143 WeakPolarHBondContact O-CB 3.5Å; E139-A143 PolarHBondContact O-N 3.07Å; E139-A143 VanDerWaalsContact O-N 3.07Å; F140-A143 PolarHBondContact O-N 2.87Å
144	Q	96.4	Very high	97.9	Very high	83 Å²	83	57.2 Å²	57.2	39%	0.388	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	9.5	-178.8	-58.5	-57.6	-63.1	0	0	112.9	L104 F140 S141 E142 M146	L104-Q144 HydrophobicContact CD1-CB 4.43Å; L104-Q144 HydrophobicContact CD1-CG 3.8Å; F140-Q144 HydrophobicContact CE1-CG 4.37Å; F140-Q144 HydrophobicContact CE2-CG 4.45Å; F140-Q144 HydrophobicContact CZ-CG 4.27Å; F140-Q144 VanDerWaalsContact O-CG 3.28Å; F140-Q144 WeakPolarHBondContact O-CG 3.4Å; F140-Q144 PolarHBondContact O-N 3.41Å; S141-Q144 CarbonylContact O-C 3.44Å; S141-Q144 PolarHBondContact O-N 2.89Å; E142-Q144 PolarHBondContact O-N 3.36Å; E142-Q144 VanDerWaalsContact O-N 3.14Å; Q144-M146 VanDerWaalsContact C-N 3.26Å; Q144-M146 HydrophobicContact CB-CE 3.68Å; Q144-M146 HydrophobicContact CB-CG 4.16Å; Q144-M146 HydrophobicContact CG-CE 4.2Å; Q144-M146 PolarHBondContact O-N 3Å
145	D	94.6	Very high	97.8	Very high	157 Å²	157	57.4 Å²	57.4	84%	0.84	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	42.2	-177.7	-164.9	31.1	0	0	0	113.7	S141 E142	S141-D145 PolarHBondContact O-N 2.88Å; E142-D145 PolarHBondContact O-N 3.23Å
146	M	96.6	Very high	97.8	Very high	15 Å²	15	54.1 Å²	54.1	7%	0.074	27%	0.27	C	S	.	.			trans	-104.6	140.3	178.5	-66.3	-168.8	-74.2	0	0	111.1	L87 L104 T117 L119 F140 S141 Q144	L87-M146 HydrophobicContact CD2-SD 4.42Å; L104-M146 HydrophobicContact CD1-CE 4.39Å; L104-M146 HydrophobicContact CD2-CE 4.15Å; L104-M146 HydrophobicContact CD2-SD 3.95Å; T117-M146 HydrophobicContact CG2-CG 4.14Å; T117-M146 HydrophobicContact CG2-SD 3.48Å; T117-M146 WeakPolarHBondContact CG2-SD 3.38Å; L119-M146 HydrophobicContact CB-CB 4.45Å; L119-M146 HydrophobicContact CB-CE 4.09Å; L119-M146 HydrophobicContact CB-SD 4.31Å; L119-M146 HydrophobicContact CD2-CE 4.47Å; F140-M146 HydrophobicContact CD1-CE 4.05Å; F140-M146 HydrophobicContact CE1-CE 3.65Å; S141-M146 PolarHBondContact O-N 3.01Å; Q144-M146 VanDerWaalsContact C-N 3.26Å; Q144-M146 HydrophobicContact CB-CE 3.68Å; Q144-M146 HydrophobicContact CB-CG 4.16Å; Q144-M146 HydrophobicContact CG-CE 4.2Å; Q144-M146 PolarHBondContact O-N 3Å
147	Y	95.6	Very high	97.8	Very high	51 Å²	51	53.7 Å²	53.7	20%	0.2	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	135.9	162.7	176.8	-122.5	0	0	0	109.3	V118 L119 L149 D165	V118-Y147 CarbonylContact C-O 3.55Å; V118-Y147 WeakPolarHBondContact CA-O 3.43Å; V118-Y147 HydrophobicContact CG1-CD1 3.73Å; V118-Y147 HydrophobicContact CG1-CE1 4.46Å; V118-Y147 HydrophobicContact CG1-CG 4.49Å; V118-Y147 WeakPolarHBondContact CG1-O 3.47Å; V118-Y147 HydrophobicContact CG2-CD1 4.17Å; L119-Y147 PolarHBondContact N-O 2.86Å; Y147-L149 HydrophobicContact CD1-CD2 4.01Å; Y147-L149 HydrophobicContact CE1-CD1 4.35Å; Y147-L149 HydrophobicContact CE1-CD2 3.59Å; Y147-L149 HydrophobicContact CE1-CG 4.42Å; Y147-D165 HydrophobicContact CE1-CB 4.46Å; Y147-D165 PolarHBondContact OH-OD2 2.91Å
148	Y	98.3	Very high	97.8	Very high	26 Å²	26	57 Å²	57	10%	0.102	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.5	-179.3	171.8	-110.1	0	0	0	112.5	Y89 L119 Q134 A137 E138 S141 E150	Y89-Y148 HydrophobicContact CE1-CE2 4.21Å; Y89-Y148 PolarHBondContact OH-OH 2.73Å; Y89-Y148 VanDerWaalsContact OH-OH 3.11Å; L119-Y148 HydrophobicContact CB-CD2 4.04Å; L119-Y148 HydrophobicContact CD2-CD2 3.76Å; L119-Y148 HydrophobicContact CD2-CE2 4.22Å; L119-Y148 HydrophobicContact CG-CD2 3.82Å; L119-Y148 HydrophobicContact CG-CE2 4.33Å; L119-Y148 WeakPolarHBondContact O-CA 3.2Å; L119-Y148 WeakPolarHBondContact O-CD2 3.33Å; Q134-Y148 HydrophobicContact CG-CE1 4.03Å; A137-Y148 HydrophobicContact CB-CD2 4.47Å; A137-Y148 HydrophobicContact CB-CE1 4.29Å; A137-Y148 HydrophobicContact CB-CE2 3.65Å; A137-Y148 WeakPolarHBondContact CB-OH 3.24Å; E138-Y148 HydrophobicContact CG-CD1 3.52Å; E138-Y148 HydrophobicContact CG-CE1 3.53Å; S141-Y148 VanDerWaalsContact OG-CB 3.28Å; S141-Y148 WeakPolarHBondContact OG-CB 3.37Å; Y148-E150 HydrophobicContact CE1-CG 4.32Å; Y148-E150 HydrophobicContact CE2-CG 4.34Å; Y148-E150 WeakPolarHBondContact OH-CG 3.45Å; Y148-E150 PolarHBondContact OH-OE1 2.94Å
149	L	98.5	Very high	97.8	Very high	13 Å²	13	53.8 Å²	53.8	7%	0.068	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	157.3	167.2	66.4	170.9	0	0	0	111.1	V118 L119 V120 G121 Y147 T151 N158 L162	V118-L149 HydrophobicContact CG1-CD2 3.55Å; L119-L149 PolarHBondContact O-N 3.01Å; V120-L149 WeakPolarHBondContact CA-O 3.33Å; V120-L149 HydrophobicContact CG2-CD2 4.02Å; G121-L149 PolarHBondContact N-O 3.2Å; Y147-L149 HydrophobicContact CD1-CD2 4.01Å; Y147-L149 HydrophobicContact CE1-CD1 4.35Å; Y147-L149 HydrophobicContact CE1-CD2 3.59Å; Y147-L149 HydrophobicContact CE1-CG 4.42Å; L149-T151 HydrophobicContact CD1-CG2 4.44Å; L149-T151 HydrophobicContact CG-CG2 4.48Å; L149-N158 HydrophobicContact CD1-CB 4.42Å; L149-L162 HydrophobicContact CD1-CB 3.91Å; L149-L162 HydrophobicContact CD1-CD1 4.27Å; L149-L162 HydrophobicContact CD2-CD1 3.74Å; L149-L162 HydrophobicContact CG-CD1 4.41Å
150	E	98.8	Very high	97.8	Very high	21 Å²	21	54.4 Å²	54.4	10%	0.098	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	151.1	169.8	-58.5	-168.2	152.9	0	0	112.2	G121 I124 R130 Y148 N158	G121-E150 CarbonylContact O-C 3.53Å; G121-E150 WeakPolarHBondContact O-CA 3.29Å; G121-E150 WeakPolarHBondContact O-CB 3.47Å; I124-E150 HydrophobicContact CG2-CB 3.51Å; I124-E150 HydrophobicContact CG2-CG 4.25Å; I124-E150 VanDerWaalsContact CG2-OE2 3.23Å; I124-E150 WeakPolarHBondContact CG2-OE2 3.14Å; R130-E150 IonicContact CZ-OE1 3.62Å; R130-E150 IonicContact CZ-OE2 3.56Å; R130-E150 IonicContact NH1-OE1 3.66Å; R130-E150 PolarHBondContact NH1-OE1 3.22Å; R130-E150 IonicContact NH1-OE2 2.97Å; R130-E150 IonicContact NH2-OE1 2.71Å; R130-E150 PolarHBondContact NH2-OE1 2.84Å; R130-E150 IonicContact NH2-OE2 2.66Å; R130-E150 PolarHBondContact NH2-OE2 3.4Å; Y148-E150 HydrophobicContact CE1-CG 4.32Å; Y148-E150 HydrophobicContact CE2-CG 4.34Å; Y148-E150 WeakPolarHBondContact OH-CG 3.45Å; Y148-E150 PolarHBondContact OH-OE1 2.94Å; E150-N158 WeakPolarHBondContact O-CB 3.13Å; E150-N158 PolarHBondContact O-ND2 3.27Å
151	T	98.8	Very high	97.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	155.8	-176.1	57.4	0	0	0	0	112.1	L25 V120 G121 N122 K123 I124 L149 D157 N158 L162	L25-T151 HydrophobicContact CD2-CG2 4.47Å; V120-T151 HydrophobicContact CG1-CG2 3.84Å; V120-T151 VanDerWaalsContact CG1-OG1 3.24Å; V120-T151 WeakPolarHBondContact CG1-OG1 3.45Å; G121-T151 PolarHBondContact O-N 3.21Å; N122-T151 CarbonylContact C-O 3.42Å; N122-T151 WeakPolarHBondContact CA-O 3.42Å; N122-T151 PolarHBondContact OD1-O 2.92Å; N122-T151 PolarHBondContact OD1-OG1 3.44Å; K123-T151 PolarHBondContact N-O 2.88Å; I124-T151 PolarHBondContact N-O 3.05Å; L149-T151 HydrophobicContact CD1-CG2 4.44Å; L149-T151 HydrophobicContact CG-CG2 4.48Å; T151-D157 WeakPolarHBondContact CA-O 3.48Å; T151-N158 HydrophobicContact CG2-CB 3.97Å; T151-L162 HydrophobicContact CG2-CB 4.42Å; T151-L162 HydrophobicContact CG2-CD2 4.33Å
152	S	98.6	Very high	97.8	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.			trans	-122.6	109.8	158.4	177.1	0	0	0	0	109.2	D125 K154 E155 S156 D157 V159	D125-S152 WeakPolarHBondContact CB-OG 3.49Å; D125-S152 VanDerWaalsContact CG-OG 3.3Å; D125-S152 WeakPolarHBondContact OD1-CB 3.38Å; D125-S152 PolarHBondContact OD1-OG 2.95Å; S152-K154 PolarHBondContact O-N 2.8Å; S152-K154 PolarHBondContact OG-N 3.26Å; S152-E155 PolarHBondContact OG-N 2.85Å; S152-S156 CarbonylContact O-C 3.45Å; S152-S156 WeakPolarHBondContact O-CA 3.23Å; S152-S156 PolarHBondContact O-N 2.86Å; S152-D157 PolarHBondContact N-O 2.87Å; S152-D157 PolarHBondContact O-N 3.44Å; S152-D157 VanDerWaalsContact O-N 3.13Å; S152-V159 WeakPolarHBondContact O-CG2 3.21Å
153	A	98.2	Very high	97.9	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.5	168.2	0	0	0	0	0	112.6	C24 L25 R28 F34 N122	C24-A153 HydrophobicContact CB-CB 3.58Å; L25-A153 HydrophobicContact CD2-CB 3.88Å; L25-A153 HydrophobicContact CG-CB 4.15Å; R28-A153 PolarHBondContact NE-O 3.27Å; F34-A153 HydrophobicContact CD2-CB 4.09Å; F34-A153 WeakPolarHBondContact CD2-O 3.49Å; F34-A153 HydrophobicContact CE2-CB 4.04Å; N122-A153 PolarHBondContact OD1-N 3.34Å
154	K	97.6	Very high	97.9	Very high	89 Å²	89	48.4 Å²	48.4	39%	0.387	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-52.7	-177.1	-174.9	-169.8	170.6	-128.6	0	111.4	R28 F34 D125 S152 S156	R28-K154 PolarHBondContact NH2-O 3.38Å; F34-K154 HydrophobicContact CD1-CB 4.33Å; F34-K154 HydrophobicContact CD1-CG 4.04Å; F34-K154 HydrophobicContact CD2-CB 4.22Å; F34-K154 HydrophobicContact CE1-CB 3.99Å; F34-K154 HydrophobicContact CE1-CD 4.46Å; F34-K154 HydrophobicContact CE1-CG 3.76Å; F34-K154 HydrophobicContact CE2-CB 3.86Å; F34-K154 HydrophobicContact CG-CB 4.44Å; F34-K154 HydrophobicContact CZ-CB 3.74Å; F34-K154 HydrophobicContact CZ-CG 4.02Å; D125-K154 HydrophobicContact CB-CD 4.43Å; D125-K154 WeakPolarHBondContact OD2-CD 3.33Å; S152-K154 PolarHBondContact O-N 2.8Å; S152-K154 PolarHBondContact OG-N 3.26Å; K154-S156 VanDerWaalsContact C-N 3.3Å
155	E	97.8	Very high	98	Very high	100 Å²	100	46.7 Å²	46.7	47%	0.467	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-2	-178.1	-52.6	-57.9	151.6	0	0	112.4	D125 S152 D157	D125-E155 HydrophobicContact CB-CG 3.59Å; S152-E155 PolarHBondContact OG-N 2.85Å; E155-D157 PolarHBondContact O-N 3.3Å
156	S	97.9	Very high	98.1	Very high	56 Å²	56	39.2 Å²	39.2	39%	0.392	19%	0.192	S	C	.	.			trans	68.3	13.2	-176.6	-160.8	0	0	0	0	114.8	S152 K154 N158	S152-S156 CarbonylContact O-C 3.45Å; S152-S156 WeakPolarHBondContact O-CA 3.23Å; S152-S156 PolarHBondContact O-N 2.86Å; K154-S156 VanDerWaalsContact C-N 3.3Å; S156-N158 PolarHBondContact O-N 3.43Å
157	D	98.6	Very high	98.2	Very high	75 Å²	75	38.5 Å²	38.5	40%	0.401	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	126.6	178.9	-64.3	-33.6	0	0	0	111.5	I124 T151 S152 E155 V159	I124-D157 HydrophobicContact CD1-CB 3.95Å; T151-D157 WeakPolarHBondContact CA-O 3.48Å; S152-D157 PolarHBondContact N-O 2.87Å; S152-D157 PolarHBondContact O-N 3.44Å; S152-D157 VanDerWaalsContact O-N 3.13Å; E155-D157 PolarHBondContact O-N 3.3Å; D157-V159 PolarHBondContact O-N 2.7Å
158	N	98.6	Very high	98.3	Very high	69 Å²	69	38.5 Å²	38.5	37%	0.369	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	7.5	179.1	-63.7	-33.7	0	0	0	116	L149 E150 T151 S156 K161 L162	L149-N158 HydrophobicContact CD1-CB 4.42Å; E150-N158 WeakPolarHBondContact O-CB 3.13Å; E150-N158 PolarHBondContact O-ND2 3.27Å; T151-N158 HydrophobicContact CG2-CB 3.97Å; S156-N158 PolarHBondContact O-N 3.43Å; N158-K161 HydrophobicContact CB-CB 4.43Å; N158-K161 PolarHBondContact O-N 2.69Å; N158-L162 WeakPolarHBondContact O-CB 3.34Å; N158-L162 PolarHBondContact O-N 2.98Å
159	V	98.6	Very high	98.2	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-49.2	-179	179.3	0	0	0	0	110.7	L25 R28 F29 S152 D157 L162 F163	L25-V159 HydrophobicContact CD2-CG1 4.43Å; L25-V159 HydrophobicContact CD2-CG2 3.87Å; R28-V159 HydrophobicContact CB-CG1 4.14Å; R28-V159 HydrophobicContact CG-CB 4.2Å; R28-V159 HydrophobicContact CG-CG1 3.9Å; R28-V159 HydrophobicContact CG-CG2 4.06Å; F29-V159 HydrophobicContact CB-CG1 3.89Å; S152-V159 WeakPolarHBondContact O-CG2 3.21Å; D157-V159 PolarHBondContact O-N 2.7Å; V159-L162 WeakPolarHBondContact O-CB 3.34Å; V159-L162 PolarHBondContact O-N 2.92Å; V159-F163 HydrophobicContact CG1-CE2 4.37Å; V159-F163 VanDerWaalsContact O-CD2 3.28Å; V159-F163 WeakPolarHBondContact O-CD2 3.46Å
160	E	98.1	Very high	98.2	Very high	115 Å²	115	42.3 Å²	42.3	54%	0.537	21%	0.209	S	C	.	.	H	α-helix	trans	-65.3	-42.7	176.6	-178	164.5	-134.7	0	0	111.3	L162 F163 L164	E160-L162 VanDerWaalsContact C-N 3.33Å; E160-L162 PolarHBondContact O-N 3.18Å; E160-F163 PolarHBondContact O-N 3.26Å; E160-L164 HydrophobicContact CG-CD1 3.52Å; E160-L164 HydrophobicContact CG-CG 3.89Å; E160-L164 WeakPolarHBondContact O-CB 3.28Å; E160-L164 WeakPolarHBondContact O-CG 3.11Å; E160-L164 PolarHBondContact O-N 3Å
161	K	98.5	Very high	98.1	Very high	97 Å²	97	41.6 Å²	41.6	42%	0.422	21%	0.206	S	C	.	.	H	α-helix	trans	-53.5	-46.7	175.4	-177.8	174.7	175.4	54.6	0	112.4	N158 F163 L164 D165	N158-K161 HydrophobicContact CB-CB 4.43Å; N158-K161 PolarHBondContact O-N 2.69Å; K161-F163 PolarHBondContact O-N 3.38Å; K161-L164 PolarHBondContact O-N 3.2Å; K161-D165 WeakPolarHBondContact CE-OD2 3.41Å; K161-D165 VanDerWaalsContact CG-OD2 3.26Å; K161-D165 WeakPolarHBondContact CG-OD2 3.02Å; K161-D165 IonicContact NZ-OD1 3.3Å; K161-D165 IonicContact NZ-OD2 2.7Å; K161-D165 PolarHBondContact NZ-OD2 3.13Å; K161-D165 VanDerWaalsContact O-CB 3.23Å; K161-D165 WeakPolarHBondContact O-CB 3.39Å; K161-D165 VanDerWaalsContact O-CG 3.31Å; K161-D165 PolarHBondContact O-N 3.2Å
162	L	98.7	Very high	98	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-50.6	-53.7	177	170	60	0	0	0	112	I86 V118 V120 L149 T151 N158 V159 E160 L166	I86-L162 HydrophobicContact CD1-CD1 4.26Å; I86-L162 HydrophobicContact CD1-CD2 4.23Å; I86-L162 HydrophobicContact CD1-CG 4.23Å; I86-L162 HydrophobicContact CG2-CD1 4.46Å; I86-L162 HydrophobicContact CG2-CD2 4.29Å; V118-L162 HydrophobicContact CG1-CD1 3.9Å; V120-L162 HydrophobicContact CG1-CD2 4.43Å; V120-L162 HydrophobicContact CG2-CD1 3.54Å; V120-L162 HydrophobicContact CG2-CD2 3.95Å; V120-L162 HydrophobicContact CG2-CG 4.41Å; L149-L162 HydrophobicContact CD1-CB 3.91Å; L149-L162 HydrophobicContact CD1-CD1 4.27Å; L149-L162 HydrophobicContact CD2-CD1 3.74Å; L149-L162 HydrophobicContact CG-CD1 4.41Å; T151-L162 HydrophobicContact CG2-CB 4.42Å; T151-L162 HydrophobicContact CG2-CD2 4.33Å; N158-L162 WeakPolarHBondContact O-CB 3.34Å; N158-L162 PolarHBondContact O-N 2.98Å; V159-L162 WeakPolarHBondContact O-CB 3.34Å; V159-L162 PolarHBondContact O-N 2.92Å; E160-L162 VanDerWaalsContact C-N 3.33Å; E160-L162 PolarHBondContact O-N 3.18Å; L162-L166 WeakPolarHBondContact O-CB 3.38Å; L162-L166 PolarHBondContact O-N 3.29Å
163	F	98.6	Very high	97.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-77.8	-35.1	-174.1	-70.9	-81	0	0	0	112.6	I12 L14 F29 I62 I86 V159 E160 K161 A167	I12-F163 HydrophobicContact CD1-CD1 4.31Å; L14-F163 HydrophobicContact CD1-CE1 4.37Å; L14-F163 HydrophobicContact CD1-CZ 4.43Å; F29-F163 HydrophobicContact CB-CD2 3.61Å; F29-F163 HydrophobicContact CB-CE2 3.55Å; F29-F163 HydrophobicContact CB-CG 4.48Å; F29-F163 HydrophobicContact CB-CZ 4.37Å; F29-F163 HydrophobicContact CD1-CB 4.06Å; F29-F163 AromaticContact CD1-CD1 4Å; F29-F163 HydrophobicContact CD1-CD1 4Å; F29-F163 AromaticContact CD1-CD2 3.61Å; F29-F163 HydrophobicContact CD1-CD2 3.61Å; F29-F163 HydrophobicContact CD1-CE1 4.35Å; F29-F163 HydrophobicContact CD1-CE2 4.02Å; F29-F163 AromaticContact CD1-CG 3.62Å; F29-F163 HydrophobicContact CD1-CG 3.62Å; F29-F163 HydrophobicContact CD1-CZ 4.37Å; F29-F163 HydrophobicContact CD2-CB 3.95Å; F29-F163 AromaticContact CD2-CD2 3.62Å; F29-F163 HydrophobicContact CD2-CD2 3.62Å; F29-F163 HydrophobicContact CD2-CE2 4.45Å; F29-F163 HydrophobicContact CD2-CG 4.01Å; F29-F163 HydrophobicContact CE1-CB 3.66Å; F29-F163 HydrophobicContact CE1-CD1 4.04Å; F29-F163 HydrophobicContact CE1-CD2 4.13Å; F29-F163 AromaticContact CE1-CG 3.69Å; F29-F163 HydrophobicContact CE1-CG 3.69Å; F29-F163 HydrophobicContact CE2-CB 3.55Å; F29-F163 HydrophobicContact CE2-CD2 4.15Å; F29-F163 HydrophobicContact CE2-CG 4.09Å; F29-F163 HydrophobicContact CG-CB 4.18Å; F29-F163 AromaticContact CG-CD2 3.31Å; F29-F163 HydrophobicContact CG-CD2 3.31Å; F29-F163 AromaticContact CG-CE2 3.76Å; F29-F163 HydrophobicContact CG-CE2 3.76Å; F29-F163 AromaticContact CG-CG 3.77Å; F29-F163 HydrophobicContact CG-CG 3.77Å; F29-F163 HydrophobicContact CZ-CB 3.38Å; F29-F163 HydrophobicContact CZ-CD2 4.37Å; F29-F163 AromaticContact CZ-CG 3.92Å; F29-F163 HydrophobicContact CZ-CG 3.92Å; I62-F163 HydrophobicContact CD1-CD1 4.05Å; I62-F163 HydrophobicContact CD1-CE1 3.86Å; I62-F163 HydrophobicContact CG1-CE1 4.39Å; I62-F163 HydrophobicContact CG2-CE1 4.18Å; I86-F163 HydrophobicContact CD1-CD1 4.19Å; I86-F163 HydrophobicContact CD1-CE1 3.69Å; I86-F163 HydrophobicContact CD1-CZ 4.14Å; V159-F163 HydrophobicContact CG1-CE2 4.37Å; V159-F163 VanDerWaalsContact O-CD2 3.28Å; V159-F163 WeakPolarHBondContact O-CD2 3.46Å; E160-F163 PolarHBondContact O-N 3.26Å; K161-F163 PolarHBondContact O-N 3.38Å; F163-A167 VanDerWaalsContact O-CB 3.29Å; F163-A167 WeakPolarHBondContact O-CB 3.32Å; F163-A167 PolarHBondContact O-N 2.84Å
164	L	98.3	Very high	97.6	Very high	47 Å²	47	49.5 Å²	49.5	25%	0.246	25%	0.254	C	S	.	.	H	α-helix	trans	-72.6	-44.1	178.6	-65.1	-173.1	0	0	0	112.1	V51 I53 E160 K161 L166 A167 C168	V51-L164 HydrophobicContact CB-CD2 4.16Å; V51-L164 HydrophobicContact CG1-CD2 4.17Å; V51-L164 HydrophobicContact CG2-CD2 4.1Å; I53-L164 HydrophobicContact CD1-CD2 4.37Å; E160-L164 HydrophobicContact CG-CD1 3.52Å; E160-L164 HydrophobicContact CG-CG 3.89Å; E160-L164 WeakPolarHBondContact O-CB 3.28Å; E160-L164 WeakPolarHBondContact O-CG 3.11Å; E160-L164 PolarHBondContact O-N 3Å; K161-L164 PolarHBondContact O-N 3.2Å; L164-L166 VanDerWaalsContact C-N 3.29Å; L164-L166 PolarHBondContact O-N 2.72Å; L164-A167 PolarHBondContact O-N 2.78Å; L164-C168 PolarHBondContact O-N 3.08Å; L164-C168 PolarHBondContact O-SG 3.26Å
165	D	98	Very high	97.3	Very high	47 Å²	47	50.7 Å²	50.7	25%	0.251	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-39.6	176.5	-72.3	-5.3	0	0	0	110.6	Y147 K161 C168 R169	Y147-D165 HydrophobicContact CE1-CB 4.46Å; Y147-D165 PolarHBondContact OH-OD2 2.91Å; K161-D165 WeakPolarHBondContact CE-OD2 3.41Å; K161-D165 VanDerWaalsContact CG-OD2 3.26Å; K161-D165 WeakPolarHBondContact CG-OD2 3.02Å; K161-D165 IonicContact NZ-OD1 3.3Å; K161-D165 IonicContact NZ-OD2 2.7Å; K161-D165 PolarHBondContact NZ-OD2 3.13Å; K161-D165 VanDerWaalsContact O-CB 3.23Å; K161-D165 WeakPolarHBondContact O-CB 3.39Å; K161-D165 VanDerWaalsContact O-CG 3.31Å; K161-D165 PolarHBondContact O-N 3.2Å; D165-C168 PolarHBondContact O-N 3.25Å; D165-R169 WeakPolarHBondContact O-CG 3.17Å; D165-R169 PolarHBondContact O-N 2.76Å
166	L	98.1	Very high	97	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-43.3	174.9	-176	53.4	0	0	0	112.1	I12 A84 I86 I116 V118 L162 L164 C168 R169 L170	I12-L166 HydrophobicContact CD1-CD2 4.02Å; I12-L166 HydrophobicContact CD1-CG 4.43Å; I12-L166 HydrophobicContact CG1-CD2 4.37Å; I12-L166 HydrophobicContact CG2-CD2 4.12Å; A84-L166 HydrophobicContact CB-CD1 3.68Å; A84-L166 HydrophobicContact CB-CD2 3.73Å; A84-L166 HydrophobicContact CB-CG 3.95Å; I86-L166 HydrophobicContact CD1-CD2 3.91Å; I86-L166 HydrophobicContact CG1-CD2 3.81Å; I116-L166 HydrophobicContact CB-CD1 4.32Å; I116-L166 HydrophobicContact CG2-CD1 3.8Å; V118-L166 HydrophobicContact CG2-CD1 3.71Å; V118-L166 HydrophobicContact CG2-CD2 4.26Å; V118-L166 HydrophobicContact CG2-CG 4.47Å; L162-L166 WeakPolarHBondContact O-CB 3.38Å; L162-L166 PolarHBondContact O-N 3.29Å; L164-L166 VanDerWaalsContact C-N 3.29Å; L164-L166 PolarHBondContact O-N 2.72Å; L166-C168 PolarHBondContact O-N 2.87Å; L166-R169 PolarHBondContact O-N 3.28Å; L166-L170 HydrophobicContact CD1-CD1 4.39Å; L166-L170 HydrophobicContact CD1-CG 4.42Å; L166-L170 HydrophobicContact CG-CD1 4.12Å; L166-L170 WeakPolarHBondContact O-CB 3.36Å; L166-L170 VanDerWaalsContact O-CG 3.28Å; L166-L170 WeakPolarHBondContact O-CG 3.44Å; L166-L170 PolarHBondContact O-N 3.45Å
167	A	98.2	Very high	96.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-43.3	175	0	0	0	0	0	111.8	I53 V58 L60 F163 L164 R169 L170 I171	I53-A167 HydrophobicContact CD1-CB 3.43Å; I53-A167 VanDerWaalsContact CD1-CB 3.43Å; V58-A167 HydrophobicContact CG1-CB 4.4Å; L60-A167 HydrophobicContact CD1-CB 4.46Å; L60-A167 HydrophobicContact CD2-CB 4.17Å; F163-A167 VanDerWaalsContact O-CB 3.29Å; F163-A167 WeakPolarHBondContact O-CB 3.32Å; F163-A167 PolarHBondContact O-N 2.84Å; L164-A167 PolarHBondContact O-N 2.78Å; A167-R169 VanDerWaalsContact C-N 3.35Å; A167-R169 PolarHBondContact O-N 2.88Å; A167-L170 PolarHBondContact O-N 2.86Å; A167-I171 VanDerWaalsContact O-CG1 3.28Å; A167-I171 WeakPolarHBondContact O-CG1 3.46Å; A167-I171 PolarHBondContact O-N 3.2Å
168	C	97.9	Very high	95.3	Very high	50 Å²	50	51.1 Å²	51.1	34%	0.338	26%	0.256	S	S	.	.	H	α-helix	trans	-59.1	-42.6	175	-72.5	0	0	0	0	112.8	L164 D165 L166 I171 S172	L164-C168 PolarHBondContact O-N 3.08Å; L164-C168 PolarHBondContact O-SG 3.26Å; D165-C168 PolarHBondContact O-N 3.25Å; L166-C168 PolarHBondContact O-N 2.87Å; C168-I171 PolarHBondContact O-N 3.28Å; C168-S172 PolarHBondContact O-N 2.97Å; C168-S172 VanDerWaalsContact O-N 3.14Å; C168-S172 PolarHBondContact O-OG 2.9Å
169	R	96.7	Very high	93.6	Very high	112 Å²	112	53.1 Å²	53.1	42%	0.423	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-44.8	175.2	-71.7	173	-179.4	-101	2	111.2	I116 D165 L166 A167 I171 S172 E173	I116-R169 HydrophobicContact CD1-CB 3.93Å; D165-R169 WeakPolarHBondContact O-CG 3.17Å; D165-R169 PolarHBondContact O-N 2.76Å; L166-R169 PolarHBondContact O-N 3.28Å; A167-R169 VanDerWaalsContact C-N 3.35Å; A167-R169 PolarHBondContact O-N 2.88Å; R169-I171 PolarHBondContact O-N 3.21Å; R169-S172 WeakPolarHBondContact O-CB 3.42Å; R169-S172 PolarHBondContact O-N 2.92Å; R169-S172 VanDerWaalsContact O-N 3.16Å; R169-E173 PolarHBondContact O-N 2.97Å
170	L	97.4	Very high	91.9	Very high	8 Å²	8	57.6 Å²	57.6	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-39.9	178.3	-73.3	168.9	0	0	0	113.4	F10 I12 N83 A84 I116 L166 A167 S172 E173 A174	F10-L170 HydrophobicContact CB-CD1 3.85Å; F10-L170 HydrophobicContact CD1-CB 3.95Å; F10-L170 HydrophobicContact CD1-CD1 4.32Å; F10-L170 HydrophobicContact CD1-CD2 4.44Å; F10-L170 HydrophobicContact CD1-CG 4.49Å; F10-L170 HydrophobicContact CD2-CB 3.77Å; F10-L170 HydrophobicContact CD2-CD1 4.05Å; F10-L170 HydrophobicContact CE1-CB 3.82Å; F10-L170 HydrophobicContact CE2-CB 3.62Å; F10-L170 HydrophobicContact CG-CB 3.93Å; F10-L170 HydrophobicContact CG-CD1 3.82Å; F10-L170 HydrophobicContact CG-CG 4.39Å; F10-L170 VanDerWaalsContact CZ-C 3.45Å; F10-L170 HydrophobicContact CZ-CB 3.65Å; F10-L170 WeakPolarHBondContact CZ-O 3.31Å; I12-L170 HydrophobicContact CD1-CD1 4.49Å; I12-L170 HydrophobicContact CG1-CD1 4.39Å; N83-L170 HydrophobicContact CB-CD2 3.68Å; N83-L170 WeakPolarHBondContact O-CD2 3.41Å; A84-L170 HydrophobicContact CB-CD1 4.03Å; A84-L170 HydrophobicContact CB-CD2 4.24Å; A84-L170 HydrophobicContact CB-CG 4.49Å; I116-L170 HydrophobicContact CD1-CD2 3.68Å; I116-L170 HydrophobicContact CD1-CG 4.04Å; I116-L170 HydrophobicContact CG1-CD2 4.16Å; L166-L170 HydrophobicContact CD1-CD1 4.39Å; L166-L170 HydrophobicContact CD1-CG 4.42Å; L166-L170 HydrophobicContact CG-CD1 4.12Å; L166-L170 WeakPolarHBondContact O-CB 3.36Å; L166-L170 VanDerWaalsContact O-CG 3.28Å; L166-L170 WeakPolarHBondContact O-CG 3.44Å; L166-L170 PolarHBondContact O-N 3.45Å; A167-L170 PolarHBondContact O-N 2.86Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 2.66Å; L170-E173 PolarHBondContact O-N 2.74Å; L170-A174 VanDerWaalsContact O-CB 3.31Å; L170-A174 WeakPolarHBondContact O-CB 3.46Å; L170-A174 PolarHBondContact O-N 3.38Å
171	I	97.4	Very high	90	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-59.5	-45.5	172.7	-66.9	166.4	0	0	0	110.3	F8 F10 I53 V58 A167 C168 R169 A174 R175	F8-I171 HydrophobicContact CD2-CG1 4.01Å; F8-I171 HydrophobicContact CE1-CG2 4.42Å; F8-I171 HydrophobicContact CE2-CG1 4.19Å; F8-I171 HydrophobicContact CE2-CG2 3.92Å; F8-I171 HydrophobicContact CG-CG1 4.22Å; F8-I171 HydrophobicContact CZ-CG2 3.84Å; F10-I171 HydrophobicContact CE2-CG1 3.84Å; F10-I171 HydrophobicContact CZ-CG1 4.2Å; I53-I171 HydrophobicContact CB-CD1 4.11Å; I53-I171 HydrophobicContact CD1-CD1 4.26Å; I53-I171 HydrophobicContact CG2-CD1 3.87Å; V58-I171 HydrophobicContact CG2-CD1 3.75Å; V58-I171 HydrophobicContact CG2-CG1 4.33Å; A167-I171 VanDerWaalsContact O-CG1 3.28Å; A167-I171 WeakPolarHBondContact O-CG1 3.46Å; A167-I171 PolarHBondContact O-N 3.2Å; C168-I171 PolarHBondContact O-N 3.28Å; R169-I171 PolarHBondContact O-N 3.21Å; I171-A174 PolarHBondContact O-N 3.13Å; I171-R175 WeakPolarHBondContact O-CG 3.48Å; I171-R175 PolarHBondContact O-N 2.84Å
172	S	96.1	Very high	88.1	Confident	59 Å²	59	58.7 Å²	58.7	41%	0.413	31%	0.308	S	S	.	.	H	α-helix	trans	-61.7	-46.9	-179.4	-57.3	0	0	0	0	111.2	C168 R169 L170 R175 Q176	C168-S172 PolarHBondContact O-N 2.97Å; C168-S172 VanDerWaalsContact O-N 3.14Å; C168-S172 PolarHBondContact O-OG 2.9Å; R169-S172 WeakPolarHBondContact O-CB 3.42Å; R169-S172 PolarHBondContact O-N 2.92Å; R169-S172 VanDerWaalsContact O-N 3.16Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 2.66Å; S172-R175 PolarHBondContact O-N 3Å; S172-Q176 WeakPolarHBondContact O-CG 3.49Å; S172-Q176 PolarHBondContact O-N 3.3Å
173	E	94	Very high	86.3	Confident	82 Å²	82	64.5 Å²	64.5	38%	0.383	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-43.8	175.4	-73.1	-54.6	141.9	0	0	112.6	I116 R169 L170 R175 Q176 N177	I116-E173 HydrophobicContact CD1-CG 3.73Å; I116-E173 HydrophobicContact CG1-CG 4.37Å; R169-E173 PolarHBondContact O-N 2.97Å; L170-E173 PolarHBondContact O-N 2.74Å; E173-R175 VanDerWaalsContact C-N 3.3Å; E173-R175 PolarHBondContact O-N 3.14Å; E173-Q176 PolarHBondContact O-N 3.02Å; E173-N177 WeakPolarHBondContact O-CB 3.49Å; E173-N177 PolarHBondContact O-N 3.27Å; E173-N177 PolarHBondContact O-ND2 2.95Å
174	A	93.7	Very high	83.9	Confident	26 Å²	26	68 Å²	68	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-40.6	179.3	0	0	0	0	0	111.7	F8 F10 L170 I171 T178	F8-A174 HydrophobicContact CD1-CB 4.13Å; F8-A174 HydrophobicContact CE1-CB 3.85Å; F10-A174 HydrophobicContact CE1-CB 4.22Å; F10-A174 HydrophobicContact CZ-CB 4.26Å; L170-A174 VanDerWaalsContact O-CB 3.31Å; L170-A174 WeakPolarHBondContact O-CB 3.46Å; L170-A174 PolarHBondContact O-N 3.38Å; I171-A174 PolarHBondContact O-N 3.13Å; A174-T178 WeakPolarHBondContact O-CB 3.45Å; A174-T178 PolarHBondContact O-N 3.25Å; A174-T178 PolarHBondContact O-OG1 2.78Å
175	R	93.2	Very high	81.3	Confident	113 Å²	113	70.6 Å²	70.6	43%	0.426	39%	0.39	S	S	.	.	H	α-helix	trans	-67.6	-45.5	176.4	-73.9	174.7	170.9	167.9	-3.6	112.1	F8 E56 I171 S172 E173 N177 T178 L179	F8-R175 HydrophobicContact CZ-CG 4.4Å; E56-R175 IonicContact OE1-CZ 3.68Å; E56-R175 IonicContact OE1-NH2 2.64Å; E56-R175 PolarHBondContact OE1-NH2 2.91Å; E56-R175 IonicContact OE2-CZ 3.49Å; E56-R175 IonicContact OE2-NH1 3.92Å; E56-R175 IonicContact OE2-NH2 2.65Å; E56-R175 PolarHBondContact OE2-NH2 3.1Å; I171-R175 WeakPolarHBondContact O-CG 3.48Å; I171-R175 PolarHBondContact O-N 2.84Å; S172-R175 PolarHBondContact O-N 3Å; E173-R175 VanDerWaalsContact C-N 3.3Å; E173-R175 PolarHBondContact O-N 3.14Å; R175-N177 VanDerWaalsContact C-N 3.35Å; R175-N177 PolarHBondContact O-N 2.7Å; R175-T178 PolarHBondContact O-N 3.11Å; R175-L179 WeakPolarHBondContact O-CG 3.42Å; R175-L179 PolarHBondContact O-N 3.27Å
176	Q	90	Very high	78.6	Confident	111 Å²	111	74.1 Å²	74.1	52%	0.519	42%	0.415	S	S	.	.	H	α-helix	trans	-60.2	-44.4	177.4	-72.4	-178.1	4.7	0	0	111.8	S172 E173 T178 L179 V180	S172-Q176 WeakPolarHBondContact O-CG 3.49Å; S172-Q176 PolarHBondContact O-N 3.3Å; E173-Q176 PolarHBondContact O-N 3.02Å; Q176-T178 VanDerWaalsContact C-N 3.32Å; Q176-T178 PolarHBondContact O-N 2.77Å; Q176-L179 PolarHBondContact O-N 3.4Å; Q176-V180 WeakPolarHBondContact O-CG2 3.23Å; Q176-V180 PolarHBondContact O-N 3.1Å
177	N	82.8	Confident	75.9	Confident	51 Å²	51	81.8 Å²	81.8	27%	0.273	46%	0.455	S	S	.	.	H	α-helix	trans	-63.1	-37.8	175.9	-76.4	-71.4	0	0	0	112.4	K114 E173 R175 N181	K114-N177 PolarHBondContact NZ-OD1 2.71Å; E173-N177 WeakPolarHBondContact O-CB 3.49Å; E173-N177 PolarHBondContact O-N 3.27Å; E173-N177 PolarHBondContact O-ND2 2.95Å; R175-N177 VanDerWaalsContact C-N 3.35Å; R175-N177 PolarHBondContact O-N 2.7Å; N177-N181 VanDerWaalsContact O-CG 3.26Å; N177-N181 PolarHBondContact O-N 3.42Å; N177-N181 VanDerWaalsContact O-N 3.15Å; N177-N181 PolarHBondContact O-ND2 2.66Å
178	T	78.7	Confident	73.1	Confident	78 Å²	78	88.2 Å²	88.2	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-65.8	-42.9	176.6	-56.6	0	0	0	0	111.5	A174 R175 Q176 N181 N182	A174-T178 WeakPolarHBondContact O-CB 3.45Å; A174-T178 PolarHBondContact O-N 3.25Å; A174-T178 PolarHBondContact O-OG1 2.78Å; R175-T178 PolarHBondContact O-N 3.11Å; Q176-T178 VanDerWaalsContact C-N 3.32Å; Q176-T178 PolarHBondContact O-N 2.77Å; T178-N181 PolarHBondContact O-N 2.77Å; T178-N182 PolarHBondContact O-N 3.1Å; T178-N182 VanDerWaalsContact O-N 3.08Å; T178-N182 PolarHBondContact O-ND2 2.82Å
179	L	62.8	Low	70.4	Confident	112 Å²	112	89.2 Å²	89.2	59%	0.586	52%	0.516	S	S	*	.	H	α-helix	trans	-64.5	-43.7	177.5	-67.7	173.7	0	0	0	111.9	R175 Q176 N181 N182 V183	R175-L179 WeakPolarHBondContact O-CG 3.42Å; R175-L179 PolarHBondContact O-N 3.27Å; Q176-L179 PolarHBondContact O-N 3.4Å; L179-N181 VanDerWaalsContact C-N 3.33Å; L179-N181 PolarHBondContact O-N 3.31Å; L179-N182 PolarHBondContact O-N 2.97Å; L179-N182 VanDerWaalsContact O-N 3.17Å; L179-V183 WeakPolarHBondContact O-CG2 3.2Å; L179-V183 PolarHBondContact O-N 2.85Å
180	V	63.8	Low	67.6	Low	94 Å²	94	93.2 Å²	93.2	57%	0.57	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-40	178.2	173.1	0	0	0	0	111.8	Q176 N182 V183 S184	Q176-V180 WeakPolarHBondContact O-CG2 3.23Å; Q176-V180 PolarHBondContact O-N 3.1Å; V180-N182 VanDerWaalsContact C-N 3.33Å; V180-N182 PolarHBondContact O-N 3.28Å; V180-V183 PolarHBondContact O-N 3.26Å; V180-S184 PolarHBondContact O-N 3.39Å; V180-S184 PolarHBondContact O-OG 2.62Å
181	N	56.2	Low	64.7	Low	112 Å²	112	96.3 Å²	96.3	60%	0.599	57%	0.573	S	S	*	*	H	α-helix	trans	-67.1	-33.6	176	-70.3	-16.5	0	0	0	112.4	N177 T178 L179 S184	N177-N181 VanDerWaalsContact O-CG 3.26Å; N177-N181 PolarHBondContact O-N 3.42Å; N177-N181 VanDerWaalsContact O-N 3.15Å; N177-N181 PolarHBondContact O-ND2 2.66Å; T178-N181 PolarHBondContact O-N 2.77Å; L179-N181 VanDerWaalsContact C-N 3.33Å; L179-N181 PolarHBondContact O-N 3.31Å; N181-S184 PolarHBondContact O-OG 2.97Å
182	N	59.7	Low	61.8	Low	124 Å²	124	105.3 Å²	105.3	66%	0.663	61%	0.612	S	S	*	*	H	α-helix	trans	-78.6	-22.4	177	-70.1	-17.5	0	0	0	113.2	T178 L179 V180	T178-N182 PolarHBondContact O-N 3.1Å; T178-N182 VanDerWaalsContact O-N 3.08Å; T178-N182 PolarHBondContact O-ND2 2.82Å; L179-N182 PolarHBondContact O-N 2.97Å; L179-N182 VanDerWaalsContact O-N 3.17Å; V180-N182 VanDerWaalsContact C-N 3.33Å; V180-N182 PolarHBondContact O-N 3.28Å
183	V	59.8	Low	58.9	Low	122 Å²	122	108.6 Å²	108.6	74%	0.739	64%	0.635	S	S	*	*	H	α-helix	trans	-86.1	-16.2	178	176.1	0	0	0	0	112	L179 V180 S185	L179-V183 WeakPolarHBondContact O-CG2 3.2Å; L179-V183 PolarHBondContact O-N 2.85Å; V180-V183 PolarHBondContact O-N 3.26Å; V183-S185 PolarHBondContact O-N 2.91Å
184	S	49.2	Very low	56.1	Low	74 Å²	74	111.6 Å²	111.6	52%	0.517	65%	0.652	S	S	.	*	S	Bend	trans	-92.2	66.6	-179.7	39.7	0	0	0	0	113	V180 N181	V180-S184 PolarHBondContact O-N 3.39Å; V180-S184 PolarHBondContact O-OG 2.62Å; N181-S184 PolarHBondContact O-OG 2.97Å
185	S	43.5	Very low	53.2	Low	102 Å²	102	114.9 Å²	114.9	71%	0.713	67%	0.674	S	S	*	*			trans	-165.3	91.8	150.1	-72.8	0	0	0	0	108.8	V183 L187	V183-S185 PolarHBondContact O-N 2.91Å; S185-L187 PolarHBondContact O-N 3.16Å
186	P	42.3	Very low	50.4	Low	121 Å²	121	120.2 Å²	120.2	79%	0.786	70%	0.695	S	S	*	*			trans	-59.3	122	154	-11.8	26.7	0	0	0	106.9
187	L	41.3	Very low	48.1	Very low	160 Å²	160	121.6 Å²	121.6	84%	0.838	71%	0.705	S	S	*	*			trans	-49.9	127	168.6	-73.8	162.7	0	0	0	108.5	S185 G189	S185-L187 PolarHBondContact O-N 3.16Å; L187-G189 PolarHBondContact O-N 3.12Å; L187-G189 VanDerWaalsContact O-N 3.1Å
188	P	38.3	Very low	45.9	Very low	136 Å²	136	125.6 Å²	125.6	88%	0.883	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	108.5	165.8	2.2	11	0	0	0	106.8
189	G	41.3	Very low	43.7	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.7	-19.4	-178.9	0	0	0	0	0	119.2	L187 G191	L187-G189 PolarHBondContact O-N 3.12Å; L187-G189 VanDerWaalsContact O-N 3.1Å; G189-G191 PolarHBondContact O-N 3.16Å
190	E	39.1	Very low	42.4	Very low	195 Å²	195	127.4 Å²	127.4	91%	0.911	76%	0.755	S	S	*	*			trans	-86.4	87.2	171.8	-75.7	-172.1	171.2	0	0	109.9	K192	E190-K192 PolarHBondContact O-N 3.11Å; E190-K192 VanDerWaalsContact O-N 3.17Å
191	G	35.2	Very low	41.5	Very low	74 Å²	74	131 Å²	131	76%	0.763	77%	0.771	S	S	*	*			trans	-51.5	115.7	178.3	0	0	0	0	0	111.9	G189	G189-G191 PolarHBondContact O-N 3.16Å
192	K	37.1	Very low	40.8	Very low	195 Å²	195	134.8 Å²	134.8	85%	0.848	78%	0.782	S	S	*	*			trans	-103.3	117.1	151.8	-72.9	-175.7	178	175.2	0	107	E190 I194	E190-K192 PolarHBondContact O-N 3.11Å; E190-K192 VanDerWaalsContact O-N 3.17Å; K192-I194 PolarHBondContact O-N 3.32Å; K192-I194 VanDerWaalsContact O-N 3.12Å
193	S	34.8	Very low	40.3	Very low	127 Å²	127	140.1 Å²	140.1	89%	0.888	81%	0.811	S	S	*	*			trans	-38.8	110	-176.6	-55.4	0	0	0	0	112.6	S195	S193-S195 PolarHBondContact O-N 2.84Å
194	I	34.3	Very low	39.3	Very low	145 Å²	145	141 Å²	141	74%	0.744	81%	0.814	S	S	*	*			trans	-84	109.1	164.1	-61.9	176.6	0	0	0	106.1	K192 Y196	K192-I194 PolarHBondContact O-N 3.32Å; K192-I194 VanDerWaalsContact O-N 3.12Å; I194-Y196 PolarHBondContact O-N 2.96Å
195	S	34.8	Very low	38.8	Very low	96 Å²	96	144.5 Å²	144.5	67%	0.671	83%	0.83	S	S	*	*			trans	-65.3	109.6	174.2	52.5	0	0	0	0	109.5	S193 L197	S193-S195 PolarHBondContact O-N 2.84Å; S195-L197 PolarHBondContact O-N 3.05Å
196	Y	33.8	Very low	38.6	Very low	224 Å²	224	146.9 Å²	146.9	88%	0.878	84%	0.836	S	S	*	*			trans	-71.1	94.5	165.1	-70.4	-89.7	0	0	0	108.6	I194	I194-Y196 PolarHBondContact O-N 2.96Å
197	L	41.1	Very low	38.3	Very low	140 Å²	140	148.4 Å²	148.4	73%	0.733	84%	0.839	S	S	*	*			trans	-116.5	85.9	163	-81.2	160.7	0	0	0	107.9	S195 C199	S195-L197 PolarHBondContact O-N 3.05Å; L197-C199 PolarHBondContact O-N 3.22Å
198	T	37.6	Very low	38.2	Very low	135 Å²	135	147.7 Å²	147.7	83%	0.828	84%	0.839	S	S	*	*			trans	20.7	92	141.7	38.2	0	0	0	0	116.5
199	C	31.3	Very low	38.1	Very low	122 Å²	122	148.5 Å²	148.5	82%	0.824	84%	0.836	S	S	*	*			trans	-110.7	99.5	153.4	-71.6	0	0	0	0	107.2	L197	L197-C199 PolarHBondContact O-N 3.22Å
200	C	36.1	Very low	37.9	Very low	107 Å²	107	154 Å²	154	72%	0.723	84%	0.844	S	S	*	*			trans	168.7	101.1	148.9	-92.4	0	0	0	0	109
201	N	44.5	Very low	37.8	Very low	168 Å²	168	150.8 Å²	150.8	90%	0.898	84%	0.839	S	S	*	*				-154.6	119.5	117.9	-91.9	-18.9	0	0	0	108.7
202	F	42.3	Very low	38	Very low	193 Å²	193	157.3 Å²	157.3	85%	0.846	85%	0.845	S	S	*	*			trans	-64.5	140.5	169.8	-87.7	-105.8	0	0	0	109.6
203	N	48.9	Very low	38.1	Very low	235 Å²	235	153.8 Å²	153.8	100%	1.257	85%	0.845	S	S	*	*			trans	22.3	0	158.9	-66.1	-18	0	0	0	118.6

Retrieved 203 of 203 residues in 277.6 ms (Link to these results)

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