A0A2K6JUJ2_RHIBE Loading...

Voltage-dependent calcium channel gamma-1 subunit

Regulatory subunit of the voltage-gated calcium channel that gives rise to L-type calcium currents in skeletal muscle. Regulates channel inactivation kinetics.

AlphaFold DB , UniProt , Accession A0A2K6JUJ2, Species RHIBE (Rhinopithecus bieti, Black snub-nosed monkey), Gene CACNG1, Length 222 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	73.4	Confident	198 Å²	198	88.7 Å²	88.7	98%	0.975	43%	0.433	S	S	*	.				0	113.6	0	-176.3	172.2	148.6	0	0	107.4	Q3 K5	M1-Q3 PolarHBondContact O-N 3.44Å; M1-K5 HydrophobicContact CE-CB 4.48Å
2	S	57.3	Low	75.1	Confident	34 Å²	34	82.5 Å²	82.5	24%	0.238	40%	0.404	C	S	.	.			trans	-51.2	134.3	-170.7	162.7	0	0	0	0	112.9	T4 K5 D134	S2-T4 PolarHBondContact O-N 2.78Å; S2-T4 VanDerWaalsContact O-N 3.13Å; S2-T4 PolarHBondContact OG-OG1 3.48Å; S2-K5 PolarHBondContact O-N 2.84Å; S2-D134 VanDerWaalsContact CA-OD2 3.3Å; S2-D134 WeakPolarHBondContact CA-OD2 3.1Å; S2-D134 VanDerWaalsContact CB-OD2 3.27Å; S2-D134 WeakPolarHBondContact CB-OD2 3.4Å; S2-D134 PolarHBondContact OG-OD1 3.13Å; S2-D134 PolarHBondContact OG-OD2 3.14Å
3	Q	60.3	Low	76.4	Confident	55 Å²	55	77.9 Å²	77.9	26%	0.257	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-54.8	-33.1	-176.8	-90.7	-168.9	-22.2	0	0	112	M1 K5 T6 D134 F202 S203 L204	M1-Q3 PolarHBondContact O-N 3.44Å; Q3-K5 PolarHBondContact O-N 2.84Å; Q3-T6 WeakPolarHBondContact O-CB 3Å; Q3-T6 PolarHBondContact O-N 3.16Å; Q3-T6 VanDerWaalsContact O-N 3.14Å; Q3-T6 PolarHBondContact O-OG1 3.4Å; Q3-D134 HydrophobicContact CB-CB 4.45Å; Q3-D134 PolarHBondContact N-OD2 3.27Å; Q3-F202 PolarHBondContact NE2-O 3.34Å; Q3-F202 VanDerWaalsContact NE2-O 3.16Å; Q3-S203 PolarHBondContact NE2-O 3.02Å; Q3-S203 VanDerWaalsContact OE1-CA 3.29Å; Q3-S203 PolarHBondContact OE1-O 3.12Å; Q3-S203 VanDerWaalsContact OE1-O 3.04Å; Q3-L204 PolarHBondContact NE2-O 3.16Å
4	T	59.8	Low	77.6	Confident	11 Å²	11	83 Å²	83	7%	0.067	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-63.3	-19.9	178.1	53.8	0	0	0	0	114.8	S2 T6 F129 D134 L137	S2-T4 PolarHBondContact O-N 2.78Å; S2-T4 VanDerWaalsContact O-N 3.13Å; S2-T4 PolarHBondContact OG-OG1 3.48Å; T4-T6 VanDerWaalsContact C-N 3.35Å; T4-F129 HydrophobicContact CG2-CD1 4.25Å; T4-F129 HydrophobicContact CG2-CE1 4.08Å; T4-D134 WeakPolarHBondContact CG2-OD1 3.45Å; T4-D134 PolarHBondContact OG1-OD1 3.49Å; T4-L137 HydrophobicContact CG2-CD1 3.63Å; T4-L137 HydrophobicContact CG2-CG 4.46Å
5	K	64.8	Low	78.7	Confident	131 Å²	131	80.7 Å²	80.7	57%	0.57	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-86.1	-7.3	177.4	-67.4	-172	178.5	-174.5	0	113.4	M1 S2 Q3 L7	M1-K5 HydrophobicContact CE-CB 4.48Å; S2-K5 PolarHBondContact O-N 2.84Å; Q3-K5 PolarHBondContact O-N 2.84Å; K5-L7 PolarHBondContact O-N 3.15Å
6	T	80.2	Confident	79.8	Confident	56 Å²	56	75.8 Å²	75.8	34%	0.344	37%	0.373	S	S	.	.			trans	-69.6	128.2	-179.4	-46.7	0	0	0	0	109.8	Q3 T4 K8 V9 R10	Q3-T6 WeakPolarHBondContact O-CB 3Å; Q3-T6 PolarHBondContact O-N 3.16Å; Q3-T6 VanDerWaalsContact O-N 3.14Å; Q3-T6 PolarHBondContact O-OG1 3.4Å; T4-T6 VanDerWaalsContact C-N 3.35Å; T6-K8 HydrophobicContact CG2-CB 4.14Å; T6-K8 HydrophobicContact CG2-CG 4.39Å; T6-K8 PolarHBondContact O-N 3.14Å; T6-K8 VanDerWaalsContact O-N 3.14Å; T6-V9 PolarHBondContact O-N 3.35Å; T6-R10 PolarHBondContact O-N 3.19Å
7	L	84.2	Confident	80.7	Confident	133 Å²	133	77.4 Å²	77.4	70%	0.696	38%	0.383	S	S	*	.	H	α-helix	trans	-50.8	-41	178.3	-178.1	66.8	0	0	0	111.9	K5 V9 R10 V11	K5-L7 PolarHBondContact O-N 3.15Å; L7-V9 PolarHBondContact O-N 3Å; L7-R10 PolarHBondContact O-N 3.42Å; L7-V11 HydrophobicContact CD1-CG2 4.32Å; L7-V11 HydrophobicContact CG-CG2 4.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.38Å; L7-V11 PolarHBondContact O-N 2.98Å
8	K	87.3	Confident	81.6	Confident	128 Å²	128	75.2 Å²	75.2	56%	0.557	38%	0.378	S	S	*	.	H	α-helix	trans	-55.6	-47.1	177.7	-62.4	-177.6	178.6	-175.6	0	112.4	T6 V11 T12 F202	T6-K8 HydrophobicContact CG2-CB 4.14Å; T6-K8 HydrophobicContact CG2-CG 4.39Å; T6-K8 PolarHBondContact O-N 3.14Å; T6-K8 VanDerWaalsContact O-N 3.14Å; K8-V11 PolarHBondContact O-N 3.22Å; K8-T12 PolarHBondContact O-N 3.4Å; K8-T12 PolarHBondContact O-OG1 2.93Å; K8-F202 HydrophobicContact CB-CD2 4.3Å; K8-F202 HydrophobicContact CB-CE2 4.21Å
9	V	86.5	Confident	82.3	Confident	4 Å²	4	71.2 Å²	71.2	2%	0.024	36%	0.359	C	S	.	.	H	α-helix	trans	-65	-41.9	179.8	174.1	0	0	0	0	110.9	T6 L7 T12 L13 L137 L199 F202	T6-V9 PolarHBondContact O-N 3.35Å; L7-V9 PolarHBondContact O-N 3Å; V9-T12 PolarHBondContact O-N 3.13Å; V9-L13 HydrophobicContact CG1-CD1 4.04Å; V9-L13 HydrophobicContact CG1-CG 4.47Å; V9-L13 WeakPolarHBondContact O-CB 3.3Å; V9-L13 VanDerWaalsContact O-CG 3.3Å; V9-L13 WeakPolarHBondContact O-CG 3.35Å; V9-L13 PolarHBondContact O-N 2.89Å; V9-L137 HydrophobicContact CG1-CD1 4.46Å; V9-L199 HydrophobicContact CG1-CD1 3.93Å; V9-F202 HydrophobicContact CG2-CB 4.09Å
10	R	88	Confident	83	Confident	145 Å²	145	69.4 Å²	69.4	55%	0.547	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-42.8	178	-69.9	-176.1	175.7	-173.2	-4.9	112.7	T6 L7 L13 F14	T6-R10 PolarHBondContact O-N 3.19Å; L7-R10 PolarHBondContact O-N 3.42Å; R10-L13 PolarHBondContact O-N 3.42Å; R10-F14 PolarHBondContact O-N 3.25Å
11	V	92.1	Very high	83.6	Confident	81 Å²	81	69.9 Å²	69.9	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-45.7	175.6	172.3	0	0	0	0	110.1	L7 K8 L13 F14 C15	L7-V11 HydrophobicContact CD1-CG2 4.32Å; L7-V11 HydrophobicContact CG-CG2 4.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.38Å; L7-V11 PolarHBondContact O-N 2.98Å; K8-V11 PolarHBondContact O-N 3.22Å; V11-L13 VanDerWaalsContact C-N 3.34Å; V11-L13 PolarHBondContact O-N 3.02Å; V11-F14 WeakPolarHBondContact O-CB 3.49Å; V11-F14 PolarHBondContact O-N 3.14Å; V11-C15 PolarHBondContact O-N 2.91Å; V11-C15 PolarHBondContact O-SG 2.95Å; V11-C15 VanDerWaalsContact O-SG 3.39Å
12	T	93.1	Very high	85.8	Confident	14 Å²	14	62.9 Å²	62.9	9%	0.086	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-42.8	176.5	-55.1	0	0	0	0	112.1	K8 V9 F14 C15 I16 G195 A198 L199 F202	K8-T12 PolarHBondContact O-N 3.4Å; K8-T12 PolarHBondContact O-OG1 2.93Å; V9-T12 PolarHBondContact O-N 3.13Å; T12-F14 VanDerWaalsContact C-N 3.31Å; T12-F14 PolarHBondContact O-N 3.5Å; T12-C15 WeakPolarHBondContact O-CB 3.4Å; T12-C15 PolarHBondContact O-N 3.48Å; T12-I16 HydrophobicContact CG2-CD1 4.17Å; T12-I16 WeakPolarHBondContact O-CG1 3.15Å; T12-I16 PolarHBondContact O-N 3.22Å; T12-G195 VanDerWaalsContact CG2-O 3.32Å; T12-G195 WeakPolarHBondContact CG2-O 3.13Å; T12-A198 HydrophobicContact CG2-CB 4.21Å; T12-L199 HydrophobicContact CG2-CB 3.95Å; T12-L199 HydrophobicContact CG2-CD1 4.43Å; T12-F202 WeakPolarHBondContact OG1-CE2 3.22Å
13	L	91.8	Very high	87.5	Confident	23 Å²	23	61.4 Å²	61.4	12%	0.12	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-36	176.6	-73.1	171.5	0	0	0	112.6	V9 R10 V11 I16 L17 V125 F129 L199	V9-L13 HydrophobicContact CG1-CD1 4.04Å; V9-L13 HydrophobicContact CG1-CG 4.47Å; V9-L13 WeakPolarHBondContact O-CB 3.3Å; V9-L13 VanDerWaalsContact O-CG 3.3Å; V9-L13 WeakPolarHBondContact O-CG 3.35Å; V9-L13 PolarHBondContact O-N 2.89Å; R10-L13 PolarHBondContact O-N 3.42Å; V11-L13 VanDerWaalsContact C-N 3.34Å; V11-L13 PolarHBondContact O-N 3.02Å; L13-I16 PolarHBondContact O-N 3.26Å; L13-L17 WeakPolarHBondContact O-CB 3.12Å; L13-L17 PolarHBondContact O-N 3.47Å; L13-V125 HydrophobicContact CD1-CG1 4.36Å; L13-V125 HydrophobicContact CD2-CG1 3.96Å; L13-V125 HydrophobicContact CD2-CG2 4.03Å; L13-F129 HydrophobicContact CD1-CE2 3.83Å; L13-F129 HydrophobicContact CD1-CZ 3.47Å; L13-F129 VanDerWaalsContact CD1-CZ 3.47Å; L13-L199 HydrophobicContact CD2-CD1 4.23Å; L13-L199 HydrophobicContact CD2-CD2 3.86Å; L13-L199 HydrophobicContact CG-CD1 4.27Å
14	F	93.7	Very high	89.1	Confident	149 Å²	149	62.9 Å²	62.9	65%	0.654	32%	0.32	S	S	*	.	H	α-helix	trans	-65.5	-42.2	173.5	-175	-97.7	0	0	0	111.8	R10 V11 T12 I16 L17 A18	R10-F14 PolarHBondContact O-N 3.25Å; V11-F14 WeakPolarHBondContact O-CB 3.49Å; V11-F14 PolarHBondContact O-N 3.14Å; T12-F14 VanDerWaalsContact C-N 3.31Å; T12-F14 PolarHBondContact O-N 3.5Å; F14-I16 VanDerWaalsContact C-N 3.34Å; F14-I16 PolarHBondContact O-N 3Å; F14-L17 WeakPolarHBondContact O-CB 3.18Å; F14-L17 PolarHBondContact O-N 2.83Å; F14-A18 PolarHBondContact O-N 3.42Å
15	C	94.8	Very high	90.6	Very high	49 Å²	49	64.9 Å²	64.9	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-41.6	173.3	-65.9	0	0	0	0	112.2	V11 T12 L17 A18 G19	V11-C15 PolarHBondContact O-N 2.91Å; V11-C15 PolarHBondContact O-SG 2.95Å; V11-C15 VanDerWaalsContact O-SG 3.39Å; T12-C15 WeakPolarHBondContact O-CB 3.4Å; T12-C15 PolarHBondContact O-N 3.48Å; C15-L17 VanDerWaalsContact C-N 3.33Å; C15-A18 PolarHBondContact O-N 2.9Å; C15-G19 PolarHBondContact O-N 2.84Å
16	I	95.3	Very high	91.9	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-42.9	175	-69.9	169.1	0	0	0	110.2	T12 L13 F14 A18 G19 I20 Y144 L192 L199	T12-I16 HydrophobicContact CG2-CD1 4.17Å; T12-I16 WeakPolarHBondContact O-CG1 3.15Å; T12-I16 PolarHBondContact O-N 3.22Å; L13-I16 PolarHBondContact O-N 3.26Å; F14-I16 VanDerWaalsContact C-N 3.34Å; F14-I16 PolarHBondContact O-N 3Å; I16-A18 VanDerWaalsContact C-N 3.34Å; I16-A18 PolarHBondContact O-N 3.32Å; I16-G19 CarbonylContact O-C 3.53Å; I16-G19 WeakPolarHBondContact O-CA 3.4Å; I16-G19 PolarHBondContact O-N 2.89Å; I16-I20 HydrophobicContact CG2-CD1 4.07Å; I16-I20 HydrophobicContact CG2-CG1 4.36Å; I16-I20 WeakPolarHBondContact O-CG1 3.28Å; I16-I20 PolarHBondContact O-N 3.49Å; I16-Y144 HydrophobicContact CD1-CD2 4Å; I16-Y144 HydrophobicContact CD1-CE2 4.39Å; I16-Y144 HydrophobicContact CG2-CD1 3.88Å; I16-Y144 HydrophobicContact CG2-CD2 3.95Å; I16-Y144 HydrophobicContact CG2-CE1 3.82Å; I16-Y144 HydrophobicContact CG2-CE2 3.87Å; I16-Y144 HydrophobicContact CG2-CG 3.94Å; I16-L192 HydrophobicContact CG2-CD2 4.04Å; I16-L199 HydrophobicContact CD1-CB 4.26Å; I16-L199 HydrophobicContact CD1-CD2 3.84Å
17	L	95.6	Very high	92.3	Very high	103 Å²	103	56.6 Å²	56.6	54%	0.539	29%	0.292	S	S	.	.	H	α-helix	trans	-60.6	-42.1	177.6	-174.5	134.7	0	0	0	112	L13 F14 C15 G19 I20 V21	L13-L17 WeakPolarHBondContact O-CB 3.12Å; L13-L17 PolarHBondContact O-N 3.47Å; F14-L17 WeakPolarHBondContact O-CB 3.18Å; F14-L17 PolarHBondContact O-N 2.83Å; C15-L17 VanDerWaalsContact C-N 3.33Å; L17-G19 VanDerWaalsContact C-N 3.33Å; L17-G19 PolarHBondContact O-N 3.33Å; L17-I20 PolarHBondContact O-N 2.85Å; L17-V21 WeakPolarHBondContact O-CG2 3.3Å; L17-V21 PolarHBondContact O-N 3.15Å; L17-V21 VanDerWaalsContact O-N 3.1Å
18	A	96.4	Very high	92.5	Very high	37 Å²	37	54.9 Å²	54.9	31%	0.306	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-42.4	171.6	0	0	0	0	0	111.8	F14 C15 I16 I20 V21 L22	F14-A18 PolarHBondContact O-N 3.42Å; C15-A18 PolarHBondContact O-N 2.9Å; I16-A18 VanDerWaalsContact C-N 3.34Å; I16-A18 PolarHBondContact O-N 3.32Å; A18-I20 VanDerWaalsContact C-N 3.35Å; A18-I20 PolarHBondContact O-N 3.34Å; A18-V21 PolarHBondContact O-N 3.48Å; A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 2.89Å
19	G	95.3	Very high	92.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-39.4	174.2	0	0	0	0	0	113.5	C15 I16 L17 L22 A23	C15-G19 PolarHBondContact O-N 2.84Å; I16-G19 CarbonylContact O-C 3.53Å; I16-G19 WeakPolarHBondContact O-CA 3.4Å; I16-G19 PolarHBondContact O-N 2.89Å; L17-G19 VanDerWaalsContact C-N 3.33Å; L17-G19 PolarHBondContact O-N 3.33Å; G19-L22 PolarHBondContact O-N 3.04Å; G19-A23 WeakPolarHBondContact O-CB 3.34Å; G19-A23 PolarHBondContact O-N 3.18Å
20	I	95.6	Very high	92.2	Very high	35 Å²	35	51.1 Å²	51.1	18%	0.179	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-46.3	175.6	-67.6	170	0	0	0	110.7	I16 L17 A18 L22 A23 M24 V118 Y144 L192	I16-I20 HydrophobicContact CG2-CD1 4.07Å; I16-I20 HydrophobicContact CG2-CG1 4.36Å; I16-I20 WeakPolarHBondContact O-CG1 3.28Å; I16-I20 PolarHBondContact O-N 3.49Å; L17-I20 PolarHBondContact O-N 2.85Å; A18-I20 VanDerWaalsContact C-N 3.35Å; A18-I20 PolarHBondContact O-N 3.34Å; I20-L22 VanDerWaalsContact C-N 3.35Å; I20-A23 PolarHBondContact O-N 3.42Å; I20-M24 HydrophobicContact CG2-CG 4.48Å; I20-M24 WeakPolarHBondContact O-CG 3.27Å; I20-M24 PolarHBondContact O-N 3.03Å; I20-V118 HydrophobicContact CB-CG1 4.33Å; I20-V118 HydrophobicContact CD1-CG1 3.89Å; I20-V118 HydrophobicContact CG1-CG1 3.73Å; I20-V118 HydrophobicContact CG2-CG1 3.75Å; I20-Y144 HydrophobicContact CD1-CE1 3.81Å; I20-Y144 HydrophobicContact CG1-CE1 4.44Å; I20-L192 HydrophobicContact CG1-CD2 3.93Å
21	V	95.9	Very high	92	Very high	80 Å²	80	46.7 Å²	46.7	49%	0.485	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-44.6	178.6	175.5	0	0	0	0	110.3	L17 A18 A23 M24 T25	L17-V21 WeakPolarHBondContact O-CG2 3.3Å; L17-V21 PolarHBondContact O-N 3.15Å; L17-V21 VanDerWaalsContact O-N 3.1Å; A18-V21 PolarHBondContact O-N 3.48Å; V21-A23 PolarHBondContact O-N 2.99Å; V21-M24 PolarHBondContact O-N 2.97Å; V21-T25 HydrophobicContact CG1-CG2 4.43Å; V21-T25 WeakPolarHBondContact O-CG2 3.48Å; V21-T25 PolarHBondContact O-N 3.39Å; V21-T25 PolarHBondContact O-OG1 2.93Å
22	L	94.4	Very high	91.7	Very high	51 Å²	51	43.1 Å²	43.1	27%	0.267	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-42.2	176.1	-70.7	171.8	0	0	0	112.1	A18 G19 I20 M24 T25 A26 C184 A187 A188 L191	A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 2.89Å; G19-L22 PolarHBondContact O-N 3.04Å; I20-L22 VanDerWaalsContact C-N 3.35Å; L22-M24 PolarHBondContact O-N 2.87Å; L22-T25 WeakPolarHBondContact CA-OG1 3.44Å; L22-T25 PolarHBondContact O-N 3.36Å; L22-T25 PolarHBondContact O-OG1 3.39Å; L22-A26 WeakPolarHBondContact O-CB 3.24Å; L22-A26 PolarHBondContact O-N 3.37Å; L22-C184 HydrophobicContact CD2-CB 4.44Å; L22-A187 HydrophobicContact CD1-CB 4.23Å; L22-A188 HydrophobicContact CB-CB 3.89Å; L22-L191 HydrophobicContact CD1-CD1 3.76Å
23	A	93.4	Very high	91.1	Very high	2 Å²	2	42.5 Å²	42.5	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-46.7	174.8	0	0	0	0	0	111.8	G19 I20 V21 A26 V27 I151 A188 L192	G19-A23 WeakPolarHBondContact O-CB 3.34Å; G19-A23 PolarHBondContact O-N 3.18Å; I20-A23 PolarHBondContact O-N 3.42Å; V21-A23 PolarHBondContact O-N 2.99Å; A23-A26 PolarHBondContact O-N 2.91Å; A23-V27 WeakPolarHBondContact O-CG2 3.41Å; A23-V27 PolarHBondContact O-N 2.88Å; A23-I151 HydrophobicContact CB-CD1 3.5Å; A23-A188 HydrophobicContact CB-CB 3.93Å; A23-L192 HydrophobicContact CB-CD1 4.16Å
24	M	92.8	Very high	90.5	Very high	87 Å²	87	41.9 Å²	41.9	43%	0.429	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-45.4	177.5	-73.7	-64.5	-65.4	0	0	111.6	I20 V21 L22 A26 V27 V28 L115	I20-M24 HydrophobicContact CG2-CG 4.48Å; I20-M24 WeakPolarHBondContact O-CG 3.27Å; I20-M24 PolarHBondContact O-N 3.03Å; V21-M24 PolarHBondContact O-N 2.97Å; L22-M24 PolarHBondContact O-N 2.87Å; M24-A26 PolarHBondContact O-N 3.3Å; M24-V27 PolarHBondContact O-N 3.34Å; M24-V28 WeakPolarHBondContact O-CB 3.32Å; M24-V28 VanDerWaalsContact O-CG2 3.3Å; M24-V28 WeakPolarHBondContact O-CG2 3.34Å; M24-V28 PolarHBondContact O-N 2.89Å; M24-L115 HydrophobicContact SD-CD1 4.42Å; M24-L115 HydrophobicContact SD-CD2 3.31Å; M24-L115 WeakPolarHBondContact SD-CD2 3.34Å; M24-L115 HydrophobicContact SD-CG 4.49Å
25	T	92.2	Very high	89.4	Confident	52 Å²	52	34.9 Å²	34.9	32%	0.319	20%	0.2	S	C	.	.	H	α-helix	trans	-61.6	-44.3	176.8	57.4	0	0	0	0	111.3	V21 L22 V27 V28 T29	V21-T25 HydrophobicContact CG1-CG2 4.43Å; V21-T25 WeakPolarHBondContact O-CG2 3.48Å; V21-T25 PolarHBondContact O-N 3.39Å; V21-T25 PolarHBondContact O-OG1 2.93Å; L22-T25 WeakPolarHBondContact CA-OG1 3.44Å; L22-T25 PolarHBondContact O-N 3.36Å; L22-T25 PolarHBondContact O-OG1 3.39Å; T25-V27 PolarHBondContact O-N 3.39Å; T25-V28 PolarHBondContact O-N 2.96Å; T25-T29 VanDerWaalsContact O-CB 3.23Å; T25-T29 WeakPolarHBondContact O-CB 3.44Å; T25-T29 WeakPolarHBondContact O-CG2 3.48Å; T25-T29 PolarHBondContact O-N 2.97Å; T25-T29 VanDerWaalsContact O-N 3.09Å; T25-T29 PolarHBondContact O-OG1 3.38Å
26	A	90.8	Very high	88.1	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-44.7	177.2	0	0	0	0	0	112.4	L22 A23 M24 V28 T29 W32 C184 A185	L22-A26 WeakPolarHBondContact O-CB 3.24Å; L22-A26 PolarHBondContact O-N 3.37Å; A23-A26 PolarHBondContact O-N 2.91Å; M24-A26 PolarHBondContact O-N 3.3Å; A26-V28 PolarHBondContact O-N 2.74Å; A26-T29 PolarHBondContact O-N 2.62Å; A26-T29 PolarHBondContact O-OG1 2.84Å; A26-W32 HydrophobicContact CB-CZ2 4.07Å; A26-W32 WeakPolarHBondContact O-CZ2 3.4Å; A26-W32 PolarHBondContact O-NE1 3.25Å; A26-C184 HydrophobicContact CB-CB 4.25Å; A26-A185 HydrophobicContact CB-CB 3.88Å
27	V	89.5	Confident	86.7	Confident	12 Å²	12	36 Å²	36	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-34.3	-178	173.8	0	0	0	0	112.8	A23 M24 T25 L53 W54 A111 L115	A23-V27 WeakPolarHBondContact O-CG2 3.41Å; A23-V27 PolarHBondContact O-N 2.88Å; M24-V27 PolarHBondContact O-N 3.34Å; T25-V27 PolarHBondContact O-N 3.39Å; V27-L53 HydrophobicContact CG1-CD2 4.43Å; V27-W54 HydrophobicContact CG1-CZ2 4.2Å; V27-W54 PolarHBondContact O-NE1 3.25Å; V27-A111 HydrophobicContact CG1-CB 4.46Å; V27-A111 HydrophobicContact CG2-CB 4.16Å; V27-L115 HydrophobicContact CG1-CD1 4.18Å
28	V	88.2	Confident	84.6	Confident	97 Å²	97	36 Å²	36	59%	0.588	21%	0.205	S	C	*	.	H	α-helix	trans	-82.7	-22.8	-178.2	175.3	0	0	0	0	112.3	M24 T25 A26	M24-V28 WeakPolarHBondContact O-CB 3.32Å; M24-V28 VanDerWaalsContact O-CG2 3.3Å; M24-V28 WeakPolarHBondContact O-CG2 3.34Å; M24-V28 PolarHBondContact O-N 2.89Å; T25-V28 PolarHBondContact O-N 2.96Å; A26-V28 PolarHBondContact O-N 2.74Å
29	T	86.8	Confident	82.6	Confident	28 Å²	28	38.7 Å²	38.7	17%	0.172	21%	0.212	C	C	.	.			trans	-93.4	143.1	-171.6	55	0	0	0	0	112.2	T25 A26 H31 W32 W180 S181	T25-T29 VanDerWaalsContact O-CB 3.23Å; T25-T29 WeakPolarHBondContact O-CB 3.44Å; T25-T29 WeakPolarHBondContact O-CG2 3.48Å; T25-T29 PolarHBondContact O-N 2.97Å; T25-T29 VanDerWaalsContact O-N 3.09Å; T25-T29 PolarHBondContact O-OG1 3.38Å; A26-T29 PolarHBondContact O-N 2.62Å; A26-T29 PolarHBondContact O-OG1 2.84Å; T29-H31 VanDerWaalsContact C-N 3.32Å; T29-H31 PolarHBondContact O-N 3.19Å; T29-W32 VanDerWaalsContact O-CD1 3.27Å; T29-W32 PolarHBondContact O-NE1 2.96Å; T29-W180 HydrophobicContact CG2-CH2 3.29Å; T29-W180 HydrophobicContact CG2-CZ2 4.17Å; T29-W180 HydrophobicContact CG2-CZ3 3.86Å; T29-S181 WeakPolarHBondContact CB-OG 3.49Å; T29-S181 VanDerWaalsContact OG1-CB 3.29Å; T29-S181 WeakPolarHBondContact OG1-CB 3.5Å; T29-S181 PolarHBondContact OG1-OG 3.01Å
30	D	81	Confident	80.2	Confident	25 Å²	25	45.7 Å²	45.7	13%	0.134	25%	0.245	C	C	.	.	S	Bend	trans	-95.5	21.7	-175.1	-54.4	-49.8	0	0	0	113.2	F51 G52	D30-F51 CarbonylContact C-O 3.59Å; D30-F51 CarbonylContact O-C 3.5Å; D30-G52 VanDerWaalsContact CA-CA 3.48Å; D30-G52 PolarHBondContact O-N 2.83Å
31	H	84.3	Confident	77.7	Confident	53 Å²	53	51.6 Å²	51.6	25%	0.245	27%	0.272	C	S	.	.			trans	-112.4	54.8	-174.3	-68.7	-75.7	0	0	0	111.7	T29 H50 S179 W180 S181	T29-H31 VanDerWaalsContact C-N 3.32Å; T29-H31 PolarHBondContact O-N 3.19Å; H31-H50 AromaticContact CE1-ND1 3.98Å; H31-H50 AromaticContact ND1-CE1 3.97Å; H31-H50 AromaticContact ND1-ND1 3.54Å; H31-S179 VanDerWaalsContact C-CB 3.46Å; H31-S179 CarbonylContact O-C 3.43Å; H31-S179 WeakPolarHBondContact O-CB 3.31Å; H31-W180 HydrophobicContact CB-CD2 4.39Å; H31-W180 HydrophobicContact CB-CZ2 4.05Å; H31-W180 AromaticContact CD2-CE2 3.9Å; H31-W180 AromaticContact CD2-CZ2 3.59Å; H31-W180 AromaticContact CD2-NE1 3.75Å; H31-W180 AromaticContact CG-CE2 3.94Å; H31-W180 AromaticContact CG-NE1 3.5Å; H31-S181 WeakPolarHBondContact CB-OG 3.4Å; H31-S181 WeakPolarHBondContact O-CB 3.39Å; H31-S181 PolarHBondContact O-N 2.91Å; H31-S181 VanDerWaalsContact O-N 3.11Å; H31-S181 PolarHBondContact O-OG 2.79Å; H31-S181 VanDerWaalsContact O-OG 3.09Å
32	W	85.1	Confident	75.4	Confident	5 Å²	5	57 Å²	57	2%	0.019	29%	0.291	C	S	.	.	S	Bend	trans	-86.3	-47.8	176	-71.8	62.6	0	0	0	111.7	A26 T29 F51 L53 V155 M158 S179 F182 A185	A26-W32 HydrophobicContact CB-CZ2 4.07Å; A26-W32 WeakPolarHBondContact O-CZ2 3.4Å; A26-W32 PolarHBondContact O-NE1 3.25Å; T29-W32 VanDerWaalsContact O-CD1 3.27Å; T29-W32 PolarHBondContact O-NE1 2.96Å; W32-F51 VanDerWaalsContact CB-O 3.31Å; W32-F51 WeakPolarHBondContact CB-O 3.18Å; W32-F51 PolarHBondContact N-O 3.13Å; W32-L53 HydrophobicContact CH2-CD1 4.45Å; W32-L53 HydrophobicContact CZ2-CD1 4.29Å; W32-V155 HydrophobicContact CH2-CG2 4.23Å; W32-V155 HydrophobicContact CZ3-CG2 3.78Å; W32-M158 HydrophobicContact CB-CE 4.32Å; W32-M158 HydrophobicContact CE3-CB 4.42Å; W32-M158 HydrophobicContact CE3-CG 4.06Å; W32-S179 PolarHBondContact O-N 3.25Å; W32-F182 HydrophobicContact CE3-CD2 4.41Å; W32-A185 HydrophobicContact CH2-CB 3.65Å; W32-A185 HydrophobicContact CZ2-CB 4.26Å; W32-A185 HydrophobicContact CZ3-CB 3.97Å
33	A	80.5	Confident	73.5	Confident	2 Å²	2	60.9 Å²	60.9	2%	0.017	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	147.8	175.9	0	0	0	0	0	110.4	L35 F51 V162 Y177	A33-L35 HydrophobicContact CB-CD1 4.13Å; A33-F51 HydrophobicContact CB-CB 4.38Å; A33-F51 PolarHBondContact O-N 2.75Å; A33-V162 HydrophobicContact CB-CG2 4.14Å; A33-Y177 CarbonylContact C-O 3.6Å; A33-Y177 WeakPolarHBondContact CA-O 3.31Å
34	V	78.6	Confident	71.8	Confident	10 Å²	10	66.2 Å²	66.2	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.9	168	-166.4	0	0	0	0	107.4	A48 A49 I72 Y176 Y177 S179	V34-A48 HydrophobicContact CG1-CB 4.49Å; V34-A49 WeakPolarHBondContact CA-O 3.44Å; V34-I72 HydrophobicContact CG1-CD1 4.42Å; V34-Y176 WeakPolarHBondContact O-CA 3.46Å; V34-Y177 PolarHBondContact N-O 3.37Å; V34-Y177 PolarHBondContact O-N 3.48Å; V34-S179 WeakPolarHBondContact CG2-OG 3.23Å
35	L	71.5	Confident	70.4	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.2	171	-80.7	69.5	0	0	0	109.3	A33 A49 F51 V162 M165 W173	A33-L35 HydrophobicContact CB-CD1 4.13Å; L35-A49 HydrophobicContact CB-CB 4.48Å; L35-A49 PolarHBondContact N-O 3.42Å; L35-A49 PolarHBondContact O-N 3.11Å; L35-F51 HydrophobicContact CB-CE2 4.1Å; L35-F51 HydrophobicContact CD1-CD2 3.4Å; L35-F51 VanDerWaalsContact CD1-CD2 3.4Å; L35-F51 HydrophobicContact CD1-CE2 3.4Å; L35-F51 HydrophobicContact CD1-CG 4.47Å; L35-F51 HydrophobicContact CD1-CZ 4.47Å; L35-F51 HydrophobicContact CD2-CE2 3.68Å; L35-F51 HydrophobicContact CD2-CZ 4.18Å; L35-F51 HydrophobicContact CG-CD2 4.37Å; L35-F51 HydrophobicContact CG-CE2 3.9Å; L35-V162 HydrophobicContact CD1-CG1 4.38Å; L35-M165 HydrophobicContact CD2-CE 4.43Å; L35-M165 HydrophobicContact CD2-CG 4.35Å; L35-M165 HydrophobicContact CD2-SD 3.22Å; L35-M165 WeakPolarHBondContact CD2-SD 3.3Å; L35-W173 HydrophobicContact CB-CD2 4.27Å; L35-W173 HydrophobicContact CB-CE3 3.71Å; L35-W173 HydrophobicContact CB-CZ3 4.29Å; L35-W173 HydrophobicContact CD2-CB 4.23Å; L35-W173 HydrophobicContact CD2-CG 4.24Å
36	S	68.1	Low	69.1	Low	39 Å²	39	63.3 Å²	63.3	27%	0.273	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.2	173.9	-167.9	0	0	0	0	109.8	W173 E175	S36-W173 VanDerWaalsContact C-CE3 3.43Å; S36-E175 PolarHBondContact N-O 3.03Å; S36-E175 VanDerWaalsContact N-O 3.08Å
37	P	64.7	Low	68	Low	34 Å²	34	66.3 Å²	66.3	22%	0.221	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	154	-179.2	29.7	-22.6	0	0	0	110.2	E47 V172 W173	P37-E47 WeakPolarHBondContact CD-O 3.36Å; P37-E47 VanDerWaalsContact CG-O 3.25Å; P37-E47 WeakPolarHBondContact CG-O 3.32Å; P37-V172 CarbonylContact C-O 3.56Å; P37-W173 HydrophobicContact CB-CD2 3.96Å; P37-W173 HydrophobicContact CB-CE3 3.6Å; P37-W173 HydrophobicContact CB-CH2 4.06Å; P37-W173 HydrophobicContact CB-CZ2 4.39Å; P37-W173 HydrophobicContact CB-CZ3 3.69Å; P37-W173 HydrophobicContact CG-CE3 3.9Å; P37-W173 HydrophobicContact CG-CH2 3.89Å; P37-W173 HydrophobicContact CG-CZ3 3.5Å
38	H	52.3	Low	67.2	Low	103 Å²	103	66.1 Å²	66.1	48%	0.477	35%	0.346	S	S	.	.			trans	-64.6	131.2	166	-163.8	-39	0	0	0	108.3	E40 V172 I174	H38-E40 PolarHBondContact O-N 3.19Å; H38-V172 HydrophobicContact CB-CG1 3.6Å; H38-V172 WeakPolarHBondContact CB-O 3.5Å; H38-V172 PolarHBondContact N-O 3.34Å; H38-V172 VanDerWaalsContact O-CG1 3.22Å; H38-V172 WeakPolarHBondContact O-CG1 3.06Å; H38-I174 HydrophobicContact CB-CD1 3.82Å; H38-I174 HydrophobicContact CB-CG1 4.37Å; H38-I174 WeakPolarHBondContact CD2-CD1 3.36Å
39	M	53.5	Low	66.5	Low	94 Å²	94	61.7 Å²	61.7	46%	0.463	32%	0.32	S	S	.	.			trans	-72.9	97.1	169.4	-63.1	-179.8	-159.5	0	0	108.7	C46 M63 C69	M39-C46 VanDerWaalsContact CE-SG 3.6Å; M39-M63 HydrophobicContact CE-CE 3.2Å; M39-M63 HydrophobicContact SD-CE 3.33Å; M39-M63 WeakPolarHBondContact SD-CE 3.41Å; M39-M63 HydrophobicContact SD-SD 4.28Å; M39-C69 WeakPolarHBondContact CE-SG 3.37Å
40	E	45.3	Very low	66.1	Low	147 Å²	147	61.2 Å²	61.2	69%	0.687	32%	0.315	S	S	*	.			trans	-104.7	102.6	168	-136.5	161.8	-169.9	0	0	108.7	H38	H38-E40 PolarHBondContact O-N 3.19Å
41	H	43.1	Very low	65.9	Low	160 Å²	160	60.5 Å²	60.5	74%	0.741	31%	0.311	S	S	*	.	S	Bend	trans	68.5	105.5	172	-75.5	54.5	0	0	0	118.5	N43	H41-N43 VanDerWaalsContact C-N 3.34Å; H41-N43 PolarHBondContact O-N 3.25Å
42	H	47.5	Very low	65.7	Low	193 Å²	193	58.1 Å²	58.1	89%	0.894	30%	0.3	S	S	*	.			trans	54.9	23.3	142.1	-82.4	30.8	0	0	0	119.4
43	N	54.3	Low	65.3	Low	133 Å²	133	58 Å²	58	71%	0.711	30%	0.3	S	S	*	.			trans	-92.5	136.6	166.2	-83.5	-15	0	0	0	111.7	H41 T45	H41-N43 VanDerWaalsContact C-N 3.34Å; H41-N43 PolarHBondContact O-N 3.25Å; N43-T45 PolarHBondContact O-N 3.07Å; N43-T45 VanDerWaalsContact O-N 3.17Å
44	T	58.4	Low	65.2	Low	114 Å²	114	60.8 Å²	60.8	70%	0.699	31%	0.31	S	S	*	.	S	Bend	trans	-75.1	3.4	-174.9	51.3	0	0	0	0	114.4	M63	T44-M63 WeakPolarHBondContact O-CG 3.36Å; T44-M63 PolarHBondContact O-N 3.48Å; T44-M63 VanDerWaalsContact O-N 3.16Å
45	T	62	Low	65.1	Low	67 Å²	67	64.9 Å²	64.9	41%	0.411	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	129.3	-171.3	55.2	0	0	0	0	111.7	N43	N43-T45 PolarHBondContact O-N 3.07Å; N43-T45 VanDerWaalsContact O-N 3.17Å
46	C	66.1	Low	65.4	Low	11 Å²	11	66.3 Å²	66.3	7%	0.074	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	140.2	168	-66.3	0	0	0	0	110.8	M39 R60 I61 M63 C69	M39-C46 VanDerWaalsContact CE-SG 3.6Å; C46-R60 CarbonylContact O-C 3.57Å; C46-R60 WeakPolarHBondContact O-CA 3.14Å; C46-I61 HydrophobicContact CB-CB 4.36Å; C46-I61 PolarHBondContact N-O 3.09Å; C46-I61 PolarHBondContact O-N 3.41Å; C46-M63 WeakPolarHBondContact SG-CE 3.32Å; C46-C69 HydrophobicContact CB-CB 3.87Å; C46-C69 WeakPolarHBondContact CB-SG 3.35Å; C46-C69 WeakPolarHBondContact SG-CA 3.32Å; C46-C69 WeakPolarHBondContact SG-CB 3.49Å; C46-C69 CovalentContact SG-SG 2.04Å; C46-C69 PolarHBondContact SG-SG 3.4Å
47	E	67.4	Low	65.8	Low	63 Å²	63	64.6 Å²	64.6	29%	0.294	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.5	171.2	-58.1	-162.6	142.4	0	0	109.6	P37 R60	P37-E47 WeakPolarHBondContact CD-O 3.36Å; P37-E47 VanDerWaalsContact CG-O 3.25Å; P37-E47 WeakPolarHBondContact CG-O 3.32Å; E47-R60 HydrophobicContact CG-CG 4.28Å; E47-R60 IonicContact OE1-CZ 3.17Å; E47-R60 IonicContact OE1-NE 2.76Å; E47-R60 PolarHBondContact OE1-NE 3.22Å; E47-R60 IonicContact OE1-NH2 2.85Å; E47-R60 PolarHBondContact OE1-NH2 3.27Å
48	A	72.1	Confident	66.3	Low	8 Å²	8	65 Å²	65	7%	0.066	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.8	172.3	0	0	0	0	0	109.5	V34 T58 K59 I61	V34-A48 HydrophobicContact CG1-CB 4.49Å; A48-T58 CarbonylContact O-C 3.2Å; A48-T58 WeakPolarHBondContact O-CA 3.48Å; A48-K59 PolarHBondContact N-O 3.23Å; A48-K59 PolarHBondContact O-N 3.35Å; A48-I61 HydrophobicContact CB-CD1 4.46Å
49	A	73.8	Confident	67.4	Low	5 Å²	5	61.6 Å²	61.6	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.8	179.1	0	0	0	0	0	110.8	V34 L35 F51 T58 W173	V34-A49 WeakPolarHBondContact CA-O 3.44Å; L35-A49 HydrophobicContact CB-CB 4.48Å; L35-A49 PolarHBondContact N-O 3.42Å; L35-A49 PolarHBondContact O-N 3.11Å; A49-F51 HydrophobicContact CB-CE2 3.98Å; A49-T58 HydrophobicContact CB-CG2 4.27Å; A49-W173 HydrophobicContact CB-CH2 4.28Å; A49-W173 HydrophobicContact CB-CZ3 4.24Å
50	H	79	Confident	68.2	Low	17 Å²	17	62.2 Å²	62.2	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121	170.9	-66.5	-71.6	0	0	0	109.9	H31 C57	H31-H50 AromaticContact CE1-ND1 3.98Å; H31-H50 AromaticContact ND1-CE1 3.97Å; H31-H50 AromaticContact ND1-ND1 3.54Å; H50-C57 HydrophobicContact CB-CB 4.35Å; H50-C57 PolarHBondContact N-O 3.25Å; H50-C57 PolarHBondContact O-N 2.64Å
51	F	76.3	Confident	69.3	Low	11 Å²	11	55.4 Å²	55.4	5%	0.048	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.3	177.2	-76.5	-94.2	0	0	0	111.1	D30 W32 A33 L35 A49 I56 M158 M165	D30-F51 CarbonylContact C-O 3.59Å; D30-F51 CarbonylContact O-C 3.5Å; W32-F51 VanDerWaalsContact CB-O 3.31Å; W32-F51 WeakPolarHBondContact CB-O 3.18Å; W32-F51 PolarHBondContact N-O 3.13Å; A33-F51 HydrophobicContact CB-CB 4.38Å; A33-F51 PolarHBondContact O-N 2.75Å; L35-F51 HydrophobicContact CB-CE2 4.1Å; L35-F51 HydrophobicContact CD1-CD2 3.4Å; L35-F51 VanDerWaalsContact CD1-CD2 3.4Å; L35-F51 HydrophobicContact CD1-CE2 3.4Å; L35-F51 HydrophobicContact CD1-CG 4.47Å; L35-F51 HydrophobicContact CD1-CZ 4.47Å; L35-F51 HydrophobicContact CD2-CE2 3.68Å; L35-F51 HydrophobicContact CD2-CZ 4.18Å; L35-F51 HydrophobicContact CG-CD2 4.37Å; L35-F51 HydrophobicContact CG-CE2 3.9Å; A49-F51 HydrophobicContact CB-CE2 3.98Å; F51-I56 HydrophobicContact CD1-CD1 4.09Å; F51-I56 HydrophobicContact CD1-CG1 4.45Å; F51-I56 HydrophobicContact CE1-CD1 3.49Å; F51-I56 VanDerWaalsContact CE1-CD1 3.49Å; F51-I56 HydrophobicContact CE1-CG1 4.32Å; F51-I56 HydrophobicContact CE2-CD1 4.17Å; F51-I56 HydrophobicContact CZ-CD1 3.56Å; F51-M158 HydrophobicContact CB-CE 3.59Å; F51-M158 HydrophobicContact CD1-CE 4.42Å; F51-M158 HydrophobicContact CG-CE 4.33Å; F51-M165 HydrophobicContact CD1-CE 4.36Å; F51-M165 HydrophobicContact CE1-CE 3.51Å; F51-M165 HydrophobicContact CE1-SD 4.24Å; F51-M165 HydrophobicContact CE2-CE 4.33Å; F51-M165 HydrophobicContact CE2-SD 4.21Å; F51-M165 HydrophobicContact CZ-CE 3.48Å; F51-M165 VanDerWaalsContact CZ-CE 3.48Å; F51-M165 HydrophobicContact CZ-SD 3.58Å; F51-M165 VanDerWaalsContact CZ-SD 3.58Å
52	G	79.6	Confident	70.3	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.021	26%	0.258	C	S	.	.			trans	-105.4	178.6	163.4	0	0	0	0	0	112.5	D30 R55	D30-G52 VanDerWaalsContact CA-CA 3.48Å; D30-G52 PolarHBondContact O-N 2.83Å; G52-R55 WeakPolarHBondContact CA-O 3.47Å; G52-R55 PolarHBondContact N-O 3.44Å
53	L	76.7	Confident	70.9	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	23%	0.229	C	C	.	.	S	Bend	trans	-75	-32	173.9	-139.1	74.8	0	0	0	112	V27 W32 A107 A108 A111	V27-L53 HydrophobicContact CG1-CD2 4.43Å; W32-L53 HydrophobicContact CH2-CD1 4.45Å; W32-L53 HydrophobicContact CZ2-CD1 4.29Å; L53-A107 HydrophobicContact CD1-CB 4.06Å; L53-A108 HydrophobicContact CD2-CB 4.37Å; L53-A108 HydrophobicContact CG-CB 4.31Å; L53-A111 HydrophobicContact CD2-CB 3.4Å; L53-A111 VanDerWaalsContact CD2-CB 3.4Å
54	W	78.9	Confident	71.1	Confident	59 Å²	59	42.6 Å²	42.6	22%	0.223	22%	0.218	C	C	.	.	S	Bend	trans	-111.5	-31.2	-172.7	-52.7	97.3	0	0	0	113.5	V27 F86 A108 I112	V27-W54 HydrophobicContact CG1-CZ2 4.2Å; V27-W54 PolarHBondContact O-NE1 3.25Å; W54-F86 HydrophobicContact CE3-CE1 4.32Å; W54-F86 HydrophobicContact CE3-CE2 4.05Å; W54-F86 AromaticContact CE3-CZ 3.74Å; W54-F86 HydrophobicContact CE3-CZ 3.74Å; W54-F86 HydrophobicContact CZ3-CE1 4.1Å; W54-F86 HydrophobicContact CZ3-CE2 4.45Å; W54-F86 AromaticContact CZ3-CZ 3.69Å; W54-F86 HydrophobicContact CZ3-CZ 3.69Å; W54-A108 HydrophobicContact CH2-CB 4.39Å; W54-A108 HydrophobicContact CZ3-CB 4.27Å; W54-I112 HydrophobicContact CH2-CD1 3.82Å; W54-I112 HydrophobicContact CH2-CG1 3.79Å; W54-I112 HydrophobicContact CZ2-CG1 4.43Å; W54-I112 HydrophobicContact CZ3-CD1 4.43Å
55	R	77.4	Confident	70.9	Confident	96 Å²	96	45.3 Å²	45.3	36%	0.362	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	153	-171.9	-53.3	178.2	-159.4	-159.1	4.9	109.7	G52 Y82	G52-R55 WeakPolarHBondContact CA-O 3.47Å; G52-R55 PolarHBondContact N-O 3.44Å; R55-Y82 HydrophobicContact CG-CD1 3.55Å; R55-Y82 HydrophobicContact CG-CE1 3.61Å; R55-Y82 HydrophobicContact CG-CG 4.09Å; R55-Y82 VanDerWaalsContact NE-CZ 3.29Å; R55-Y82 PolarHBondContact NE-OH 3.41Å; R55-Y82 PolarHBondContact NH1-OH 2.92Å; R55-Y82 VanDerWaalsContact NH1-OH 3.14Å; R55-Y82 PolarHBondContact NH2-OH 3.38Å
56	I	76.5	Confident	70.6	Confident	32 Å²	32	45.6 Å²	45.6	16%	0.164	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.6	164.5	-169.4	171	0	0	0	107.4	F51 C80 S81	F51-I56 HydrophobicContact CD1-CD1 4.09Å; F51-I56 HydrophobicContact CD1-CG1 4.45Å; F51-I56 HydrophobicContact CE1-CD1 3.49Å; F51-I56 VanDerWaalsContact CE1-CD1 3.49Å; F51-I56 HydrophobicContact CE1-CG1 4.32Å; F51-I56 HydrophobicContact CE2-CD1 4.17Å; F51-I56 HydrophobicContact CZ-CD1 3.56Å; I56-C80 WeakPolarHBondContact O-CA 3.23Å; I56-S81 WeakPolarHBondContact CG2-OG 3.44Å; I56-S81 PolarHBondContact N-O 3.45Å; I56-S81 PolarHBondContact O-N 3.43Å
57	C	76.6	Confident	70.2	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.027	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	113.8	178.1	-71.4	0	0	0	0	109	H50 N79 C80	H50-C57 HydrophobicContact CB-CB 4.35Å; H50-C57 PolarHBondContact N-O 3.25Å; H50-C57 PolarHBondContact O-N 2.64Å; C57-N79 CarbonylContact C-O 3.57Å; C57-N79 WeakPolarHBondContact CA-O 3.19Å; C57-C80 HydrophobicContact CB-CB 4.19Å; C57-C80 WeakPolarHBondContact CB-SG 3.39Å; C57-C80 WeakPolarHBondContact SG-CB 3.46Å; C57-C80 CovalentContact SG-SG 2.04Å; C57-C80 PolarHBondContact SG-SG 3.46Å
58	T	76	Confident	69.6	Low	42 Å²	42	54 Å²	54	26%	0.258	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	138	170.6	56.1	0	0	0	0	109.2	A48 A49 N79	A48-T58 CarbonylContact O-C 3.2Å; A48-T58 WeakPolarHBondContact O-CA 3.48Å; A49-T58 HydrophobicContact CB-CG2 4.27Å; T58-N79 PolarHBondContact N-O 3.37Å; T58-N79 PolarHBondContact O-N 3.02Å; T58-N79 PolarHBondContact OG1-O 3.43Å
59	K	74.6	Confident	69	Low	31 Å²	31	55.8 Å²	55.8	14%	0.135	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.3	178.1	-172.7	176.8	-179.1	179.3	0	108.8	A48 I61 I72 L74 E77	A48-K59 PolarHBondContact N-O 3.23Å; A48-K59 PolarHBondContact O-N 3.35Å; K59-I61 HydrophobicContact CD-CG1 4.44Å; K59-I61 HydrophobicContact CG-CG1 4.21Å; K59-I72 PolarHBondContact NZ-O 2.98Å; K59-L74 WeakPolarHBondContact CE-O 3.46Å; K59-L74 PolarHBondContact NZ-O 2.99Å; K59-E77 WeakPolarHBondContact CA-O 3.49Å
60	R	70.9	Confident	68.3	Low	108 Å²	108	55.9 Å²	55.9	41%	0.408	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121	174.2	-63.2	-170.7	166.2	172.3	-0.6	109.3	C46 E47 G76 E77	C46-R60 CarbonylContact O-C 3.57Å; C46-R60 WeakPolarHBondContact O-CA 3.14Å; E47-R60 HydrophobicContact CG-CG 4.28Å; E47-R60 IonicContact OE1-CZ 3.17Å; E47-R60 IonicContact OE1-NE 2.76Å; E47-R60 PolarHBondContact OE1-NE 3.22Å; E47-R60 IonicContact OE1-NH2 2.85Å; E47-R60 PolarHBondContact OE1-NH2 3.27Å; R60-G76 WeakPolarHBondContact O-CA 3.4Å; R60-E77 PolarHBondContact N-O 2.84Å
61	I	69.1	Low	67.3	Low	3 Å²	3	58.9 Å²	58.9	2%	0.015	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.6	-179.2	-53.4	172.1	0	0	0	107.2	C46 A48 K59	C46-I61 HydrophobicContact CB-CB 4.36Å; C46-I61 PolarHBondContact N-O 3.09Å; C46-I61 PolarHBondContact O-N 3.41Å; A48-I61 HydrophobicContact CB-CD1 4.46Å; K59-I61 HydrophobicContact CD-CG1 4.44Å; K59-I61 HydrophobicContact CG-CG1 4.21Å
62	P	62.7	Low	66.5	Low	72 Å²	72	62.5 Å²	62.5	47%	0.468	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	143.2	173	27.5	-32.5	0	0	0	110.2
63	M	60.4	Low	65.4	Low	57 Å²	57	68.3 Å²	68.3	28%	0.281	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-60.6	140.8	174.7	-72.8	-123.2	101	0	0	111.1	M39 T44 C46	M39-M63 HydrophobicContact CE-CE 3.2Å; M39-M63 HydrophobicContact SD-CE 3.33Å; M39-M63 WeakPolarHBondContact SD-CE 3.41Å; M39-M63 HydrophobicContact SD-SD 4.28Å; T44-M63 WeakPolarHBondContact O-CG 3.36Å; T44-M63 PolarHBondContact O-N 3.48Å; T44-M63 VanDerWaalsContact O-N 3.16Å; C46-M63 WeakPolarHBondContact SG-CE 3.32Å
64	D	58.3	Low	64.4	Low	89 Å²	89	71.2 Å²	71.2	48%	0.476	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-82.1	157.6	165.6	-160.7	5.2	0	0	0	109.5	S66 K67 T68	D64-S66 PolarHBondContact O-N 3.44Å; D64-K67 PolarHBondContact O-N 3.41Å; D64-T68 PolarHBondContact N-O 3.34Å
65	D	55	Low	63.2	Low	171 Å²	171	74.3 Å²	74.3	91%	0.914	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.2	-174	-80.5	-26.3	0	0	0	113.4
66	S	55.3	Low	62.3	Low	72 Å²	72	71.2 Å²	71.2	50%	0.503	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	8.6	176.8	57.8	0	0	0	0	115.7	D64 T68	D64-S66 PolarHBondContact O-N 3.44Å; S66-T68 PolarHBondContact O-N 2.83Å; S66-T68 VanDerWaalsContact O-N 3.12Å; S66-T68 PolarHBondContact OG-OG1 2.91Å
67	K	56.9	Low	61.8	Low	173 Å²	173	76.9 Å²	76.9	75%	0.752	43%	0.428	S	S	*	.	S	Bend	trans	59.1	19	-177.4	-55.6	176	178.6	175.4	0	114.1	D64	D64-K67 PolarHBondContact O-N 3.41Å
68	T	54.6	Low	61.5	Low	79 Å²	79	83.1 Å²	83.1	49%	0.485	46%	0.455	S	S	.	.	S	Bend	trans	-110.5	143.8	172.6	48.6	0	0	0	0	108.4	D64 S66 G70	D64-T68 PolarHBondContact N-O 3.34Å; S66-T68 PolarHBondContact O-N 2.83Å; S66-T68 VanDerWaalsContact O-N 3.12Å; S66-T68 PolarHBondContact OG-OG1 2.91Å; T68-G70 PolarHBondContact O-N 3.32Å
69	C	59.9	Low	61.5	Low	45 Å²	45	86.3 Å²	86.3	30%	0.304	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-59.2	125.7	172.3	-56.3	0	0	0	0	108.7	M39 C46	M39-C69 WeakPolarHBondContact CE-SG 3.37Å; C46-C69 HydrophobicContact CB-CB 3.87Å; C46-C69 WeakPolarHBondContact CB-SG 3.35Å; C46-C69 WeakPolarHBondContact SG-CA 3.32Å; C46-C69 WeakPolarHBondContact SG-CB 3.49Å; C46-C69 CovalentContact SG-SG 2.04Å; C46-C69 PolarHBondContact SG-SG 3.4Å
70	G	59.6	Low	61.7	Low	6 Å²	6	87.2 Å²	87.2	6%	0.062	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-58.5	164.3	172.6	0	0	0	0	0	111.3	T68 I72	T68-G70 PolarHBondContact O-N 3.32Å; G70-I72 PolarHBondContact O-N 3.07Å
71	P	58.3	Low	61.7	Low	81 Å²	81	83.7 Å²	83.7	53%	0.526	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-56.1	138.3	-175.4	16.5	-25.1	0	0	0	111.6	T73 L74	P71-T73 PolarHBondContact O-N 3.06Å; P71-L74 HydrophobicContact CB-CD1 4.33Å; P71-L74 HydrophobicContact CG-CD1 3.47Å; P71-L74 VanDerWaalsContact CG-CD1 3.47Å; P71-L74 VanDerWaalsContact O-CD1 3.3Å; P71-L74 WeakPolarHBondContact O-CD1 3.45Å; P71-L74 PolarHBondContact O-N 3.34Å
72	I	58.8	Low	61.6	Low	87 Å²	87	88.6 Å²	88.6	45%	0.446	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-13.4	-175.2	-56.8	161.4	0	0	0	112.2	V34 K59 G70	V34-I72 HydrophobicContact CG1-CD1 4.42Å; K59-I72 PolarHBondContact NZ-O 2.98Å; G70-I72 PolarHBondContact O-N 3.07Å
73	T	56.8	Low	61.4	Low	124 Å²	124	87.1 Å²	87.1	76%	0.761	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-13.4	174.1	49.7	0	0	0	0	114.9	P71	P71-T73 PolarHBondContact O-N 3.06Å
74	L	55.4	Low	60.9	Low	65 Å²	65	92 Å²	92	34%	0.34	49%	0.492	S	S	.	.	S	Bend	trans	-63.3	139.4	178.2	-94.8	76	0	0	0	111.8	K59 P71 G76	K59-L74 WeakPolarHBondContact CE-O 3.46Å; K59-L74 PolarHBondContact NZ-O 2.99Å; P71-L74 HydrophobicContact CB-CD1 4.33Å; P71-L74 HydrophobicContact CG-CD1 3.47Å; P71-L74 VanDerWaalsContact CG-CD1 3.47Å; P71-L74 VanDerWaalsContact O-CD1 3.3Å; P71-L74 WeakPolarHBondContact O-CD1 3.45Å; P71-L74 PolarHBondContact O-N 3.34Å; L74-G76 PolarHBondContact O-N 3.48Å
75	P	53.1	Low	60.3	Low	124 Å²	124	93.6 Å²	93.6	81%	0.805	50%	0.496	S	S	*	.			trans	-65.5	124.2	174	27.4	-31.6	0	0	0	109.6
76	G	60	Low	59.9	Low	30 Å²	30	90.3 Å²	90.3	31%	0.309	47%	0.474	S	S	.	.			trans	-143.8	164.2	179.7	0	0	0	0	0	109.7	R60 L74 K78	R60-G76 WeakPolarHBondContact O-CA 3.4Å; L74-G76 PolarHBondContact O-N 3.48Å; G76-K78 PolarHBondContact O-N 2.91Å; G76-K78 VanDerWaalsContact O-N 3.16Å
77	E	65.2	Low	59.1	Low	151 Å²	151	91.6 Å²	91.6	71%	0.706	48%	0.475	S	S	*	.			trans	-60	120.5	177.1	-72.5	-176.2	163.7	0	0	109.5	K59 R60	K59-E77 WeakPolarHBondContact CA-O 3.49Å; R60-E77 PolarHBondContact N-O 2.84Å
78	K	70.9	Confident	58.6	Low	136 Å²	136	89 Å²	89	59%	0.591	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	106.3	-179.2	-179	174.4	175.7	174.2	0	107.9	G76 C80	G76-K78 PolarHBondContact O-N 2.91Å; G76-K78 VanDerWaalsContact O-N 3.16Å; K78-C80 WeakPolarHBondContact CE-SG 3.36Å
79	N	76.8	Confident	58.1	Low	108 Å²	108	88.7 Å²	88.7	58%	0.578	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	114.5	173	-166	-1.2	0	0	0	108.5	C57 T58	C57-N79 CarbonylContact C-O 3.57Å; C57-N79 WeakPolarHBondContact CA-O 3.19Å; T58-N79 PolarHBondContact N-O 3.37Å; T58-N79 PolarHBondContact O-N 3.02Å; T58-N79 PolarHBondContact OG1-O 3.43Å
80	C	78.3	Confident	57.2	Low	50 Å²	50	93.4 Å²	93.4	34%	0.338	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.2	178.6	-67.4	0	0	0	0	109.3	I56 C57 K78	I56-C80 WeakPolarHBondContact O-CA 3.23Å; C57-C80 HydrophobicContact CB-CB 4.19Å; C57-C80 WeakPolarHBondContact CB-SG 3.39Å; C57-C80 WeakPolarHBondContact SG-CB 3.46Å; C57-C80 CovalentContact SG-SG 2.04Å; C57-C80 PolarHBondContact SG-SG 3.46Å; K78-C80 WeakPolarHBondContact CE-SG 3.36Å
81	S	70.3	Confident	56.5	Low	35 Å²	35	99 Å²	99	25%	0.245	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.5	173.8	58.1	0	0	0	0	109.9	I56	I56-S81 WeakPolarHBondContact CG2-OG 3.44Å; I56-S81 PolarHBondContact N-O 3.45Å; I56-S81 PolarHBondContact O-N 3.43Å
82	Y	66.4	Low	55.6	Low	105 Å²	105	96.9 Å²	96.9	41%	0.412	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	150	167.4	-69.5	-97.6	0	0	0	108.9	R55 R84	R55-Y82 HydrophobicContact CG-CD1 3.55Å; R55-Y82 HydrophobicContact CG-CE1 3.61Å; R55-Y82 HydrophobicContact CG-CG 4.09Å; R55-Y82 VanDerWaalsContact NE-CZ 3.29Å; R55-Y82 PolarHBondContact NE-OH 3.41Å; R55-Y82 PolarHBondContact NH1-OH 2.92Å; R55-Y82 VanDerWaalsContact NH1-OH 3.14Å; R55-Y82 PolarHBondContact NH2-OH 3.38Å; Y82-R84 PolarHBondContact O-N 3.39Å
83	F	59.9	Low	54.9	Low	41 Å²	41	100.7 Å²	100.7	18%	0.18	55%	0.548	C	S	.	.			trans	-56.9	128.6	167	-72.1	-75.2	0	0	0	109.2	H85 F86	F83-H85 PolarHBondContact O-N 2.88Å; F83-F86 PolarHBondContact O-N 3.22Å
84	R	49.9	Very low	54.2	Low	160 Å²	160	100.5 Å²	100.5	60%	0.604	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-16	-172	-159	178.9	179.7	158.5	0.5	115.4	Y82 F86	Y82-R84 PolarHBondContact O-N 3.39Å; R84-F86 VanDerWaalsContact C-N 3.29Å; R84-F86 PolarHBondContact O-N 3.5Å
85	H	45	Very low	53.6	Low	122 Å²	122	102.3 Å²	102.3	57%	0.565	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.9	173.4	-171.3	62	0	0	0	113.7	F83	F83-H85 PolarHBondContact O-N 2.88Å
86	F	46.3	Very low	52.8	Low	103 Å²	103	104 Å²	104	45%	0.452	54%	0.544	S	S	.	.	S	Bend	trans	-92.7	-12.4	-176.5	-65.8	-74	0	0	0	114.4	W54 F83 R84	W54-F86 HydrophobicContact CE3-CE1 4.32Å; W54-F86 HydrophobicContact CE3-CE2 4.05Å; W54-F86 AromaticContact CE3-CZ 3.74Å; W54-F86 HydrophobicContact CE3-CZ 3.74Å; W54-F86 HydrophobicContact CZ3-CE1 4.1Å; W54-F86 HydrophobicContact CZ3-CE2 4.45Å; W54-F86 AromaticContact CZ3-CZ 3.69Å; W54-F86 HydrophobicContact CZ3-CZ 3.69Å; F83-F86 PolarHBondContact O-N 3.22Å; R84-F86 VanDerWaalsContact C-N 3.29Å; R84-F86 PolarHBondContact O-N 3.5Å
87	N	38.7	Very low	52.1	Low	98 Å²	98	105.4 Å²	105.4	52%	0.524	54%	0.541	S	S	.	.			trans	-153.2	91.8	177	-148	-2.4	0	0	0	111.3	G89	N87-G89 VanDerWaalsContact C-N 3.34Å; N87-G89 PolarHBondContact O-N 3.38Å
88	P	46.2	Very low	51	Low	118 Å²	118	103.5 Å²	103.5	77%	0.766	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	78.8	-178.7	31.7	-32.6	0	0	0	110.4
89	G	44.8	Very low	49.7	Very low	73 Å²	73	101.1 Å²	101.1	75%	0.753	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-171.1	-17.1	178.7	0	0	0	0	0	117.1	N87	N87-G89 VanDerWaalsContact C-N 3.34Å; N87-G89 PolarHBondContact O-N 3.38Å
90	E	41	Very low	48.5	Very low	144 Å²	144	97.3 Å²	97.3	67%	0.673	52%	0.516	S	S	*	.			trans	-111.2	129	-171.5	-158.5	160.3	-169.1	0	0	111.8	S92	E90-S92 VanDerWaalsContact C-N 3.32Å; E90-S92 PolarHBondContact O-N 2.86Å
91	S	44.6	Very low	47.5	Very low	124 Å²	124	101 Å²	101	87%	0.867	53%	0.526	S	S	*	.			trans	-69.9	83.3	179.2	52.7	0	0	0	0	110.4
92	S	39.8	Very low	47.2	Very low	37 Å²	37	105.6 Å²	105.6	26%	0.259	54%	0.543	S	S	.	.			trans	-95.8	140.5	165.3	41.8	0	0	0	0	109.3	E90 I94	E90-S92 VanDerWaalsContact C-N 3.32Å; E90-S92 PolarHBondContact O-N 2.86Å; S92-I94 PolarHBondContact O-N 2.98Å
93	E	44.6	Very low	47.3	Very low	166 Å²	166	103.9 Å²	103.9	78%	0.776	54%	0.537	S	S	*	.			trans	-48.7	125	-176.2	-66.5	-177.4	159.6	0	0	110.7	F95	E93-F95 VanDerWaalsContact C-N 3.33Å; E93-F95 PolarHBondContact O-N 3.24Å
94	I	40.7	Very low	47.9	Very low	120 Å²	120	102.6 Å²	102.6	62%	0.615	53%	0.533	S	S	*	.			trans	-71.2	89.6	-174.7	-64.9	164.5	0	0	0	106.9	S92 E96	S92-I94 PolarHBondContact O-N 2.98Å; I94-E96 HydrophobicContact CG2-CB 3.75Å; I94-E96 HydrophobicContact CG2-CG 3.97Å; I94-E96 PolarHBondContact O-N 3.47Å; I94-E96 VanDerWaalsContact O-N 3.08Å
95	F	42.7	Very low	49.1	Very low	103 Å²	103	97.9 Å²	97.9	45%	0.452	52%	0.519	S	S	.	.			trans	-77.7	86.7	162.3	-139.7	-93.7	0	0	0	106.8	E93 F97 Q100 T171 W173	E93-F95 VanDerWaalsContact C-N 3.33Å; E93-F95 PolarHBondContact O-N 3.24Å; F95-F97 AromaticContact CD1-CD2 3.67Å; F95-F97 HydrophobicContact CD1-CD2 3.67Å; F95-F97 HydrophobicContact CD1-CE2 4.24Å; F95-F97 AromaticContact CE1-CD2 3.61Å; F95-F97 HydrophobicContact CE1-CD2 3.61Å; F95-F97 AromaticContact CE1-CE2 3.85Å; F95-F97 HydrophobicContact CE1-CE2 3.85Å; F95-F97 HydrophobicContact CZ-CE2 4.45Å; F95-F97 PolarHBondContact O-N 3.28Å; F95-Q100 VanDerWaalsContact CD1-OE1 3.29Å; F95-T171 HydrophobicContact CE1-CG2 4.31Å; F95-T171 HydrophobicContact CZ-CG2 4.29Å; F95-W173 AromaticContact CZ-NE1 3.94Å
96	E	37	Very low	51	Low	161 Å²	161	94.7 Å²	94.7	75%	0.752	51%	0.51	S	S	*	.			trans	-77.1	55.3	-170.3	-150.4	162.5	-179.8	0	0	112.7	I94	I94-E96 HydrophobicContact CG2-CB 3.75Å; I94-E96 HydrophobicContact CG2-CG 3.97Å; I94-E96 PolarHBondContact O-N 3.47Å; I94-E96 VanDerWaalsContact O-N 3.08Å
97	F	45.5	Very low	52.8	Low	58 Å²	58	89.8 Å²	89.8	25%	0.254	49%	0.489	S	S	.	.			trans	-112.7	99.9	167.7	-68	-76.8	0	0	0	109.5	F95 T99 Q100 D170 T171	F95-F97 AromaticContact CD1-CD2 3.67Å; F95-F97 HydrophobicContact CD1-CD2 3.67Å; F95-F97 HydrophobicContact CD1-CE2 4.24Å; F95-F97 AromaticContact CE1-CD2 3.61Å; F95-F97 HydrophobicContact CE1-CD2 3.61Å; F95-F97 AromaticContact CE1-CE2 3.85Å; F95-F97 HydrophobicContact CE1-CE2 3.85Å; F95-F97 HydrophobicContact CZ-CE2 4.45Å; F95-F97 PolarHBondContact O-N 3.28Å; F97-T99 PolarHBondContact O-N 3.06Å; F97-T99 VanDerWaalsContact O-N 3.1Å; F97-Q100 HydrophobicContact CB-CB 4.23Å; F97-Q100 WeakPolarHBondContact O-CB 3.27Å; F97-Q100 PolarHBondContact O-N 3.2Å; F97-D170 HydrophobicContact CE1-CB 4.19Å; F97-D170 HydrophobicContact CZ-CB 3.62Å; F97-T171 HydrophobicContact CE2-CG2 3.91Å; F97-T171 HydrophobicContact CZ-CG2 4.2Å
98	T	42.1	Very low	54.9	Low	112 Å²	112	85.3 Å²	85.3	69%	0.687	47%	0.466	S	S	*	.	H	α-helix	trans	-51.8	-29.6	175.5	46.4	0	0	0	0	112.6
99	T	43.6	Very low	56.9	Low	85 Å²	85	81.6 Å²	81.6	52%	0.521	45%	0.445	S	S	.	.	H	α-helix	trans	-73.8	-33.4	178	53.2	0	0	0	0	113.6	F97 K101 Y103	F97-T99 PolarHBondContact O-N 3.06Å; F97-T99 VanDerWaalsContact O-N 3.1Å; T99-K101 VanDerWaalsContact C-N 3.35Å; T99-Y103 WeakPolarHBondContact O-CD2 3.19Å
100	Q	50.9	Low	59.2	Low	29 Å²	29	79.9 Å²	79.9	14%	0.136	42%	0.418	C	S	.	.	H	α-helix	trans	-67.8	-36	178.4	-177.4	-174.9	-0.8	0	0	112.2	F95 F97 E102 S104	F95-Q100 VanDerWaalsContact CD1-OE1 3.29Å; F97-Q100 HydrophobicContact CB-CB 4.23Å; F97-Q100 WeakPolarHBondContact O-CB 3.27Å; F97-Q100 PolarHBondContact O-N 3.2Å; Q100-E102 VanDerWaalsContact C-N 3.35Å; Q100-E102 PolarHBondContact O-N 3.27Å; Q100-S104 PolarHBondContact O-N 3.14Å; Q100-S104 PolarHBondContact O-OG 3.42Å
101	K	57.6	Low	61.4	Low	126 Å²	126	73.2 Å²	73.2	55%	0.548	39%	0.388	S	S	.	.	H	α-helix	trans	-62.2	-39.1	-177.6	-176.5	179.3	176.1	-174.7	0	112.4	T99 S104 I105	T99-K101 VanDerWaalsContact C-N 3.35Å; K101-S104 PolarHBondContact O-OG 3.41Å; K101-I105 HydrophobicContact CG-CD1 3.82Å; K101-I105 WeakPolarHBondContact O-CB 3.26Å; K101-I105 WeakPolarHBondContact O-CD1 3.22Å; K101-I105 WeakPolarHBondContact O-CG1 3.29Å; K101-I105 PolarHBondContact O-N 3.37Å
102	E	63.3	Low	63.7	Low	132 Å²	132	71.8 Å²	71.8	62%	0.617	37%	0.369	S	S	*	.	H	α-helix	trans	-77	-38.5	-173.1	-63.9	-175.9	166.4	0	0	112.8	Q100 S106	Q100-E102 VanDerWaalsContact C-N 3.35Å; Q100-E102 PolarHBondContact O-N 3.27Å; E102-S106 WeakPolarHBondContact O-CB 3.45Å; E102-S106 PolarHBondContact O-N 3.43Å; E102-S106 PolarHBondContact O-OG 3.44Å
103	Y	69.3	Low	66.2	Low	69 Å²	69	76.5 Å²	76.5	27%	0.271	39%	0.385	S	S	.	.	H	α-helix	trans	-73.3	-38.8	179.5	-68.9	-77.2	0	0	0	112.9	T99 S106 A107 V157 R164	T99-Y103 WeakPolarHBondContact O-CD2 3.19Å; Y103-S106 PolarHBondContact O-N 3.24Å; Y103-A107 PolarHBondContact O-N 2.97Å; Y103-V157 HydrophobicContact CD1-CG1 4.28Å; Y103-V157 WeakPolarHBondContact O-CG1 3.36Å; Y103-R164 VanDerWaalsContact CZ-NH1 3.27Å; Y103-R164 PolarHBondContact OH-NH1 2.96Å
104	S	72.2	Confident	68.6	Low	14 Å²	14	68.7 Å²	68.7	10%	0.098	35%	0.349	C	S	.	.	H	α-helix	trans	-66.7	-40.1	176.1	62.8	0	0	0	0	111.9	Q100 K101 S106 A107 A108	Q100-S104 PolarHBondContact O-N 3.14Å; Q100-S104 PolarHBondContact O-OG 3.42Å; K101-S104 PolarHBondContact O-OG 3.41Å; S104-S106 VanDerWaalsContact C-N 3.33Å; S104-S106 PolarHBondContact O-N 2.93Å; S104-A107 PolarHBondContact O-N 3.45Å; S104-A108 PolarHBondContact O-N 3.31Å
105	I	75.9	Confident	71.1	Confident	62 Å²	62	64.8 Å²	64.8	32%	0.318	33%	0.329	S	S	.	.	H	α-helix	trans	-60.3	-44.5	173.2	-70.9	170.4	0	0	0	110.8	K101 A108 A109	K101-I105 HydrophobicContact CG-CD1 3.82Å; K101-I105 WeakPolarHBondContact O-CB 3.26Å; K101-I105 WeakPolarHBondContact O-CD1 3.22Å; K101-I105 WeakPolarHBondContact O-CG1 3.29Å; K101-I105 PolarHBondContact O-N 3.37Å; I105-A108 PolarHBondContact O-N 3.19Å; I105-A109 WeakPolarHBondContact O-CB 3.46Å; I105-A109 PolarHBondContact O-N 3.14Å
106	S	83.3	Confident	73.6	Confident	54 Å²	54	61.3 Å²	61.3	38%	0.378	32%	0.323	S	S	.	.	H	α-helix	trans	-62.6	-44.2	178.8	-60.2	0	0	0	0	111.6	E102 Y103 S104 A108 A109 I110	E102-S106 WeakPolarHBondContact O-CB 3.45Å; E102-S106 PolarHBondContact O-N 3.43Å; E102-S106 PolarHBondContact O-OG 3.44Å; Y103-S106 PolarHBondContact O-N 3.24Å; S104-S106 VanDerWaalsContact C-N 3.33Å; S104-S106 PolarHBondContact O-N 2.93Å; S106-A108 PolarHBondContact O-N 3.03Å; S106-A109 PolarHBondContact O-N 3.21Å; S106-I110 WeakPolarHBondContact O-CD1 3.39Å; S106-I110 VanDerWaalsContact O-CG1 3.24Å; S106-I110 WeakPolarHBondContact O-CG1 3.44Å; S106-I110 PolarHBondContact O-N 3.4Å
107	A	84.1	Confident	76.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-41.9	177.6	0	0	0	0	0	112.4	L53 Y103 S104 A111 S154 V157	L53-A107 HydrophobicContact CD1-CB 4.06Å; Y103-A107 PolarHBondContact O-N 2.97Å; S104-A107 PolarHBondContact O-N 3.45Å; A107-A111 WeakPolarHBondContact O-CB 3.4Å; A107-A111 PolarHBondContact O-N 2.89Å; A107-S154 PolarHBondContact O-OG 3.05Å; A107-V157 HydrophobicContact CB-CB 4.22Å; A107-V157 HydrophobicContact CB-CG1 3.84Å
108	A	84.7	Confident	78.8	Confident	5 Å²	5	54.3 Å²	54.3	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-42.9	176.5	0	0	0	0	0	112.3	L53 W54 S104 I105 S106 I110 A111 I112	L53-A108 HydrophobicContact CD2-CB 4.37Å; L53-A108 HydrophobicContact CG-CB 4.31Å; W54-A108 HydrophobicContact CH2-CB 4.39Å; W54-A108 HydrophobicContact CZ3-CB 4.27Å; S104-A108 PolarHBondContact O-N 3.31Å; I105-A108 PolarHBondContact O-N 3.19Å; S106-A108 PolarHBondContact O-N 3.03Å; A108-I110 PolarHBondContact O-N 3.48Å; A108-A111 PolarHBondContact O-N 3.24Å; A108-I112 WeakPolarHBondContact O-CG1 3.47Å; A108-I112 PolarHBondContact O-N 3.46Å
109	A	88.1	Confident	81.4	Confident	39 Å²	39	53.7 Å²	53.7	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-60.2	-44.4	176.2	0	0	0	0	0	111.9	I105 S106 A111 I112 F113	I105-A109 WeakPolarHBondContact O-CB 3.46Å; I105-A109 PolarHBondContact O-N 3.14Å; S106-A109 PolarHBondContact O-N 3.21Å; A109-A111 VanDerWaalsContact C-N 3.34Å; A109-A111 PolarHBondContact O-N 3.21Å; A109-I112 WeakPolarHBondContact O-CB 3.29Å; A109-I112 PolarHBondContact O-N 3.03Å; A109-F113 WeakPolarHBondContact O-CD2 3.35Å; A109-F113 PolarHBondContact O-N 3.29Å; A109-F113 VanDerWaalsContact O-N 3.12Å
110	I	91.4	Very high	83.8	Confident	38 Å²	38	53.5 Å²	53.5	20%	0.195	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-38.6	177.4	-65.5	162.3	0	0	0	111.3	S106 A108 I112 F113 S114 C150 V153 V157	S106-I110 WeakPolarHBondContact O-CD1 3.39Å; S106-I110 VanDerWaalsContact O-CG1 3.24Å; S106-I110 WeakPolarHBondContact O-CG1 3.44Å; S106-I110 PolarHBondContact O-N 3.4Å; A108-I110 PolarHBondContact O-N 3.48Å; I110-I112 VanDerWaalsContact C-N 3.32Å; I110-I112 PolarHBondContact O-N 3.45Å; I110-F113 PolarHBondContact O-N 2.98Å; I110-S114 PolarHBondContact O-N 3.33Å; I110-C150 HydrophobicContact CG2-CB 3.98Å; I110-C150 WeakPolarHBondContact CG2-O 3.11Å; I110-V153 HydrophobicContact CD1-CG1 3.74Å; I110-V153 HydrophobicContact CG2-CB 4.3Å; I110-V157 HydrophobicContact CD1-CG2 4.28Å
111	A	88.9	Confident	85.9	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-36.8	174.7	0	0	0	0	0	112.2	V27 L53 A107 A108 A109 S114 L115	V27-A111 HydrophobicContact CG1-CB 4.46Å; V27-A111 HydrophobicContact CG2-CB 4.16Å; L53-A111 HydrophobicContact CD2-CB 3.4Å; L53-A111 VanDerWaalsContact CD2-CB 3.4Å; A107-A111 WeakPolarHBondContact O-CB 3.4Å; A107-A111 PolarHBondContact O-N 2.89Å; A108-A111 PolarHBondContact O-N 3.24Å; A109-A111 VanDerWaalsContact C-N 3.34Å; A109-A111 PolarHBondContact O-N 3.21Å; A111-S114 WeakPolarHBondContact O-CB 3.11Å; A111-S114 PolarHBondContact O-N 3.42Å; A111-L115 WeakPolarHBondContact O-CG 3.46Å; A111-L115 PolarHBondContact O-N 2.94Å
112	I	91.1	Very high	87.6	Confident	93 Å²	93	47.9 Å²	47.9	48%	0.477	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-45.9	172.6	-66.6	161.1	0	0	0	110.8	W54 A108 A109 I110 S114 L115 G116	W54-I112 HydrophobicContact CH2-CD1 3.82Å; W54-I112 HydrophobicContact CH2-CG1 3.79Å; W54-I112 HydrophobicContact CZ2-CG1 4.43Å; W54-I112 HydrophobicContact CZ3-CD1 4.43Å; A108-I112 WeakPolarHBondContact O-CG1 3.47Å; A108-I112 PolarHBondContact O-N 3.46Å; A109-I112 WeakPolarHBondContact O-CB 3.29Å; A109-I112 PolarHBondContact O-N 3.03Å; I110-I112 VanDerWaalsContact C-N 3.32Å; I110-I112 PolarHBondContact O-N 3.45Å; I112-S114 VanDerWaalsContact C-N 3.3Å; I112-S114 PolarHBondContact O-N 2.86Å; I112-L115 PolarHBondContact O-N 3.17Å; I112-G116 PolarHBondContact O-N 3.42Å
113	F	93.7	Very high	89	Confident	136 Å²	136	45.8 Å²	45.8	60%	0.596	25%	0.249	S	C	*	.	H	α-helix	trans	-60.3	-41.4	175.9	-72.9	-63.5	0	0	0	112	A109 I110 L115 G116 F117	A109-F113 WeakPolarHBondContact O-CD2 3.35Å; A109-F113 PolarHBondContact O-N 3.29Å; A109-F113 VanDerWaalsContact O-N 3.12Å; I110-F113 PolarHBondContact O-N 2.98Å; F113-L115 PolarHBondContact O-N 3.37Å; F113-G116 PolarHBondContact O-N 3.1Å; F113-F117 VanDerWaalsContact O-CD2 3.28Å; F113-F117 WeakPolarHBondContact O-CD2 3.38Å; F113-F117 PolarHBondContact O-N 3.25Å
114	S	94.1	Very high	90.1	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-48.4	173.5	178.7	0	0	0	0	111.9	I110 A111 I112 G116 F117 V118 A147 I151	I110-S114 PolarHBondContact O-N 3.33Å; A111-S114 WeakPolarHBondContact O-CB 3.11Å; A111-S114 PolarHBondContact O-N 3.42Å; I112-S114 VanDerWaalsContact C-N 3.3Å; I112-S114 PolarHBondContact O-N 2.86Å; S114-G116 VanDerWaalsContact C-N 3.3Å; S114-G116 PolarHBondContact O-N 3.45Å; S114-F117 PolarHBondContact O-N 3.07Å; S114-V118 WeakPolarHBondContact O-CG2 3.47Å; S114-V118 PolarHBondContact O-N 3.32Å; S114-A147 PolarHBondContact OG-O 3.3Å; S114-A147 VanDerWaalsContact OG-O 3.12Å; S114-I151 VanDerWaalsContact OG-CG1 3.27Å; S114-I151 WeakPolarHBondContact OG-CG1 3.33Å
115	L	93.5	Very high	91	Very high	38 Å²	38	43.6 Å²	43.6	20%	0.199	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-40.1	177.1	-68.8	-179	0	0	0	111.8	M24 V27 A111 I112 F113 F117 V118 I119	M24-L115 HydrophobicContact SD-CD1 4.42Å; M24-L115 HydrophobicContact SD-CD2 3.31Å; M24-L115 WeakPolarHBondContact SD-CD2 3.34Å; M24-L115 HydrophobicContact SD-CG 4.49Å; V27-L115 HydrophobicContact CG1-CD1 4.18Å; A111-L115 WeakPolarHBondContact O-CG 3.46Å; A111-L115 PolarHBondContact O-N 2.94Å; I112-L115 PolarHBondContact O-N 3.17Å; F113-L115 PolarHBondContact O-N 3.37Å; L115-F117 PolarHBondContact O-N 3.32Å; L115-V118 PolarHBondContact O-N 2.68Å; L115-I119 VanDerWaalsContact O-CG1 3.27Å; L115-I119 WeakPolarHBondContact O-CG1 3.18Å; L115-I119 PolarHBondContact O-N 3.34Å
116	G	95.3	Very high	91.6	Very high	30 Å²	30	46.2 Å²	46.2	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-56.8	-46.5	173.3	0	0	0	0	0	112.5	I112 F113 S114 I119 L120	I112-G116 PolarHBondContact O-N 3.42Å; F113-G116 PolarHBondContact O-N 3.1Å; S114-G116 VanDerWaalsContact C-N 3.3Å; S114-G116 PolarHBondContact O-N 3.45Å; G116-I119 PolarHBondContact O-N 3.47Å; G116-L120 WeakPolarHBondContact O-CG 3.31Å; G116-L120 PolarHBondContact O-N 2.97Å
117	F	96.1	Very high	91.8	Very high	61 Å²	61	48.6 Å²	48.6	27%	0.268	27%	0.265	S	S	.	.	H	α-helix	trans	-66	-37.4	176.1	-70.3	-48.7	0	0	0	113.1	F113 S114 L115 I119 L120 G121 F143 F146 A147	F113-F117 VanDerWaalsContact O-CD2 3.28Å; F113-F117 WeakPolarHBondContact O-CD2 3.38Å; F113-F117 PolarHBondContact O-N 3.25Å; S114-F117 PolarHBondContact O-N 3.07Å; L115-F117 PolarHBondContact O-N 3.32Å; F117-I119 VanDerWaalsContact C-N 3.34Å; F117-I119 PolarHBondContact O-N 3.29Å; F117-L120 HydrophobicContact CD1-CD1 4.5Å; F117-L120 PolarHBondContact O-N 3.3Å; F117-G121 PolarHBondContact O-N 3.45Å; F117-F143 AromaticContact CD1-CD1 3.71Å; F117-F143 HydrophobicContact CD1-CD1 3.71Å; F117-F143 HydrophobicContact CD1-CE1 4.27Å; F117-F143 HydrophobicContact CE1-CD1 4.24Å; F117-F143 HydrophobicContact CE1-CE1 4.46Å; F117-F146 HydrophobicContact CD2-CB 4.19Å; F117-F146 HydrophobicContact CE2-CB 4.33Å; F117-F146 HydrophobicContact CG-CB 4.49Å; F117-A147 HydrophobicContact CB-CB 3.93Å
118	V	95.9	Very high	92	Very high	10 Å²	10	48.6 Å²	48.6	6%	0.061	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-43.5	173.3	169.4	0	0	0	0	111.2	I20 S114 L115 G121 S122 A147	I20-V118 HydrophobicContact CB-CG1 4.33Å; I20-V118 HydrophobicContact CD1-CG1 3.89Å; I20-V118 HydrophobicContact CG1-CG1 3.73Å; I20-V118 HydrophobicContact CG2-CG1 3.75Å; S114-V118 WeakPolarHBondContact O-CG2 3.47Å; S114-V118 PolarHBondContact O-N 3.32Å; L115-V118 PolarHBondContact O-N 2.68Å; V118-G121 PolarHBondContact O-N 2.92Å; V118-S122 WeakPolarHBondContact O-CB 3.49Å; V118-S122 PolarHBondContact O-N 3.42Å; V118-S122 PolarHBondContact O-OG 3.19Å; V118-A147 HydrophobicContact CG2-CB 3.71Å
119	I	95.6	Very high	91.8	Very high	99 Å²	99	52.8 Å²	52.8	51%	0.508	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-49.5	178	-66.3	163.3	0	0	0	110.2	L115 G116 F117 G121 S122 L123	L115-I119 VanDerWaalsContact O-CG1 3.27Å; L115-I119 WeakPolarHBondContact O-CG1 3.18Å; L115-I119 PolarHBondContact O-N 3.34Å; G116-I119 PolarHBondContact O-N 3.47Å; F117-I119 VanDerWaalsContact C-N 3.34Å; F117-I119 PolarHBondContact O-N 3.29Å; I119-G121 PolarHBondContact O-N 3.23Å; I119-S122 WeakPolarHBondContact CA-OG 3.49Å; I119-S122 PolarHBondContact O-N 3.32Å; I119-S122 PolarHBondContact O-OG 2.87Å; I119-L123 HydrophobicContact CG2-CD1 4.12Å; I119-L123 WeakPolarHBondContact O-CG 3.45Å; I119-L123 PolarHBondContact O-N 3.31Å
120	L	95.4	Very high	91.2	Very high	82 Å²	82	54.1 Å²	54.1	43%	0.429	30%	0.301	S	S	.	.	H	α-helix	trans	-59.7	-45.2	176.8	-70.8	170.3	0	0	0	112.1	G116 F117 L123 C124 F143	G116-L120 WeakPolarHBondContact O-CG 3.31Å; G116-L120 PolarHBondContact O-N 2.97Å; F117-L120 HydrophobicContact CD1-CD1 4.5Å; F117-L120 PolarHBondContact O-N 3.3Å; L120-L123 PolarHBondContact O-N 2.86Å; L120-C124 PolarHBondContact O-N 3.36Å; L120-C124 PolarHBondContact O-SG 2.91Å; L120-F143 HydrophobicContact CB-CD2 4.21Å; L120-F143 HydrophobicContact CB-CE2 4.33Å; L120-F143 HydrophobicContact CB-CG 4.42Å
121	G	94.5	Very high	90.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-46	177.2	0	0	0	0	0	112.5	F117 V118 I119 C124 V125	F117-G121 PolarHBondContact O-N 3.45Å; V118-G121 PolarHBondContact O-N 2.92Å; I119-G121 PolarHBondContact O-N 3.23Å; G121-C124 WeakPolarHBondContact O-CB 3.37Å; G121-C124 PolarHBondContact O-N 3.13Å; G121-V125 WeakPolarHBondContact O-CG2 3.34Å; G121-V125 PolarHBondContact O-N 2.78Å
122	S	93.1	Very high	89.4	Confident	36 Å²	36	67.3 Å²	67.3	25%	0.252	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-39.3	177.9	61	0	0	0	0	112.9	V118 I119 C124 V125 L126 Y144	V118-S122 WeakPolarHBondContact O-CB 3.49Å; V118-S122 PolarHBondContact O-N 3.42Å; V118-S122 PolarHBondContact O-OG 3.19Å; I119-S122 WeakPolarHBondContact CA-OG 3.49Å; I119-S122 PolarHBondContact O-N 3.32Å; I119-S122 PolarHBondContact O-OG 2.87Å; S122-C124 VanDerWaalsContact C-N 3.34Å; S122-C124 PolarHBondContact O-N 3.46Å; S122-V125 PolarHBondContact O-N 3.42Å; S122-L126 WeakPolarHBondContact O-CB 3.36Å; S122-L126 VanDerWaalsContact O-CG 3.27Å; S122-L126 WeakPolarHBondContact O-CG 3.27Å; S122-L126 PolarHBondContact O-N 3.26Å; S122-Y144 VanDerWaalsContact CA-OH 3.22Å; S122-Y144 WeakPolarHBondContact CA-OH 3.49Å; S122-Y144 PolarHBondContact N-OH 2.97Å
123	L	93.6	Very high	88.8	Confident	88 Å²	88	67.7 Å²	67.7	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-44.8	171.7	-72.5	169.6	0	0	0	111.4	I119 L120 V125 L126 L127	I119-L123 HydrophobicContact CG2-CD1 4.12Å; I119-L123 WeakPolarHBondContact O-CG 3.45Å; I119-L123 PolarHBondContact O-N 3.31Å; L120-L123 PolarHBondContact O-N 2.86Å; L123-V125 PolarHBondContact O-N 2.92Å; L123-L126 PolarHBondContact O-N 2.99Å; L123-L127 WeakPolarHBondContact O-CB 3.25Å; L123-L127 VanDerWaalsContact O-CG 3.27Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 3.47Å
124	C	91.9	Very high	88.1	Confident	24 Å²	24	62.8 Å²	62.8	16%	0.162	33%	0.331	C	S	.	.	H	α-helix	trans	-61.9	-41.6	176.9	-68.4	0	0	0	0	112.4	L120 G121 S122 S128 A140	L120-C124 PolarHBondContact O-N 3.36Å; L120-C124 PolarHBondContact O-SG 2.91Å; G121-C124 WeakPolarHBondContact O-CB 3.37Å; G121-C124 PolarHBondContact O-N 3.13Å; S122-C124 VanDerWaalsContact C-N 3.34Å; S122-C124 PolarHBondContact O-N 3.46Å; C124-S128 WeakPolarHBondContact O-CB 3.37Å; C124-S128 PolarHBondContact O-N 3.49Å; C124-A140 HydrophobicContact CB-CB 3.6Å
125	V	90.5	Very high	87.6	Confident	13 Å²	13	69 Å²	69	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-47.8	175.7	172.8	0	0	0	0	111.4	L13 G121 S122 L123 L127 S128 F129 L137 A140 Y144	L13-V125 HydrophobicContact CD1-CG1 4.36Å; L13-V125 HydrophobicContact CD2-CG1 3.96Å; L13-V125 HydrophobicContact CD2-CG2 4.03Å; G121-V125 WeakPolarHBondContact O-CG2 3.34Å; G121-V125 PolarHBondContact O-N 2.78Å; S122-V125 PolarHBondContact O-N 3.42Å; L123-V125 PolarHBondContact O-N 2.92Å; V125-L127 VanDerWaalsContact C-N 3.35Å; V125-L127 PolarHBondContact O-N 3.1Å; V125-S128 VanDerWaalsContact O-CB 3.29Å; V125-S128 WeakPolarHBondContact O-CB 3.49Å; V125-S128 PolarHBondContact O-N 2.89Å; V125-S128 VanDerWaalsContact O-N 3.14Å; V125-F129 HydrophobicContact CG1-CD2 3.93Å; V125-F129 HydrophobicContact CG1-CE2 3.49Å; V125-F129 VanDerWaalsContact CG1-CE2 3.49Å; V125-F129 VanDerWaalsContact O-CD2 3.23Å; V125-F129 WeakPolarHBondContact O-CD2 3.29Å; V125-F129 PolarHBondContact O-N 3.37Å; V125-L137 HydrophobicContact CG2-CD2 4.46Å; V125-A140 HydrophobicContact CG2-CB 3.74Å; V125-Y144 HydrophobicContact CG2-CE2 3.79Å
126	L	89.6	Confident	87.3	Confident	118 Å²	118	68.8 Å²	68.8	62%	0.618	35%	0.354	S	S	*	.	H	α-helix	trans	-60.7	-44	-179.5	-71.5	171.6	0	0	0	111.7	S122 L123 S128 F129 G130	S122-L126 WeakPolarHBondContact O-CB 3.36Å; S122-L126 VanDerWaalsContact O-CG 3.27Å; S122-L126 WeakPolarHBondContact O-CG 3.27Å; S122-L126 PolarHBondContact O-N 3.26Å; L123-L126 PolarHBondContact O-N 2.99Å; L126-S128 VanDerWaalsContact C-N 3.29Å; L126-S128 PolarHBondContact O-N 3.34Å; L126-F129 PolarHBondContact O-N 2.92Å; L126-G130 PolarHBondContact O-N 3Å
127	L	87.8	Confident	86.9	Confident	104 Å²	104	67.3 Å²	67.3	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-66.4	-30.4	176.9	-69.1	174.6	0	0	0	112.8	L123 V125 K131 L136	L123-L127 WeakPolarHBondContact O-CB 3.25Å; L123-L127 VanDerWaalsContact O-CG 3.27Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 3.47Å; V125-L127 VanDerWaalsContact C-N 3.35Å; V125-L127 PolarHBondContact O-N 3.1Å; L127-K131 PolarHBondContact O-N 2.83Å; L127-L136 HydrophobicContact CB-CD1 3.97Å
128	S	86.8	Confident	86.6	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-46.8	175.6	-172.5	0	0	0	0	111.4	C124 V125 L126 K132 R133	C124-S128 WeakPolarHBondContact O-CB 3.37Å; C124-S128 PolarHBondContact O-N 3.49Å; V125-S128 VanDerWaalsContact O-CB 3.29Å; V125-S128 WeakPolarHBondContact O-CB 3.49Å; V125-S128 PolarHBondContact O-N 2.89Å; V125-S128 VanDerWaalsContact O-N 3.14Å; L126-S128 VanDerWaalsContact C-N 3.29Å; L126-S128 PolarHBondContact O-N 3.34Å; S128-K132 PolarHBondContact O-N 3.48Å; S128-R133 WeakPolarHBondContact CB-O 3.5Å; S128-R133 PolarHBondContact O-N 3.38Å; S128-R133 PolarHBondContact OG-O 3.47Å
129	F	80.8	Confident	86.5	Confident	92 Å²	92	69.5 Å²	69.5	40%	0.404	35%	0.35	S	S	.	.	H	α-helix	trans	-67.1	-37.9	178.5	-71.7	-65.9	0	0	0	113.4	T4 L13 V125 L126	T4-F129 HydrophobicContact CG2-CD1 4.25Å; T4-F129 HydrophobicContact CG2-CE1 4.08Å; L13-F129 HydrophobicContact CD1-CE2 3.83Å; L13-F129 HydrophobicContact CD1-CZ 3.47Å; L13-F129 VanDerWaalsContact CD1-CZ 3.47Å; V125-F129 HydrophobicContact CG1-CD2 3.93Å; V125-F129 HydrophobicContact CG1-CE2 3.49Å; V125-F129 VanDerWaalsContact CG1-CE2 3.49Å; V125-F129 VanDerWaalsContact O-CD2 3.23Å; V125-F129 WeakPolarHBondContact O-CD2 3.29Å; V125-F129 PolarHBondContact O-N 3.37Å; L126-F129 PolarHBondContact O-N 2.92Å
130	G	75.1	Confident	86.4	Confident	68 Å²	68	64.8 Å²	64.8	70%	0.701	33%	0.326	S	S	*	.	H	α-helix	trans	-68.9	-34.7	-175.4	0	0	0	0	0	114.8	L126	L126-G130 PolarHBondContact O-N 3Å
131	K	73.3	Confident	86.3	Confident	143 Å²	143	60.9 Å²	60.9	62%	0.622	31%	0.306	S	S	*	.	H	α-helix	trans	-118.1	15.1	-175.2	-70.3	-174.3	178.3	180	0	114.3	L127 R133	L127-K131 PolarHBondContact O-N 2.83Å; K131-R133 HydrophobicContact CB-CG 3.85Å; K131-R133 PolarHBondContact O-N 2.97Å
132	K	69.1	Low	86.3	Confident	175 Å²	175	65.5 Å²	65.5	76%	0.761	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	35.3	-173.2	-59.5	178.2	-178.1	171.3	0	112.8	S128 D134	S128-K132 PolarHBondContact O-N 3.48Å; K132-D134 PolarHBondContact O-N 3.43Å
133	R	79.4	Confident	86.5	Confident	102 Å²	102	66.5 Å²	66.5	39%	0.385	33%	0.329	S	S	.	.			trans	-93.5	75.2	-176.8	-70.8	176.1	175.5	-173	-5	109.2	S128 K131 Y135 L136	S128-R133 WeakPolarHBondContact CB-O 3.5Å; S128-R133 PolarHBondContact O-N 3.38Å; S128-R133 PolarHBondContact OG-O 3.47Å; K131-R133 HydrophobicContact CB-CG 3.85Å; K131-R133 PolarHBondContact O-N 2.97Å; R133-Y135 HydrophobicContact CB-CD1 4.11Å; R133-Y135 HydrophobicContact CB-CE1 3.58Å; R133-Y135 VanDerWaalsContact CD-OH 3.31Å; R133-Y135 WeakPolarHBondContact CD-OH 3.27Å; R133-Y135 HydrophobicContact CG-CE1 3.65Å; R133-Y135 PolarHBondContact O-N 3.4Å; R133-L136 HydrophobicContact CB-CD1 3.74Å; R133-L136 HydrophobicContact CB-CG 4.12Å; R133-L136 WeakPolarHBondContact O-CB 3.48Å; R133-L136 PolarHBondContact O-N 2.96Å; R133-L136 VanDerWaalsContact O-N 3.11Å
134	D	79.6	Confident	86.6	Confident	32 Å²	32	62.7 Å²	62.7	17%	0.171	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-61.3	-26.9	-175.7	-69.2	-13.4	0	0	0	112.1	S2 Q3 T4 K132 L136 L137	S2-D134 VanDerWaalsContact CA-OD2 3.3Å; S2-D134 WeakPolarHBondContact CA-OD2 3.1Å; S2-D134 VanDerWaalsContact CB-OD2 3.27Å; S2-D134 WeakPolarHBondContact CB-OD2 3.4Å; S2-D134 PolarHBondContact OG-OD1 3.13Å; S2-D134 PolarHBondContact OG-OD2 3.14Å; Q3-D134 HydrophobicContact CB-CB 4.45Å; Q3-D134 PolarHBondContact N-OD2 3.27Å; T4-D134 WeakPolarHBondContact CG2-OD1 3.45Å; T4-D134 PolarHBondContact OG1-OD1 3.49Å; K132-D134 PolarHBondContact O-N 3.43Å; D134-L136 PolarHBondContact O-N 2.87Å; D134-L137 WeakPolarHBondContact O-CB 3.44Å; D134-L137 PolarHBondContact O-N 3.36Å; D134-L137 VanDerWaalsContact O-N 3.13Å
135	Y	82.3	Confident	86.8	Confident	135 Å²	135	62.3 Å²	62.3	53%	0.529	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-62.3	-23.5	176.7	66	-94.5	0	0	0	114.1	R133 L137 R138 P139	R133-Y135 HydrophobicContact CB-CD1 4.11Å; R133-Y135 HydrophobicContact CB-CE1 3.58Å; R133-Y135 VanDerWaalsContact CD-OH 3.31Å; R133-Y135 WeakPolarHBondContact CD-OH 3.27Å; R133-Y135 HydrophobicContact CG-CE1 3.65Å; R133-Y135 PolarHBondContact O-N 3.4Å; Y135-L137 PolarHBondContact O-N 3.23Å; Y135-R138 PolarHBondContact O-N 3.46Å; Y135-P139 VanDerWaalsContact O-CD 3.32Å; Y135-P139 WeakPolarHBondContact O-CD 3.34Å
136	L	87.9	Confident	87	Confident	32 Å²	32	66.9 Å²	66.9	17%	0.168	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-72	-14.8	177.6	-71.8	172.8	0	0	0	113.2	L127 R133 D134 R138 P139 A140	L127-L136 HydrophobicContact CB-CD1 3.97Å; R133-L136 HydrophobicContact CB-CD1 3.74Å; R133-L136 HydrophobicContact CB-CG 4.12Å; R133-L136 WeakPolarHBondContact O-CB 3.48Å; R133-L136 PolarHBondContact O-N 2.96Å; R133-L136 VanDerWaalsContact O-N 3.11Å; D134-L136 PolarHBondContact O-N 2.87Å; L136-R138 VanDerWaalsContact C-N 3.28Å; L136-R138 PolarHBondContact O-N 3.35Å; L136-P139 WeakPolarHBondContact O-CD 3.48Å; L136-P139 WeakPolarHBondContact O-CG 3.46Å; L136-A140 WeakPolarHBondContact O-CB 3.27Å; L136-A140 PolarHBondContact O-N 3.26Å
137	L	87.6	Confident	87.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-67.8	-29.1	175.4	-72.2	167.7	0	0	0	112.5	T4 V9 V125 D134 Y135 A140 S141	T4-L137 HydrophobicContact CG2-CD1 3.63Å; T4-L137 HydrophobicContact CG2-CG 4.46Å; V9-L137 HydrophobicContact CG1-CD1 4.46Å; V125-L137 HydrophobicContact CG2-CD2 4.46Å; D134-L137 WeakPolarHBondContact O-CB 3.44Å; D134-L137 PolarHBondContact O-N 3.36Å; D134-L137 VanDerWaalsContact O-N 3.13Å; Y135-L137 PolarHBondContact O-N 3.23Å; L137-A140 PolarHBondContact O-N 2.84Å; L137-S141 WeakPolarHBondContact O-CB 3.45Å; L137-S141 PolarHBondContact O-N 3.43Å; L137-S141 PolarHBondContact O-OG 3.02Å
138	R	90	Very high	87.7	Confident	70 Å²	70	56.3 Å²	56.3	26%	0.264	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-57.2	179.3	-60.1	-179.6	-172	172.3	8	112	Y135 L136 A140 S141 M142 S203	Y135-R138 PolarHBondContact O-N 3.46Å; L136-R138 VanDerWaalsContact C-N 3.28Å; L136-R138 PolarHBondContact O-N 3.35Å; R138-A140 VanDerWaalsContact C-N 3.29Å; R138-A140 PolarHBondContact O-N 2.93Å; R138-S141 PolarHBondContact O-N 2.88Å; R138-S141 PolarHBondContact O-OG 3.12Å; R138-M142 PolarHBondContact O-N 3.41Å; R138-S203 PolarHBondContact NE-O 3.17Å
139	P	92.8	Very high	88.2	Confident	46 Å²	46	59.6 Å²	59.6	30%	0.299	29%	0.287	S	S	.	.	H	α-helix	trans	-63.8	-34.3	176	25	-33.9	0	0	0	112.4	Y135 L136 S141 M142 F143	Y135-P139 VanDerWaalsContact O-CD 3.32Å; Y135-P139 WeakPolarHBondContact O-CD 3.34Å; L136-P139 WeakPolarHBondContact O-CD 3.48Å; L136-P139 WeakPolarHBondContact O-CG 3.46Å; P139-S141 VanDerWaalsContact C-N 3.33Å; P139-S141 PolarHBondContact O-N 3.45Å; P139-M142 PolarHBondContact O-N 3.28Å; P139-F143 HydrophobicContact CB-CE2 4.42Å; P139-F143 WeakPolarHBondContact O-CD2 3.4Å; P139-F143 PolarHBondContact O-N 2.97Å
140	A	93.8	Very high	88.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.2	-45.6	175	0	0	0	0	0	112.3	C124 V125 L136 L137 R138 M142 F143 Y144	C124-A140 HydrophobicContact CB-CB 3.6Å; V125-A140 HydrophobicContact CG2-CB 3.74Å; L136-A140 WeakPolarHBondContact O-CB 3.27Å; L136-A140 PolarHBondContact O-N 3.26Å; L137-A140 PolarHBondContact O-N 2.84Å; R138-A140 VanDerWaalsContact C-N 3.29Å; R138-A140 PolarHBondContact O-N 2.93Å; A140-M142 VanDerWaalsContact C-N 3.31Å; A140-M142 PolarHBondContact O-N 2.94Å; A140-F143 PolarHBondContact O-N 3.23Å; A140-Y144 WeakPolarHBondContact O-CD2 3.36Å; A140-Y144 PolarHBondContact O-N 3.22Å; A140-Y144 VanDerWaalsContact O-N 3.1Å
141	S	93.6	Very high	89.7	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-36.9	179.2	73.4	0	0	0	0	112.7	L137 R138 P139 Y144 A145 G196 L200	L137-S141 WeakPolarHBondContact O-CB 3.45Å; L137-S141 PolarHBondContact O-N 3.43Å; L137-S141 PolarHBondContact O-OG 3.02Å; R138-S141 PolarHBondContact O-N 2.88Å; R138-S141 PolarHBondContact O-OG 3.12Å; P139-S141 VanDerWaalsContact C-N 3.33Å; P139-S141 PolarHBondContact O-N 3.45Å; S141-Y144 PolarHBondContact O-N 3.21Å; S141-A145 PolarHBondContact O-N 2.92Å; S141-A145 VanDerWaalsContact O-N 3.09Å; S141-G196 WeakPolarHBondContact CB-O 3.33Å; S141-L200 WeakPolarHBondContact OG-CA 3.3Å; S141-L200 WeakPolarHBondContact OG-CB 2.96Å; S141-L200 WeakPolarHBondContact OG-CD1 3.33Å
142	M	94.6	Very high	90.7	Very high	96 Å²	96	49.6 Å²	49.6	47%	0.473	23%	0.23	S	C	.	.	H	α-helix	trans	-64.9	-45.5	174.6	-66.9	178.1	173.2	0	0	111.3	R138 P139 A140 Y144 A145 F146 L200	R138-M142 PolarHBondContact O-N 3.41Å; P139-M142 PolarHBondContact O-N 3.28Å; A140-M142 VanDerWaalsContact C-N 3.31Å; A140-M142 PolarHBondContact O-N 2.94Å; M142-Y144 VanDerWaalsContact C-N 3.3Å; M142-Y144 PolarHBondContact O-N 3.46Å; M142-A145 PolarHBondContact O-N 3.43Å; M142-A145 VanDerWaalsContact O-N 3.17Å; M142-F146 HydrophobicContact CB-CD2 4.47Å; M142-F146 HydrophobicContact CB-CE2 4.36Å; M142-F146 WeakPolarHBondContact O-CD2 3.3Å; M142-F146 PolarHBondContact O-N 3.44Å; M142-L200 HydrophobicContact CE-CD1 4.31Å
143	F	96.6	Very high	91.9	Very high	58 Å²	58	44.6 Å²	44.6	25%	0.254	21%	0.214	S	C	.	.	H	α-helix	trans	-60.3	-38.7	177.1	-68.3	-49.1	0	0	0	112.4	F117 L120 P139 A140 F146 A147	F117-F143 AromaticContact CD1-CD1 3.71Å; F117-F143 HydrophobicContact CD1-CD1 3.71Å; F117-F143 HydrophobicContact CD1-CE1 4.27Å; F117-F143 HydrophobicContact CE1-CD1 4.24Å; F117-F143 HydrophobicContact CE1-CE1 4.46Å; L120-F143 HydrophobicContact CB-CD2 4.21Å; L120-F143 HydrophobicContact CB-CE2 4.33Å; L120-F143 HydrophobicContact CB-CG 4.42Å; P139-F143 HydrophobicContact CB-CE2 4.42Å; P139-F143 WeakPolarHBondContact O-CD2 3.4Å; P139-F143 PolarHBondContact O-N 2.97Å; A140-F143 PolarHBondContact O-N 3.23Å; F143-F146 PolarHBondContact O-N 2.83Å; F143-A147 WeakPolarHBondContact O-CB 3.35Å; F143-A147 PolarHBondContact O-N 2.94Å
144	Y	96.3	Very high	92.4	Very high	8 Å²	8	39.8 Å²	39.8	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-66.7	-38.8	174.7	-68.1	-50.8	0	0	0	113.4	I16 I20 S122 V125 A140 S141 M142 A147 G148 L192 L199	I16-Y144 HydrophobicContact CD1-CD2 4Å; I16-Y144 HydrophobicContact CD1-CE2 4.39Å; I16-Y144 HydrophobicContact CG2-CD1 3.88Å; I16-Y144 HydrophobicContact CG2-CD2 3.95Å; I16-Y144 HydrophobicContact CG2-CE1 3.82Å; I16-Y144 HydrophobicContact CG2-CE2 3.87Å; I16-Y144 HydrophobicContact CG2-CG 3.94Å; I20-Y144 HydrophobicContact CD1-CE1 3.81Å; I20-Y144 HydrophobicContact CG1-CE1 4.44Å; S122-Y144 VanDerWaalsContact CA-OH 3.22Å; S122-Y144 WeakPolarHBondContact CA-OH 3.49Å; S122-Y144 PolarHBondContact N-OH 2.97Å; V125-Y144 HydrophobicContact CG2-CE2 3.79Å; A140-Y144 WeakPolarHBondContact O-CD2 3.36Å; A140-Y144 PolarHBondContact O-N 3.22Å; A140-Y144 VanDerWaalsContact O-N 3.1Å; S141-Y144 PolarHBondContact O-N 3.21Å; M142-Y144 VanDerWaalsContact C-N 3.3Å; M142-Y144 PolarHBondContact O-N 3.46Å; Y144-A147 PolarHBondContact O-N 3.49Å; Y144-G148 PolarHBondContact O-N 2.94Å; Y144-L192 HydrophobicContact CD1-CD2 4.35Å; Y144-L199 HydrophobicContact CD2-CD2 4.49Å
145	A	95.6	Very high	92.9	Very high	15 Å²	15	38.6 Å²	38.6	12%	0.124	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-44	175.1	0	0	0	0	0	111.6	S141 M142 G148 L149 F193	S141-A145 PolarHBondContact O-N 2.92Å; S141-A145 VanDerWaalsContact O-N 3.09Å; M142-A145 PolarHBondContact O-N 3.43Å; M142-A145 VanDerWaalsContact O-N 3.17Å; A145-G148 PolarHBondContact O-N 3.05Å; A145-L149 WeakPolarHBondContact O-CG 3.45Å; A145-L149 PolarHBondContact O-N 3.29Å; A145-F193 HydrophobicContact CB-CD2 4.43Å
146	F	95.4	Very high	93.3	Very high	110 Å²	110	35.8 Å²	35.8	48%	0.482	18%	0.182	S	C	.	.	H	α-helix	trans	-64.2	-41.6	175	-74.7	-61.1	0	0	0	112.4	F117 M142 F143 G148 L149 C150	F117-F146 HydrophobicContact CD2-CB 4.19Å; F117-F146 HydrophobicContact CE2-CB 4.33Å; F117-F146 HydrophobicContact CG-CB 4.49Å; M142-F146 HydrophobicContact CB-CD2 4.47Å; M142-F146 HydrophobicContact CB-CE2 4.36Å; M142-F146 WeakPolarHBondContact O-CD2 3.3Å; M142-F146 PolarHBondContact O-N 3.44Å; F143-F146 PolarHBondContact O-N 2.83Å; F146-G148 VanDerWaalsContact C-N 3.32Å; F146-G148 PolarHBondContact O-N 2.95Å; F146-L149 HydrophobicContact CD1-CD1 4.47Å; F146-L149 PolarHBondContact O-N 3.08Å; F146-C150 PolarHBondContact O-N 2.96Å; F146-C150 PolarHBondContact O-SG 3.44Å; F146-C150 VanDerWaalsContact O-SG 3.33Å
147	A	96.3	Very high	93.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56.7	-46.6	173.1	0	0	0	0	0	111.4	S114 F117 V118 F143 Y144 L149 C150 I151	S114-A147 PolarHBondContact OG-O 3.3Å; S114-A147 VanDerWaalsContact OG-O 3.12Å; F117-A147 HydrophobicContact CB-CB 3.93Å; V118-A147 HydrophobicContact CG2-CB 3.71Å; F143-A147 WeakPolarHBondContact O-CB 3.35Å; F143-A147 PolarHBondContact O-N 2.94Å; Y144-A147 PolarHBondContact O-N 3.49Å; A147-L149 PolarHBondContact O-N 2.84Å; A147-C150 PolarHBondContact O-N 2.97Å; A147-I151 WeakPolarHBondContact O-CG1 3.47Å; A147-I151 PolarHBondContact O-N 2.96Å
148	G	95.4	Very high	93.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-55.5	-50.3	174.3	0	0	0	0	0	112.2	Y144 A145 F146 C150 I151 L152 F189	Y144-G148 PolarHBondContact O-N 2.94Å; A145-G148 PolarHBondContact O-N 3.05Å; F146-G148 VanDerWaalsContact C-N 3.32Å; F146-G148 PolarHBondContact O-N 2.95Å; G148-C150 VanDerWaalsContact C-N 3.33Å; G148-C150 PolarHBondContact O-N 2.91Å; G148-I151 WeakPolarHBondContact O-CB 3.36Å; G148-I151 PolarHBondContact O-N 2.88Å; G148-I151 VanDerWaalsContact O-N 3.14Å; G148-L152 PolarHBondContact O-N 3.09Å; G148-F189 VanDerWaalsContact O-CD2 3.27Å; G148-F189 WeakPolarHBondContact O-CD2 3.44Å
149	L	95.9	Very high	92.8	Very high	68 Å²	68	38.1 Å²	38.1	36%	0.356	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-40.3	178	-69.2	173.5	0	0	0	112.5	A145 F146 A147 I151 L152 V153 F189 F193	A145-L149 WeakPolarHBondContact O-CG 3.45Å; A145-L149 PolarHBondContact O-N 3.29Å; F146-L149 HydrophobicContact CD1-CD1 4.47Å; F146-L149 PolarHBondContact O-N 3.08Å; A147-L149 PolarHBondContact O-N 2.84Å; L149-I151 VanDerWaalsContact C-N 3.34Å; L149-I151 PolarHBondContact O-N 3.48Å; L149-L152 WeakPolarHBondContact O-CB 3.5Å; L149-L152 PolarHBondContact O-N 2.63Å; L149-V153 WeakPolarHBondContact O-CG2 3.37Å; L149-V153 PolarHBondContact O-N 3.48Å; L149-F189 HydrophobicContact CD2-CE2 4.45Å; L149-F193 HydrophobicContact CD1-CE2 4.18Å; L149-F193 HydrophobicContact CD2-CD2 4Å; L149-F193 HydrophobicContact CD2-CE2 3.75Å; L149-F193 HydrophobicContact CD2-CZ 4.48Å; L149-F193 HydrophobicContact CG-CD2 3.95Å; L149-F193 HydrophobicContact CG-CE2 3.9Å
150	C	94.7	Very high	92.4	Very high	26 Å²	26	40.2 Å²	40.2	18%	0.176	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-41	175	-69.5	0	0	0	0	111.8	I110 F146 A147 G148 L152 V153 S154	I110-C150 HydrophobicContact CG2-CB 3.98Å; I110-C150 WeakPolarHBondContact CG2-O 3.11Å; F146-C150 PolarHBondContact O-N 2.96Å; F146-C150 PolarHBondContact O-SG 3.44Å; F146-C150 VanDerWaalsContact O-SG 3.33Å; A147-C150 PolarHBondContact O-N 2.97Å; G148-C150 VanDerWaalsContact C-N 3.33Å; G148-C150 PolarHBondContact O-N 2.91Å; C150-L152 VanDerWaalsContact C-N 3.33Å; C150-L152 PolarHBondContact O-N 3.11Å; C150-V153 PolarHBondContact O-N 3.26Å; C150-S154 PolarHBondContact O-N 3.44Å
151	I	93.4	Very high	91.6	Very high	7 Å²	7	40.9 Å²	40.9	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-43.4	174	-65.3	176.8	0	0	0	110.8	A23 S114 A147 G148 L149 V153 S154 V155 A185 A188 F189 L192	A23-I151 HydrophobicContact CB-CD1 3.5Å; S114-I151 VanDerWaalsContact OG-CG1 3.27Å; S114-I151 WeakPolarHBondContact OG-CG1 3.33Å; A147-I151 WeakPolarHBondContact O-CG1 3.47Å; A147-I151 PolarHBondContact O-N 2.96Å; G148-I151 WeakPolarHBondContact O-CB 3.36Å; G148-I151 PolarHBondContact O-N 2.88Å; G148-I151 VanDerWaalsContact O-N 3.14Å; L149-I151 VanDerWaalsContact C-N 3.34Å; L149-I151 PolarHBondContact O-N 3.48Å; I151-V153 PolarHBondContact O-N 3.09Å; I151-S154 WeakPolarHBondContact O-CB 3.48Å; I151-S154 PolarHBondContact O-N 3.46Å; I151-V155 HydrophobicContact CG2-CG2 4.28Å; I151-V155 VanDerWaalsContact O-CG2 3.29Å; I151-V155 WeakPolarHBondContact O-CG2 3.24Å; I151-V155 PolarHBondContact O-N 3.35Å; I151-A185 HydrophobicContact CG2-CB 4.23Å; I151-A188 HydrophobicContact CD1-CB 4.39Å; I151-F189 HydrophobicContact CG2-CB 4.4Å; I151-L192 HydrophobicContact CD1-CD1 3.77Å
152	L	94.4	Very high	90.7	Very high	61 Å²	61	41 Å²	41	32%	0.319	20%	0.202	S	C	.	.	H	α-helix	trans	-58.2	-47.1	176.3	-174.3	95.2	0	0	0	111.4	G148 L149 C150 S154 V155 E156 F189	G148-L152 PolarHBondContact O-N 3.09Å; L149-L152 WeakPolarHBondContact O-CB 3.5Å; L149-L152 PolarHBondContact O-N 2.63Å; C150-L152 VanDerWaalsContact C-N 3.33Å; C150-L152 PolarHBondContact O-N 3.11Å; L152-S154 VanDerWaalsContact C-N 3.32Å; L152-S154 PolarHBondContact O-N 2.62Å; L152-V155 WeakPolarHBondContact O-CB 3.25Å; L152-V155 PolarHBondContact O-N 3.34Å; L152-E156 PolarHBondContact O-N 3.32Å; L152-F189 HydrophobicContact CB-CD2 3.87Å; L152-F189 HydrophobicContact CB-CE2 4.02Å; L152-F189 HydrophobicContact CB-CG 4.27Å; L152-F189 HydrophobicContact CD1-CD1 3.76Å; L152-F189 HydrophobicContact CD1-CD2 4.17Å; L152-F189 HydrophobicContact CD1-CE1 3.62Å; L152-F189 HydrophobicContact CD1-CE2 4.03Å; L152-F189 HydrophobicContact CD1-CG 4.04Å; L152-F189 HydrophobicContact CD1-CZ 3.75Å; L152-F189 HydrophobicContact CG-CE2 4.44Å
153	V	93.6	Very high	90	Very high	69 Å²	69	43.7 Å²	43.7	42%	0.418	21%	0.212	S	C	.	.	H	α-helix	trans	-62.6	-41.6	177.8	-178.2	0	0	0	0	110.6	I110 L149 C150 I151 V155 E156 V157	I110-V153 HydrophobicContact CD1-CG1 3.74Å; I110-V153 HydrophobicContact CG2-CB 4.3Å; L149-V153 WeakPolarHBondContact O-CG2 3.37Å; L149-V153 PolarHBondContact O-N 3.48Å; C150-V153 PolarHBondContact O-N 3.26Å; I151-V153 PolarHBondContact O-N 3.09Å; V153-V155 VanDerWaalsContact C-N 3.32Å; V153-V155 PolarHBondContact O-N 3.29Å; V153-E156 PolarHBondContact O-N 2.8Å; V153-V157 HydrophobicContact CG1-CG2 4.22Å; V153-V157 WeakPolarHBondContact O-CB 3.38Å; V153-V157 VanDerWaalsContact O-CG2 3.25Å; V153-V157 WeakPolarHBondContact O-CG2 3.44Å; V153-V157 PolarHBondContact O-N 2.97Å
154	S	91.1	Very high	88.8	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-42.7	175.2	-171.1	0	0	0	0	111.8	A107 C150 I151 L152 V157 M158	A107-S154 PolarHBondContact O-OG 3.05Å; C150-S154 PolarHBondContact O-N 3.44Å; I151-S154 WeakPolarHBondContact O-CB 3.48Å; I151-S154 PolarHBondContact O-N 3.46Å; L152-S154 VanDerWaalsContact C-N 3.32Å; L152-S154 PolarHBondContact O-N 2.62Å; S154-V157 PolarHBondContact O-N 2.88Å; S154-M158 WeakPolarHBondContact O-CB 3.38Å; S154-M158 PolarHBondContact O-N 3.43Å
155	V	90.2	Very high	87.4	Confident	6 Å²	6	47.1 Å²	47.1	4%	0.036	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-44.9	175.1	169.7	0	0	0	0	111.7	W32 I151 L152 V153 M158 R159 F182 A185	W32-V155 HydrophobicContact CH2-CG2 4.23Å; W32-V155 HydrophobicContact CZ3-CG2 3.78Å; I151-V155 HydrophobicContact CG2-CG2 4.28Å; I151-V155 VanDerWaalsContact O-CG2 3.29Å; I151-V155 WeakPolarHBondContact O-CG2 3.24Å; I151-V155 PolarHBondContact O-N 3.35Å; L152-V155 WeakPolarHBondContact O-CB 3.25Å; L152-V155 PolarHBondContact O-N 3.34Å; V153-V155 VanDerWaalsContact C-N 3.32Å; V153-V155 PolarHBondContact O-N 3.29Å; V155-M158 PolarHBondContact O-N 3.2Å; V155-R159 WeakPolarHBondContact O-CB 3.09Å; V155-R159 PolarHBondContact O-N 3.47Å; V155-F182 HydrophobicContact CG1-CD2 4.27Å; V155-F182 HydrophobicContact CG1-CE2 3.49Å; V155-F182 VanDerWaalsContact CG1-CE2 3.49Å; V155-F182 HydrophobicContact CG1-CZ 3.82Å; V155-A185 HydrophobicContact CG2-CB 3.72Å
156	E	90.8	Very high	86	Confident	77 Å²	77	48.9 Å²	48.9	36%	0.36	23%	0.231	S	C	.	.	H	α-helix	trans	-69.2	-39.2	179.1	-70.8	-61.1	161.7	0	0	112.5	L152 V153 M158 R159 Q160	L152-E156 PolarHBondContact O-N 3.32Å; V153-E156 PolarHBondContact O-N 2.8Å; E156-M158 VanDerWaalsContact C-N 3.29Å; E156-M158 PolarHBondContact O-N 3.05Å; E156-R159 PolarHBondContact O-N 3.17Å; E156-R159 IonicContact OE2-NH1 3.9Å; E156-Q160 WeakPolarHBondContact O-CB 3.28Å; E156-Q160 WeakPolarHBondContact O-CG 3.34Å; E156-Q160 PolarHBondContact O-N 3.14Å
157	V	88.2	Confident	84.6	Confident	22 Å²	22	50.3 Å²	50.3	13%	0.133	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-42.2	173.6	173.8	0	0	0	0	110.1	Y103 A107 I110 V153 S154 Q160 S161	Y103-V157 HydrophobicContact CD1-CG1 4.28Å; Y103-V157 WeakPolarHBondContact O-CG1 3.36Å; A107-V157 HydrophobicContact CB-CB 4.22Å; A107-V157 HydrophobicContact CB-CG1 3.84Å; I110-V157 HydrophobicContact CD1-CG2 4.28Å; V153-V157 HydrophobicContact CG1-CG2 4.22Å; V153-V157 WeakPolarHBondContact O-CB 3.38Å; V153-V157 VanDerWaalsContact O-CG2 3.25Å; V153-V157 WeakPolarHBondContact O-CG2 3.44Å; V153-V157 PolarHBondContact O-N 2.97Å; S154-V157 PolarHBondContact O-N 2.88Å; V157-Q160 PolarHBondContact O-N 3.16Å; V157-S161 PolarHBondContact O-N 3.48Å
158	M	82.4	Confident	82.8	Confident	11 Å²	11	52 Å²	52	5%	0.054	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-37.7	175.7	-170.4	60.4	-176.1	0	0	112.2	W32 F51 S154 V155 E156 S161 V162	W32-M158 HydrophobicContact CB-CE 4.32Å; W32-M158 HydrophobicContact CE3-CB 4.42Å; W32-M158 HydrophobicContact CE3-CG 4.06Å; F51-M158 HydrophobicContact CB-CE 3.59Å; F51-M158 HydrophobicContact CD1-CE 4.42Å; F51-M158 HydrophobicContact CG-CE 4.33Å; S154-M158 WeakPolarHBondContact O-CB 3.38Å; S154-M158 PolarHBondContact O-N 3.43Å; V155-M158 PolarHBondContact O-N 3.2Å; E156-M158 VanDerWaalsContact C-N 3.29Å; E156-M158 PolarHBondContact O-N 3.05Å; M158-S161 WeakPolarHBondContact CA-OG 3.38Å; M158-S161 PolarHBondContact O-N 3.35Å; M158-S161 PolarHBondContact O-OG 2.96Å; M158-V162 HydrophobicContact CE-CG2 4.25Å; M158-V162 WeakPolarHBondContact O-CG2 3.08Å; M158-V162 PolarHBondContact O-N 3.24Å; M158-V162 VanDerWaalsContact O-N 3.14Å
159	R	84.1	Confident	80.7	Confident	118 Å²	118	61.6 Å²	61.6	45%	0.445	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-42.7	174.8	178.9	168.9	-173.3	-130.7	2.6	111.6	V155 E156 K163 Y178	V155-R159 WeakPolarHBondContact O-CB 3.09Å; V155-R159 PolarHBondContact O-N 3.47Å; E156-R159 PolarHBondContact O-N 3.17Å; E156-R159 IonicContact OE2-NH1 3.9Å; R159-K163 WeakPolarHBondContact O-CB 3.29Å; R159-K163 PolarHBondContact O-N 3.46Å; R159-Y178 WeakPolarHBondContact CG-OH 3.33Å
160	Q	83.6	Confident	78.5	Confident	89 Å²	89	64.6 Å²	64.6	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-68	-35.9	176.9	-72.8	-174.9	14.7	0	0	112.5	E156 V157 K163 R164	E156-Q160 WeakPolarHBondContact O-CB 3.28Å; E156-Q160 WeakPolarHBondContact O-CG 3.34Å; E156-Q160 PolarHBondContact O-N 3.14Å; V157-Q160 PolarHBondContact O-N 3.16Å; Q160-K163 PolarHBondContact O-N 2.99Å; Q160-R164 WeakPolarHBondContact O-CB 2.82Å; Q160-R164 WeakPolarHBondContact O-CG 3.47Å; Q160-R164 PolarHBondContact O-N 2.81Å
161	S	77.9	Confident	76.3	Confident	14 Å²	14	64.2 Å²	64.2	10%	0.098	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-44	177.1	70.3	0	0	0	0	111.4	V157 M158 M165	V157-S161 PolarHBondContact O-N 3.48Å; M158-S161 WeakPolarHBondContact CA-OG 3.38Å; M158-S161 PolarHBondContact O-N 3.35Å; M158-S161 PolarHBondContact O-OG 2.96Å; S161-M165 WeakPolarHBondContact O-CB 2.98Å; S161-M165 PolarHBondContact O-N 3.41Å; S161-M165 VanDerWaalsContact O-N 3.16Å
162	V	75.3	Confident	74.4	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.024	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-42.2	175.2	176.6	0	0	0	0	111.2	A33 L35 M158 R164 M165 I166 Y176	A33-V162 HydrophobicContact CB-CG2 4.14Å; L35-V162 HydrophobicContact CD1-CG1 4.38Å; M158-V162 HydrophobicContact CE-CG2 4.25Å; M158-V162 WeakPolarHBondContact O-CG2 3.08Å; M158-V162 PolarHBondContact O-N 3.24Å; M158-V162 VanDerWaalsContact O-N 3.14Å; V162-R164 PolarHBondContact O-N 3.03Å; V162-M165 VanDerWaalsContact O-CB 3.31Å; V162-M165 WeakPolarHBondContact O-CB 3.23Å; V162-M165 PolarHBondContact O-N 3.48Å; V162-I166 PolarHBondContact O-N 3.47Å; V162-Y176 HydrophobicContact CG1-CD2 4.31Å; V162-Y176 HydrophobicContact CG1-CG 4.26Å
163	K	78.6	Confident	72.6	Confident	153 Å²	153	66 Å²	66	67%	0.665	32%	0.323	S	S	*	.	H	α-helix	trans	-65.3	-38	179.5	-173.3	171.9	-179.8	177.4	0	113	R159 Q160 M165 I166 D167	R159-K163 WeakPolarHBondContact O-CB 3.29Å; R159-K163 PolarHBondContact O-N 3.46Å; Q160-K163 PolarHBondContact O-N 2.99Å; K163-M165 VanDerWaalsContact C-N 3.28Å; K163-I166 VanDerWaalsContact O-CG2 3.3Å; K163-I166 WeakPolarHBondContact O-CG2 3.3Å; K163-D167 PolarHBondContact O-N 3.2Å
164	R	71.1	Confident	70.8	Confident	121 Å²	121	67.9 Å²	67.9	46%	0.457	33%	0.329	S	S	.	.	H	α-helix	trans	-71	-26.9	174.7	-75.3	-171.8	175.9	98.9	-1.6	112.7	Y103 Q160 V162 S168	Y103-R164 VanDerWaalsContact CZ-NH1 3.27Å; Y103-R164 PolarHBondContact OH-NH1 2.96Å; Q160-R164 WeakPolarHBondContact O-CB 2.82Å; Q160-R164 WeakPolarHBondContact O-CG 3.47Å; Q160-R164 PolarHBondContact O-N 2.81Å; V162-R164 PolarHBondContact O-N 3.03Å; R164-S168 PolarHBondContact O-N 3.21Å
165	M	66.5	Low	69.5	Low	17 Å²	17	72.8 Å²	72.8	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-66.3	-45.2	176.4	-168.2	-176.8	-46.1	0	0	111.4	L35 F51 S161 V162 K163 D167 S168 T171	L35-M165 HydrophobicContact CD2-CE 4.43Å; L35-M165 HydrophobicContact CD2-CG 4.35Å; L35-M165 HydrophobicContact CD2-SD 3.22Å; L35-M165 WeakPolarHBondContact CD2-SD 3.3Å; F51-M165 HydrophobicContact CD1-CE 4.36Å; F51-M165 HydrophobicContact CE1-CE 3.51Å; F51-M165 HydrophobicContact CE1-SD 4.24Å; F51-M165 HydrophobicContact CE2-CE 4.33Å; F51-M165 HydrophobicContact CE2-SD 4.21Å; F51-M165 HydrophobicContact CZ-CE 3.48Å; F51-M165 VanDerWaalsContact CZ-CE 3.48Å; F51-M165 HydrophobicContact CZ-SD 3.58Å; F51-M165 VanDerWaalsContact CZ-SD 3.58Å; S161-M165 WeakPolarHBondContact O-CB 2.98Å; S161-M165 PolarHBondContact O-N 3.41Å; S161-M165 VanDerWaalsContact O-N 3.16Å; V162-M165 VanDerWaalsContact O-CB 3.31Å; V162-M165 WeakPolarHBondContact O-CB 3.23Å; V162-M165 PolarHBondContact O-N 3.48Å; K163-M165 VanDerWaalsContact C-N 3.28Å; M165-D167 VanDerWaalsContact C-N 3.29Å; M165-D167 PolarHBondContact O-N 3.21Å; M165-S168 PolarHBondContact O-N 3.47Å; M165-T171 PolarHBondContact O-OG1 2.9Å; M165-T171 VanDerWaalsContact O-OG1 3.05Å
166	I	66.5	Low	68.5	Low	52 Å²	52	77.2 Å²	77.2	27%	0.267	37%	0.369	S	S	.	.	H	α-helix	trans	-70.7	-26.6	-179.1	-154.4	114	0	0	0	113.2	V162 K163 S168 W173 Y176	V162-I166 PolarHBondContact O-N 3.47Å; K163-I166 VanDerWaalsContact O-CG2 3.3Å; K163-I166 WeakPolarHBondContact O-CG2 3.3Å; I166-S168 VanDerWaalsContact C-N 3.29Å; I166-W173 WeakPolarHBondContact CD1-O 3.32Å; I166-W173 WeakPolarHBondContact CG1-O 3.48Å; I166-Y176 HydrophobicContact CD1-CD1 4.22Å
167	D	65.7	Low	68	Low	140 Å²	140	79.9 Å²	79.9	75%	0.749	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.4	-179.6	-156.1	46.5	0	0	0	112.5	K163 M165 E169	K163-D167 PolarHBondContact O-N 3.2Å; M165-D167 VanDerWaalsContact C-N 3.29Å; M165-D167 PolarHBondContact O-N 3.21Å; D167-E169 PolarHBondContact O-N 3.48Å
168	S	60	Low	67.7	Low	36 Å²	36	82.9 Å²	82.9	25%	0.252	39%	0.386	S	S	.	.			trans	-81.4	115.8	179.1	-163.9	0	0	0	0	110.2	R164 M165 I166 D170 T171	R164-S168 PolarHBondContact O-N 3.21Å; M165-S168 PolarHBondContact O-N 3.47Å; I166-S168 VanDerWaalsContact C-N 3.29Å; S168-D170 PolarHBondContact O-N 3.45Å; S168-T171 PolarHBondContact O-N 2.96Å; S168-T171 VanDerWaalsContact O-N 3.1Å
169	E	50.3	Low	67.7	Low	201 Å²	201	83.4 Å²	83.4	94%	0.939	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19	-177.3	-75.5	180	150.6	0	0	114.5	D167	D167-E169 PolarHBondContact O-N 3.48Å
170	D	50	Low	67.9	Low	130 Å²	130	84.1 Å²	84.1	70%	0.695	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.7	-180	-66.8	-42.7	0	0	0	114.5	F97 S168	F97-D170 HydrophobicContact CE1-CB 4.19Å; F97-D170 HydrophobicContact CZ-CB 3.62Å; S168-D170 PolarHBondContact O-N 3.45Å
171	T	49.6	Very low	68.2	Low	19 Å²	19	79.9 Å²	79.9	12%	0.117	37%	0.374	C	S	.	.			trans	-117.6	126.1	-175.4	84.6	0	0	0	0	112.7	F95 F97 M165 S168 W173	F95-T171 HydrophobicContact CE1-CG2 4.31Å; F95-T171 HydrophobicContact CZ-CG2 4.29Å; F97-T171 HydrophobicContact CE2-CG2 3.91Å; F97-T171 HydrophobicContact CZ-CG2 4.2Å; M165-T171 PolarHBondContact O-OG1 2.9Å; M165-T171 VanDerWaalsContact O-OG1 3.05Å; S168-T171 PolarHBondContact O-N 2.96Å; S168-T171 VanDerWaalsContact O-N 3.1Å; T171-W173 PolarHBondContact O-N 3.33Å
172	V	52.8	Low	68.7	Low	69 Å²	69	80.9 Å²	80.9	42%	0.418	38%	0.376	S	S	.	.			trans	-73.7	8.9	-174.6	-171.7	0	0	0	0	112.2	P37 H38	P37-V172 CarbonylContact C-O 3.56Å; H38-V172 HydrophobicContact CB-CG1 3.6Å; H38-V172 WeakPolarHBondContact CB-O 3.5Å; H38-V172 PolarHBondContact N-O 3.34Å; H38-V172 VanDerWaalsContact O-CG1 3.22Å; H38-V172 WeakPolarHBondContact O-CG1 3.06Å
173	W	56.3	Low	69.5	Low	36 Å²	36	83.5 Å²	83.5	14%	0.136	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120.5	-172.9	-46.2	92.2	0	0	0	111.6	L35 S36 P37 A49 F95 I166 T171	L35-W173 HydrophobicContact CB-CD2 4.27Å; L35-W173 HydrophobicContact CB-CE3 3.71Å; L35-W173 HydrophobicContact CB-CZ3 4.29Å; L35-W173 HydrophobicContact CD2-CB 4.23Å; L35-W173 HydrophobicContact CD2-CG 4.24Å; S36-W173 VanDerWaalsContact C-CE3 3.43Å; P37-W173 HydrophobicContact CB-CD2 3.96Å; P37-W173 HydrophobicContact CB-CE3 3.6Å; P37-W173 HydrophobicContact CB-CH2 4.06Å; P37-W173 HydrophobicContact CB-CZ2 4.39Å; P37-W173 HydrophobicContact CB-CZ3 3.69Å; P37-W173 HydrophobicContact CG-CE3 3.9Å; P37-W173 HydrophobicContact CG-CH2 3.89Å; P37-W173 HydrophobicContact CG-CZ3 3.5Å; A49-W173 HydrophobicContact CB-CH2 4.28Å; A49-W173 HydrophobicContact CB-CZ3 4.24Å; F95-W173 AromaticContact CZ-NE1 3.94Å; I166-W173 WeakPolarHBondContact CD1-O 3.32Å; I166-W173 WeakPolarHBondContact CG1-O 3.48Å; T171-W173 PolarHBondContact O-N 3.33Å
174	I	55.7	Low	70.2	Confident	109 Å²	109	77.5 Å²	77.5	56%	0.559	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	-28.2	-174.5	-61.9	178.8	0	0	0	112.4	H38	H38-I174 HydrophobicContact CB-CD1 3.82Å; H38-I174 HydrophobicContact CB-CG1 4.37Å; H38-I174 WeakPolarHBondContact CD2-CD1 3.36Å
175	E	64	Low	71.2	Confident	104 Å²	104	71.7 Å²	71.7	49%	0.486	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.7	179	-69.5	-171.1	-173.7	0	0	111.7	S36 Y177	S36-E175 PolarHBondContact N-O 3.03Å; S36-E175 VanDerWaalsContact N-O 3.08Å; E175-Y177 HydrophobicContact CB-CE2 3.88Å; E175-Y177 WeakPolarHBondContact OE2-CE2 3.15Å; E175-Y177 PolarHBondContact OE2-OH 3.37Å
176	Y	70.2	Confident	72.5	Confident	99 Å²	99	73.1 Å²	73.1	39%	0.388	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.7	171.4	77	-88.1	0	0	0	110.4	V34 V162 I166 Y178	V34-Y176 WeakPolarHBondContact O-CA 3.46Å; V162-Y176 HydrophobicContact CG1-CD2 4.31Å; V162-Y176 HydrophobicContact CG1-CG 4.26Å; I166-Y176 HydrophobicContact CD1-CD1 4.22Å; Y176-Y178 HydrophobicContact CD2-CE2 4.45Å; Y176-Y178 HydrophobicContact CE2-CD2 4.35Å; Y176-Y178 HydrophobicContact CE2-CE1 4.38Å; Y176-Y178 AromaticContact CE2-CE2 3.69Å; Y176-Y178 HydrophobicContact CE2-CE2 3.69Å; Y176-Y178 AromaticContact CE2-CZ 3.69Å
177	Y	78.6	Confident	73.9	Confident	134 Å²	134	72.6 Å²	72.6	53%	0.525	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.3	175.4	-63.9	-88.5	0	0	0	109.5	A33 V34 E175 S179	A33-Y177 CarbonylContact C-O 3.6Å; A33-Y177 WeakPolarHBondContact CA-O 3.31Å; V34-Y177 PolarHBondContact N-O 3.37Å; V34-Y177 PolarHBondContact O-N 3.48Å; E175-Y177 HydrophobicContact CB-CE2 3.88Å; E175-Y177 WeakPolarHBondContact OE2-CE2 3.15Å; E175-Y177 PolarHBondContact OE2-OH 3.37Å; Y177-S179 PolarHBondContact O-N 3.03Å
178	Y	81.6	Confident	75.3	Confident	84 Å²	84	65.9 Å²	65.9	33%	0.329	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	132.3	170	-65.9	-62.8	0	0	0	109.7	R159 Y176 F182	R159-Y178 WeakPolarHBondContact CG-OH 3.33Å; Y176-Y178 HydrophobicContact CD2-CE2 4.45Å; Y176-Y178 HydrophobicContact CE2-CD2 4.35Å; Y176-Y178 HydrophobicContact CE2-CE1 4.38Å; Y176-Y178 AromaticContact CE2-CE2 3.69Å; Y176-Y178 HydrophobicContact CE2-CE2 3.69Å; Y176-Y178 AromaticContact CE2-CZ 3.69Å; Y178-F182 HydrophobicContact CD1-CB 4.38Å; Y178-F182 HydrophobicContact CD1-CD1 4.14Å; Y178-F182 AromaticContact CD1-CD2 3.69Å; Y178-F182 HydrophobicContact CD1-CD2 3.69Å; Y178-F182 HydrophobicContact CD1-CE1 4.36Å; Y178-F182 AromaticContact CD1-CE2 3.91Å; Y178-F182 HydrophobicContact CD1-CE2 3.91Å; Y178-F182 AromaticContact CD1-CG 3.81Å; Y178-F182 HydrophobicContact CD1-CG 3.81Å; Y178-F182 HydrophobicContact CD1-CZ 4.26Å; Y178-F182 HydrophobicContact CD2-CE1 4.44Å; Y178-F182 HydrophobicContact CE1-CD2 4.03Å; Y178-F182 AromaticContact CE1-CE2 3.82Å; Y178-F182 HydrophobicContact CE1-CE2 3.82Å; Y178-F182 HydrophobicContact CE1-CZ 4.19Å; Y178-F182 HydrophobicContact CG-CD1 4.02Å; Y178-F182 HydrophobicContact CG-CD2 4.39Å; Y178-F182 HydrophobicContact CG-CE1 4.25Å; Y178-F182 HydrophobicContact CG-CG 4.1Å
179	S	83.6	Confident	77	Confident	23 Å²	23	66.1 Å²	66.1	16%	0.161	33%	0.329	C	S	.	.			trans	-96.1	177.3	178.8	-87.2	0	0	0	0	111.7	H31 W32 V34 Y177 S181 F182	H31-S179 VanDerWaalsContact C-CB 3.46Å; H31-S179 CarbonylContact O-C 3.43Å; H31-S179 WeakPolarHBondContact O-CB 3.31Å; W32-S179 PolarHBondContact O-N 3.25Å; V34-S179 WeakPolarHBondContact CG2-OG 3.23Å; Y177-S179 PolarHBondContact O-N 3.03Å; S179-S181 VanDerWaalsContact C-N 3.26Å; S179-S181 PolarHBondContact O-N 3.12Å; S179-F182 WeakPolarHBondContact O-CB 3.31Å; S179-F182 PolarHBondContact O-N 2.73Å; S179-F182 VanDerWaalsContact O-N 3.13Å
180	W	87.8	Confident	79.2	Confident	132 Å²	132	59.9 Å²	59.9	50%	0.5	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-26.5	-173.5	57.8	-91.7	0	0	0	114.3	T29 H31 F182 A183 C184	T29-W180 HydrophobicContact CG2-CH2 3.29Å; T29-W180 HydrophobicContact CG2-CZ2 4.17Å; T29-W180 HydrophobicContact CG2-CZ3 3.86Å; H31-W180 HydrophobicContact CB-CD2 4.39Å; H31-W180 HydrophobicContact CB-CZ2 4.05Å; H31-W180 AromaticContact CD2-CE2 3.9Å; H31-W180 AromaticContact CD2-CZ2 3.59Å; H31-W180 AromaticContact CD2-NE1 3.75Å; H31-W180 AromaticContact CG-CE2 3.94Å; H31-W180 AromaticContact CG-NE1 3.5Å; W180-F182 VanDerWaalsContact C-N 3.3Å; W180-F182 PolarHBondContact O-N 2.75Å; W180-A183 PolarHBondContact O-N 3.12Å; W180-C184 PolarHBondContact O-N 3.38Å; W180-C184 PolarHBondContact O-SG 2.83Å
181	S	89.4	Confident	81.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.5	-33.6	176.7	-50.9	0	0	0	0	111.8	T29 H31 S179 C184 A185	T29-S181 WeakPolarHBondContact CB-OG 3.49Å; T29-S181 VanDerWaalsContact OG1-CB 3.29Å; T29-S181 WeakPolarHBondContact OG1-CB 3.5Å; T29-S181 PolarHBondContact OG1-OG 3.01Å; H31-S181 WeakPolarHBondContact CB-OG 3.4Å; H31-S181 WeakPolarHBondContact O-CB 3.39Å; H31-S181 PolarHBondContact O-N 2.91Å; H31-S181 VanDerWaalsContact O-N 3.11Å; H31-S181 PolarHBondContact O-OG 2.79Å; H31-S181 VanDerWaalsContact O-OG 3.09Å; S179-S181 VanDerWaalsContact C-N 3.26Å; S179-S181 PolarHBondContact O-N 3.12Å; S181-C184 PolarHBondContact O-N 3.25Å; S181-A185 WeakPolarHBondContact O-CB 3.48Å; S181-A185 PolarHBondContact O-N 2.04Å
182	F	89.4	Confident	83.6	Confident	35 Å²	35	55.4 Å²	55.4	15%	0.154	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-46.9	174.4	-177.3	-89.6	0	0	0	110.9	W32 V155 Y178 S179 W180 C184 A185 C186	W32-F182 HydrophobicContact CE3-CD2 4.41Å; V155-F182 HydrophobicContact CG1-CD2 4.27Å; V155-F182 HydrophobicContact CG1-CE2 3.49Å; V155-F182 VanDerWaalsContact CG1-CE2 3.49Å; V155-F182 HydrophobicContact CG1-CZ 3.82Å; Y178-F182 HydrophobicContact CD1-CB 4.38Å; Y178-F182 HydrophobicContact CD1-CD1 4.14Å; Y178-F182 AromaticContact CD1-CD2 3.69Å; Y178-F182 HydrophobicContact CD1-CD2 3.69Å; Y178-F182 HydrophobicContact CD1-CE1 4.36Å; Y178-F182 AromaticContact CD1-CE2 3.91Å; Y178-F182 HydrophobicContact CD1-CE2 3.91Å; Y178-F182 AromaticContact CD1-CG 3.81Å; Y178-F182 HydrophobicContact CD1-CG 3.81Å; Y178-F182 HydrophobicContact CD1-CZ 4.26Å; Y178-F182 HydrophobicContact CD2-CE1 4.44Å; Y178-F182 HydrophobicContact CE1-CD2 4.03Å; Y178-F182 AromaticContact CE1-CE2 3.82Å; Y178-F182 HydrophobicContact CE1-CE2 3.82Å; Y178-F182 HydrophobicContact CE1-CZ 4.19Å; Y178-F182 HydrophobicContact CG-CD1 4.02Å; Y178-F182 HydrophobicContact CG-CD2 4.39Å; Y178-F182 HydrophobicContact CG-CE1 4.25Å; Y178-F182 HydrophobicContact CG-CG 4.1Å; S179-F182 WeakPolarHBondContact O-CB 3.31Å; S179-F182 PolarHBondContact O-N 2.73Å; S179-F182 VanDerWaalsContact O-N 3.13Å; W180-F182 VanDerWaalsContact C-N 3.3Å; W180-F182 PolarHBondContact O-N 2.75Å; F182-C184 VanDerWaalsContact C-N 3.31Å; F182-C184 PolarHBondContact O-N 3.5Å; F182-A185 WeakPolarHBondContact O-CB 3.41Å; F182-A185 PolarHBondContact O-N 2.9Å; F182-C186 PolarHBondContact O-N 3.03Å; F182-C186 PolarHBondContact O-SG 2.9Å
183	A	92	Very high	85.7	Confident	59 Å²	59	54.8 Å²	54.8	49%	0.488	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.1	0	0	0	0	0	111.9	W180 C186 A187	W180-A183 PolarHBondContact O-N 3.12Å; A183-C186 PolarHBondContact O-N 3.5Å; A183-A187 WeakPolarHBondContact O-CB 3.27Å; A183-A187 PolarHBondContact O-N 3.44Å
184	C	92.9	Very high	87.5	Confident	27 Å²	27	57.8 Å²	57.8	18%	0.182	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-42	173.8	-72.3	0	0	0	0	112.2	L22 A26 W180 S181 F182 A187 A188	L22-C184 HydrophobicContact CD2-CB 4.44Å; A26-C184 HydrophobicContact CB-CB 4.25Å; W180-C184 PolarHBondContact O-N 3.38Å; W180-C184 PolarHBondContact O-SG 2.83Å; S181-C184 PolarHBondContact O-N 3.25Å; F182-C184 VanDerWaalsContact C-N 3.31Å; F182-C184 PolarHBondContact O-N 3.5Å; C184-A187 PolarHBondContact O-N 2.98Å; C184-A188 VanDerWaalsContact O-CB 3.25Å; C184-A188 WeakPolarHBondContact O-CB 3.39Å; C184-A188 PolarHBondContact O-N 3.1Å
185	A	92.8	Very high	89.4	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-44.4	176.7	0	0	0	0	0	111.8	A26 W32 I151 V155 S181 F182 A188 F189	A26-A185 HydrophobicContact CB-CB 3.88Å; W32-A185 HydrophobicContact CH2-CB 3.65Å; W32-A185 HydrophobicContact CZ2-CB 4.26Å; W32-A185 HydrophobicContact CZ3-CB 3.97Å; I151-A185 HydrophobicContact CG2-CB 4.23Å; V155-A185 HydrophobicContact CG2-CB 3.72Å; S181-A185 WeakPolarHBondContact O-CB 3.48Å; S181-A185 PolarHBondContact O-N 2.04Å; F182-A185 WeakPolarHBondContact O-CB 3.41Å; F182-A185 PolarHBondContact O-N 2.9Å; A185-A188 PolarHBondContact O-N 3.01Å; A185-F189 PolarHBondContact O-N 3.05Å
186	C	93.8	Very high	90.8	Very high	46 Å²	46	48.1 Å²	48.1	31%	0.311	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-43.6	175.4	-68.4	0	0	0	0	112	F182 A183 F189 V190	F182-C186 PolarHBondContact O-N 3.03Å; F182-C186 PolarHBondContact O-SG 2.9Å; A183-C186 PolarHBondContact O-N 3.5Å; C186-F189 WeakPolarHBondContact O-CB 3.17Å; C186-F189 PolarHBondContact O-N 2.72Å; C186-V190 WeakPolarHBondContact O-CG2 3.5Å; C186-V190 PolarHBondContact O-N 2.99Å; C186-V190 VanDerWaalsContact O-N 3.07Å
187	A	95.3	Very high	92	Very high	41 Å²	41	46.7 Å²	46.7	34%	0.339	24%	0.243	S	C	.	.	H	α-helix	trans	-63.5	-41.9	175.8	0	0	0	0	0	111.6	L22 A183 C184 V190 L191	L22-A187 HydrophobicContact CD1-CB 4.23Å; A183-A187 WeakPolarHBondContact O-CB 3.27Å; A183-A187 PolarHBondContact O-N 3.44Å; C184-A187 PolarHBondContact O-N 2.98Å; A187-V190 PolarHBondContact O-N 2.94Å; A187-L191 WeakPolarHBondContact O-CB 3.41Å; A187-L191 WeakPolarHBondContact O-CG 3.14Å; A187-L191 PolarHBondContact O-N 3.37Å
188	A	95.4	Very high	92.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-43.5	175.3	0	0	0	0	0	111.8	L22 A23 I151 C184 A185 V190 L191 L192	L22-A188 HydrophobicContact CB-CB 3.89Å; A23-A188 HydrophobicContact CB-CB 3.93Å; I151-A188 HydrophobicContact CD1-CB 4.39Å; C184-A188 VanDerWaalsContact O-CB 3.25Å; C184-A188 WeakPolarHBondContact O-CB 3.39Å; C184-A188 PolarHBondContact O-N 3.1Å; A185-A188 PolarHBondContact O-N 3.01Å; A188-V190 PolarHBondContact O-N 3.36Å; A188-L191 PolarHBondContact O-N 3.33Å; A188-L192 VanDerWaalsContact O-CB 3.29Å; A188-L192 WeakPolarHBondContact O-CB 2.96Å; A188-L192 VanDerWaalsContact O-CG 3.26Å; A188-L192 WeakPolarHBondContact O-CG 3.09Å; A188-L192 PolarHBondContact O-N 3.02Å
189	F	95.8	Very high	93.1	Very high	41 Å²	41	37.7 Å²	37.7	18%	0.18	21%	0.214	C	C	.	.	H	α-helix	trans	-54.8	-53.6	173.3	158	-111.4	0	0	0	111.1	G148 L149 I151 L152 A185 C186 L191 L192 F193	G148-F189 VanDerWaalsContact O-CD2 3.27Å; G148-F189 WeakPolarHBondContact O-CD2 3.44Å; L149-F189 HydrophobicContact CD2-CE2 4.45Å; I151-F189 HydrophobicContact CG2-CB 4.4Å; L152-F189 HydrophobicContact CB-CD2 3.87Å; L152-F189 HydrophobicContact CB-CE2 4.02Å; L152-F189 HydrophobicContact CB-CG 4.27Å; L152-F189 HydrophobicContact CD1-CD1 3.76Å; L152-F189 HydrophobicContact CD1-CD2 4.17Å; L152-F189 HydrophobicContact CD1-CE1 3.62Å; L152-F189 HydrophobicContact CD1-CE2 4.03Å; L152-F189 HydrophobicContact CD1-CG 4.04Å; L152-F189 HydrophobicContact CD1-CZ 3.75Å; L152-F189 HydrophobicContact CG-CE2 4.44Å; A185-F189 PolarHBondContact O-N 3.05Å; C186-F189 WeakPolarHBondContact O-CB 3.17Å; C186-F189 PolarHBondContact O-N 2.72Å; F189-L191 VanDerWaalsContact C-N 3.33Å; F189-L191 PolarHBondContact O-N 3.45Å; F189-L192 PolarHBondContact O-N 2.92Å; F189-F193 HydrophobicContact CD2-CB 4.05Å; F189-F193 HydrophobicContact CE2-CB 3.76Å; F189-F193 HydrophobicContact CE2-CD1 4.31Å; F189-F193 HydrophobicContact CE2-CD2 4.38Å; F189-F193 AromaticContact CE2-CG 3.9Å; F189-F193 HydrophobicContact CE2-CG 3.9Å; F189-F193 HydrophobicContact CZ-CB 4.39Å; F189-F193 HydrophobicContact CZ-CD1 4.31Å; F189-F193 HydrophobicContact CZ-CG 4.36Å; F189-F193 WeakPolarHBondContact O-CB 2.89Å; F189-F193 PolarHBondContact O-N 2.87Å
190	V	96.6	Very high	93.4	Very high	70 Å²	70	38.3 Å²	38.3	42%	0.424	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-45.4	-177.8	174.6	0	0	0	0	110.8	C186 A187 A188 L194	C186-V190 WeakPolarHBondContact O-CG2 3.5Å; C186-V190 PolarHBondContact O-N 2.99Å; C186-V190 VanDerWaalsContact O-N 3.07Å; A187-V190 PolarHBondContact O-N 2.94Å; A188-V190 PolarHBondContact O-N 3.36Å; V190-L194 HydrophobicContact CG1-CD1 3.7Å; V190-L194 HydrophobicContact CG1-CG 4.34Å; V190-L194 VanDerWaalsContact O-CB 3.23Å; V190-L194 WeakPolarHBondContact O-CB 3.19Å; V190-L194 WeakPolarHBondContact O-CG 3.38Å; V190-L194 PolarHBondContact O-N 3.28Å
191	L	96.3	Very high	93.4	Very high	55 Å²	55	38 Å²	38	29%	0.288	22%	0.223	S	C	.	.	H	α-helix	trans	-66.7	-43.4	-179.5	-72.3	172.7	0	0	0	112.9	L22 A187 A188 F189 G195	L22-L191 HydrophobicContact CD1-CD1 3.76Å; A187-L191 WeakPolarHBondContact O-CB 3.41Å; A187-L191 WeakPolarHBondContact O-CG 3.14Å; A187-L191 PolarHBondContact O-N 3.37Å; A188-L191 PolarHBondContact O-N 3.33Å; F189-L191 VanDerWaalsContact C-N 3.33Å; F189-L191 PolarHBondContact O-N 3.45Å; L191-G195 WeakPolarHBondContact O-CA 3.22Å; L191-G195 PolarHBondContact O-N 3.47Å
192	L	95.7	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.9	-41.3	-179.5	-69.5	173.6	0	0	0	111.8	I16 I20 A23 Y144 I151 A188 F189 G196	I16-L192 HydrophobicContact CG2-CD2 4.04Å; I20-L192 HydrophobicContact CG1-CD2 3.93Å; A23-L192 HydrophobicContact CB-CD1 4.16Å; Y144-L192 HydrophobicContact CD1-CD2 4.35Å; I151-L192 HydrophobicContact CD1-CD1 3.77Å; A188-L192 VanDerWaalsContact O-CB 3.29Å; A188-L192 WeakPolarHBondContact O-CB 2.96Å; A188-L192 VanDerWaalsContact O-CG 3.26Å; A188-L192 WeakPolarHBondContact O-CG 3.09Å; A188-L192 PolarHBondContact O-N 3.02Å; F189-L192 PolarHBondContact O-N 2.92Å; L192-G196 WeakPolarHBondContact O-CA 3.22Å; L192-G196 PolarHBondContact O-N 2.65Å
193	F	96.2	Very high	93	Very high	55 Å²	55	40.5 Å²	40.5	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-71.1	-54.6	-179.3	-176	-107.4	0	0	0	111.8	A145 L149 F189 G196 L197	A145-F193 HydrophobicContact CB-CD2 4.43Å; L149-F193 HydrophobicContact CD1-CE2 4.18Å; L149-F193 HydrophobicContact CD2-CD2 4Å; L149-F193 HydrophobicContact CD2-CE2 3.75Å; L149-F193 HydrophobicContact CD2-CZ 4.48Å; L149-F193 HydrophobicContact CG-CD2 3.95Å; L149-F193 HydrophobicContact CG-CE2 3.9Å; F189-F193 HydrophobicContact CD2-CB 4.05Å; F189-F193 HydrophobicContact CE2-CB 3.76Å; F189-F193 HydrophobicContact CE2-CD1 4.31Å; F189-F193 HydrophobicContact CE2-CD2 4.38Å; F189-F193 AromaticContact CE2-CG 3.9Å; F189-F193 HydrophobicContact CE2-CG 3.9Å; F189-F193 HydrophobicContact CZ-CB 4.39Å; F189-F193 HydrophobicContact CZ-CD1 4.31Å; F189-F193 HydrophobicContact CZ-CG 4.36Å; F189-F193 WeakPolarHBondContact O-CB 2.89Å; F189-F193 PolarHBondContact O-N 2.87Å; F193-G196 PolarHBondContact O-N 2.99Å; F193-L197 HydrophobicContact CD1-CD1 4.01Å; F193-L197 HydrophobicContact CE1-CD1 3.52Å; F193-L197 HydrophobicContact CE2-CD1 4.2Å; F193-L197 HydrophobicContact CZ-CD1 3.64Å; F193-L197 WeakPolarHBondContact O-CG 3.38Å; F193-L197 PolarHBondContact O-N 3.47Å
194	L	95.6	Very high	92.5	Very high	99 Å²	99	41 Å²	41	52%	0.518	23%	0.228	S	C	.	.	H	α-helix	trans	-69	-36.7	178.2	-62.1	-178.3	0	0	0	111.5	V190 L197 A198	V190-L194 HydrophobicContact CG1-CD1 3.7Å; V190-L194 HydrophobicContact CG1-CG 4.34Å; V190-L194 VanDerWaalsContact O-CB 3.23Å; V190-L194 WeakPolarHBondContact O-CB 3.19Å; V190-L194 WeakPolarHBondContact O-CG 3.38Å; V190-L194 PolarHBondContact O-N 3.28Å; L194-L197 PolarHBondContact O-N 3.18Å; L194-A198 WeakPolarHBondContact O-CB 3.08Å; L194-A198 PolarHBondContact O-N 2.8Å
195	G	94.4	Very high	91.7	Very high	9 Å²	9	41.7 Å²	41.7	9%	0.093	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-43.8	174.2	0	0	0	0	0	112	T12 L191 A198 L199	T12-G195 VanDerWaalsContact CG2-O 3.32Å; T12-G195 WeakPolarHBondContact CG2-O 3.13Å; L191-G195 WeakPolarHBondContact O-CA 3.22Å; L191-G195 PolarHBondContact O-N 3.47Å; G195-A198 PolarHBondContact O-N 2.88Å; G195-L199 WeakPolarHBondContact O-CB 3.42Å; G195-L199 PolarHBondContact O-N 3.05Å
196	G	94	Very high	90.7	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-49.4	174.2	0	0	0	0	0	112.2	S141 L192 F193 L199 L200	S141-G196 WeakPolarHBondContact CB-O 3.33Å; L192-G196 WeakPolarHBondContact O-CA 3.22Å; L192-G196 PolarHBondContact O-N 2.65Å; F193-G196 PolarHBondContact O-N 2.99Å; G196-L199 PolarHBondContact O-N 2.81Å; G196-L200 WeakPolarHBondContact O-CB 3.46Å; G196-L200 PolarHBondContact O-N 2.97Å
197	L	94.1	Very high	89.8	Confident	69 Å²	69	58.5 Å²	58.5	36%	0.361	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-44.3	176.9	-72.3	173.2	0	0	0	112.6	F193 L194 L199 L200 L201	F193-L197 HydrophobicContact CD1-CD1 4.01Å; F193-L197 HydrophobicContact CE1-CD1 3.52Å; F193-L197 HydrophobicContact CE2-CD1 4.2Å; F193-L197 HydrophobicContact CZ-CD1 3.64Å; F193-L197 WeakPolarHBondContact O-CG 3.38Å; F193-L197 PolarHBondContact O-N 3.47Å; L194-L197 PolarHBondContact O-N 3.18Å; L197-L199 VanDerWaalsContact C-N 3.35Å; L197-L199 PolarHBondContact O-N 3.3Å; L197-L200 WeakPolarHBondContact O-CB 3.18Å; L197-L200 PolarHBondContact O-N 2.74Å; L197-L201 WeakPolarHBondContact O-CG 3.45Å; L197-L201 PolarHBondContact O-N 2.81Å
198	A	92.3	Very high	88.8	Confident	29 Å²	29	59 Å²	59	24%	0.24	30%	0.298	C	S	.	.	H	α-helix	trans	-63.5	-41.9	177.1	0	0	0	0	0	111.4	T12 L194 G195 L200 L201 F202	T12-A198 HydrophobicContact CG2-CB 4.21Å; L194-A198 WeakPolarHBondContact O-CB 3.08Å; L194-A198 PolarHBondContact O-N 2.8Å; G195-A198 PolarHBondContact O-N 2.88Å; A198-L200 VanDerWaalsContact C-N 3.31Å; A198-L200 PolarHBondContact O-N 2.99Å; A198-L201 PolarHBondContact O-N 3.4Å; A198-F202 HydrophobicContact CB-CE2 4.27Å; A198-F202 WeakPolarHBondContact O-CB 3.45Å; A198-F202 VanDerWaalsContact O-CD2 3.28Å; A198-F202 WeakPolarHBondContact O-CD2 3.46Å; A198-F202 WeakPolarHBondContact O-CG 3.38Å; A198-F202 PolarHBondContact O-N 3.1Å
199	L	91.1	Very high	87.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-37.4	176	-171.7	67.3	0	0	0	111.4	V9 T12 L13 I16 Y144 G195 G196 L197 F202 S203	V9-L199 HydrophobicContact CG1-CD1 3.93Å; T12-L199 HydrophobicContact CG2-CB 3.95Å; T12-L199 HydrophobicContact CG2-CD1 4.43Å; L13-L199 HydrophobicContact CD2-CD1 4.23Å; L13-L199 HydrophobicContact CD2-CD2 3.86Å; L13-L199 HydrophobicContact CG-CD1 4.27Å; I16-L199 HydrophobicContact CD1-CB 4.26Å; I16-L199 HydrophobicContact CD1-CD2 3.84Å; Y144-L199 HydrophobicContact CD2-CD2 4.49Å; G195-L199 WeakPolarHBondContact O-CB 3.42Å; G195-L199 PolarHBondContact O-N 3.05Å; G196-L199 PolarHBondContact O-N 2.81Å; L197-L199 VanDerWaalsContact C-N 3.35Å; L197-L199 PolarHBondContact O-N 3.3Å; L199-F202 PolarHBondContact O-N 2.94Å; L199-S203 VanDerWaalsContact O-CB 3.24Å; L199-S203 WeakPolarHBondContact O-CB 3.4Å; L199-S203 PolarHBondContact O-N 2.84Å; L199-S203 PolarHBondContact O-OG 2.04Å
200	L	90.9	Very high	87.2	Confident	37 Å²	37	71.1 Å²	71.1	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-50.7	173.9	-176.5	63.3	0	0	0	110.6	S141 M142 G196 L197 A198 F202 S203 L204	S141-L200 WeakPolarHBondContact OG-CA 3.3Å; S141-L200 WeakPolarHBondContact OG-CB 2.96Å; S141-L200 WeakPolarHBondContact OG-CD1 3.33Å; M142-L200 HydrophobicContact CE-CD1 4.31Å; G196-L200 WeakPolarHBondContact O-CB 3.46Å; G196-L200 PolarHBondContact O-N 2.97Å; L197-L200 WeakPolarHBondContact O-CB 3.18Å; L197-L200 PolarHBondContact O-N 2.74Å; A198-L200 VanDerWaalsContact C-N 3.31Å; A198-L200 PolarHBondContact O-N 2.99Å; L200-F202 VanDerWaalsContact C-N 3.28Å; L200-F202 PolarHBondContact O-N 3.08Å; L200-S203 WeakPolarHBondContact CA-OG 3.22Å; L200-S203 PolarHBondContact O-N 3.16Å; L200-S203 VanDerWaalsContact O-N 3.15Å; L200-S203 PolarHBondContact O-OG 3.05Å; L200-L204 HydrophobicContact CD1-CD1 4.27Å; L200-L204 HydrophobicContact CD1-CG 4.33Å; L200-L204 HydrophobicContact CG-CD1 3.99Å; L200-L204 HydrophobicContact CG-CG 4.48Å; L200-L204 WeakPolarHBondContact O-CB 3.25Å; L200-L204 VanDerWaalsContact O-CG 3.3Å; L200-L204 WeakPolarHBondContact O-CG 3.46Å; L200-L204 PolarHBondContact O-N 2.82Å
201	L	88.6	Confident	86.4	Confident	125 Å²	125	73.8 Å²	73.8	65%	0.654	37%	0.366	S	S	*	.	H	α-helix	trans	-62.4	-34.1	178.5	-68.2	174.2	0	0	0	112.8	L197 A198	L197-L201 WeakPolarHBondContact O-CG 3.45Å; L197-L201 PolarHBondContact O-N 2.81Å; A198-L201 PolarHBondContact O-N 3.4Å
202	F	86.6	Confident	85.5	Confident	85 Å²	85	80.3 Å²	80.3	37%	0.373	39%	0.387	S	S	.	.	H	α-helix	trans	-79	-23.8	176.8	-62.9	-21.4	0	0	0	113.6	Q3 K8 V9 T12 A198 L199 L200	Q3-F202 PolarHBondContact NE2-O 3.34Å; Q3-F202 VanDerWaalsContact NE2-O 3.16Å; K8-F202 HydrophobicContact CB-CD2 4.3Å; K8-F202 HydrophobicContact CB-CE2 4.21Å; V9-F202 HydrophobicContact CG2-CB 4.09Å; T12-F202 WeakPolarHBondContact OG1-CE2 3.22Å; A198-F202 HydrophobicContact CB-CE2 4.27Å; A198-F202 WeakPolarHBondContact O-CB 3.45Å; A198-F202 VanDerWaalsContact O-CD2 3.28Å; A198-F202 WeakPolarHBondContact O-CD2 3.46Å; A198-F202 WeakPolarHBondContact O-CG 3.38Å; A198-F202 PolarHBondContact O-N 3.1Å; L199-F202 PolarHBondContact O-N 2.94Å; L200-F202 VanDerWaalsContact C-N 3.28Å; L200-F202 PolarHBondContact O-N 3.08Å
203	S	83.3	Confident	84.5	Confident	2 Å²	2	83.9 Å²	83.9	1%	0.014	40%	0.404	C	S	.	.	H	α-helix	trans	-91.4	-17	176.9	62.4	0	0	0	0	113.4	Q3 R138 L199 L200	Q3-S203 PolarHBondContact NE2-O 3.02Å; Q3-S203 VanDerWaalsContact OE1-CA 3.29Å; Q3-S203 PolarHBondContact OE1-O 3.12Å; Q3-S203 VanDerWaalsContact OE1-O 3.04Å; R138-S203 PolarHBondContact NE-O 3.17Å; L199-S203 VanDerWaalsContact O-CB 3.24Å; L199-S203 WeakPolarHBondContact O-CB 3.4Å; L199-S203 PolarHBondContact O-N 2.84Å; L199-S203 PolarHBondContact O-OG 2.04Å; L200-S203 WeakPolarHBondContact CA-OG 3.22Å; L200-S203 PolarHBondContact O-N 3.16Å; L200-S203 VanDerWaalsContact O-N 3.15Å; L200-S203 PolarHBondContact O-OG 3.05Å
204	L	82.2	Confident	83.5	Confident	70 Å²	70	84.9 Å²	84.9	37%	0.366	42%	0.418	S	S	.	.	S	Bend	trans	-72.1	144.9	170.2	-76.1	166.7	0	0	0	110.5	Q3 L200	Q3-L204 PolarHBondContact NE2-O 3.16Å; L200-L204 HydrophobicContact CD1-CD1 4.27Å; L200-L204 HydrophobicContact CD1-CG 4.33Å; L200-L204 HydrophobicContact CG-CD1 3.99Å; L200-L204 HydrophobicContact CG-CG 4.48Å; L200-L204 WeakPolarHBondContact O-CB 3.25Å; L200-L204 VanDerWaalsContact O-CG 3.3Å; L200-L204 WeakPolarHBondContact O-CG 3.46Å; L200-L204 PolarHBondContact O-N 2.82Å
205	P	76.1	Confident	82.2	Confident	42 Å²	42	83.3 Å²	83.3	27%	0.273	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-57.5	145.8	168.5	-21.1	36.5	0	0	0	108.9	C215	P205-C215 WeakPolarHBondContact CB-O 3.36Å; P205-C215 WeakPolarHBondContact CG-O 3.43Å
206	R	70.5	Confident	81	Confident	227 Å²	227	89.8 Å²	89.8	86%	0.857	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-61.8	144.4	176.7	-78.7	-177.1	175.3	155.1	0.3	109.2
207	M	74.5	Confident	79.4	Confident	171 Å²	171	94.2 Å²	94.2	84%	0.842	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-56.2	128.8	173.5	-157.2	174.4	-154.3	0	0	108.6	R209	M207-R209 PolarHBondContact O-N 2.95Å
208	P	75.9	Confident	77.6	Confident	52 Å²	52	95.3 Å²	95.3	34%	0.338	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-60.2	126.9	-179.1	21.8	-30.9	0	0	0	109.2	E213	P208-E213 WeakPolarHBondContact CA-OE2 3.08Å; P208-E213 HydrophobicContact CB-CB 3.5Å; P208-E213 VanDerWaalsContact CB-CB 3.5Å; P208-E213 WeakPolarHBondContact CB-O 3.09Å
209	R	76.3	Confident	75.8	Confident	233 Å²	233	102.2 Å²	102.2	88%	0.879	51%	0.513	S	S	*	.			trans	-95.2	-23.1	-180	-120.4	177.6	-176.6	159	0.1	111.6	M207 E213	M207-R209 PolarHBondContact O-N 2.95Å; R209-E213 PolarHBondContact N-OE2 2.76Å
210	N	79.8	Confident	73.8	Confident	63 Å²	63	107.1 Å²	107.1	34%	0.337	55%	0.546	S	S	.	.	S	Bend	trans	-112.8	149.2	-178.6	-59.5	-54.2	0	0	0	110.1	W212 E213	N210-W212 HydrophobicContact CB-CD2 3.86Å; N210-W212 VanDerWaalsContact CB-CE2 3.43Å; N210-W212 HydrophobicContact CB-CE3 4.24Å; N210-W212 HydrophobicContact CB-CG 4.45Å; N210-W212 HydrophobicContact CB-CH2 3.89Å; N210-W212 HydrophobicContact CB-CZ2 3.47Å; N210-W212 VanDerWaalsContact CB-CZ2 3.47Å; N210-W212 HydrophobicContact CB-CZ3 4.26Å; N210-W212 PolarHBondContact O-N 3.34Å; N210-W212 VanDerWaalsContact O-N 3.14Å; N210-E213 HydrophobicContact CB-CG 4.17Å; N210-E213 PolarHBondContact N-OE2 2.85Å; N210-E213 PolarHBondContact ND2-OE1 3.14Å; N210-E213 PolarHBondContact O-N 2.93Å; N210-E213 VanDerWaalsContact O-N 3.13Å
211	P	80.5	Confident	71.2	Confident	125 Å²	125	114.6 Å²	114.6	81%	0.812	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-12.9	-175.6	23.8	-31.5	0	0	0	114.8
212	W	76.6	Confident	68.8	Low	193 Å²	193	120.4 Å²	120.4	73%	0.731	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-4.5	176	56.5	80.6	0	0	0	113.9	N210	N210-W212 HydrophobicContact CB-CD2 3.86Å; N210-W212 VanDerWaalsContact CB-CE2 3.43Å; N210-W212 HydrophobicContact CB-CE3 4.24Å; N210-W212 HydrophobicContact CB-CG 4.45Å; N210-W212 HydrophobicContact CB-CH2 3.89Å; N210-W212 HydrophobicContact CB-CZ2 3.47Å; N210-W212 VanDerWaalsContact CB-CZ2 3.47Å; N210-W212 HydrophobicContact CB-CZ3 4.26Å; N210-W212 PolarHBondContact O-N 3.34Å; N210-W212 VanDerWaalsContact O-N 3.14Å
213	E	76.1	Confident	67.9	Low	74 Å²	74	122.2 Å²	122.2	35%	0.346	61%	0.614	S	S	.	*			trans	-86.1	126.4	175	-70.9	169.2	-174.9	0	0	109.5	P208 R209 N210 D217	P208-E213 WeakPolarHBondContact CA-OE2 3.08Å; P208-E213 HydrophobicContact CB-CB 3.5Å; P208-E213 VanDerWaalsContact CB-CB 3.5Å; P208-E213 WeakPolarHBondContact CB-O 3.09Å; R209-E213 PolarHBondContact N-OE2 2.76Å; N210-E213 HydrophobicContact CB-CG 4.17Å; N210-E213 PolarHBondContact N-OE2 2.85Å; N210-E213 PolarHBondContact ND2-OE1 3.14Å; N210-E213 PolarHBondContact O-N 2.93Å; N210-E213 VanDerWaalsContact O-N 3.13Å; E213-D217 WeakPolarHBondContact CA-OD2 3.42Å
214	S	75.3	Confident	67.1	Low	76 Å²	76	128.5 Å²	128.5	53%	0.531	65%	0.646	S	S	.	*			trans	-99.6	146.2	167.6	-164.1	0	0	0	0	110.8	M216 D217	S214-M216 PolarHBondContact O-N 2.9Å; S214-D217 WeakPolarHBondContact CB-OD1 3.41Å; S214-D217 VanDerWaalsContact N-CG 3.29Å; S214-D217 PolarHBondContact N-OD1 3.25Å; S214-D217 PolarHBondContact N-OD2 3.44Å; S214-D217 PolarHBondContact O-N 3.2Å; S214-D217 VanDerWaalsContact O-N 3.12Å
215	C	66.5	Low	66.2	Low	66 Å²	66	131.7 Å²	131.7	45%	0.446	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.6	-14.9	-175.9	-152.6	0	0	0	0	113.2	P205	P205-C215 WeakPolarHBondContact CB-O 3.36Å; P205-C215 WeakPolarHBondContact CG-O 3.43Å
216	M	69.4	Low	65.7	Low	145 Å²	145	137 Å²	137	71%	0.714	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	56.9	170.3	-77	-102.8	-71.3	0	0	109.1	S214 A218	S214-M216 PolarHBondContact O-N 2.9Å; M216-A218 PolarHBondContact O-N 2.97Å
217	D	61.6	Low	65.4	Low	95 Å²	95	131.4 Å²	131.4	51%	0.508	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-61.2	135.7	170.9	-83.5	-29.5	0	0	0	110.6	E213 S214 E219	E213-D217 WeakPolarHBondContact CA-OD2 3.42Å; S214-D217 WeakPolarHBondContact CB-OD1 3.41Å; S214-D217 VanDerWaalsContact N-CG 3.29Å; S214-D217 PolarHBondContact N-OD1 3.25Å; S214-D217 PolarHBondContact N-OD2 3.44Å; S214-D217 PolarHBondContact O-N 3.2Å; S214-D217 VanDerWaalsContact O-N 3.12Å; D217-E219 PolarHBondContact O-N 2.77Å
218	A	55.2	Low	64.7	Low	91 Å²	91	128.7 Å²	128.7	75%	0.752	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-60.2	130.6	169.8	0	0	0	0	0	108.6	M216	M216-A218 PolarHBondContact O-N 2.97Å
219	E	56.1	Low	64	Low	174 Å²	174	134.2 Å²	134.2	81%	0.813	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-55.7	129.5	170.8	-89.4	172.8	149.5	0	0	108.2	D217 E221	D217-E219 PolarHBondContact O-N 2.77Å; E219-E221 PolarHBondContact O-N 2.91Å; E219-E221 VanDerWaalsContact O-N 3.15Å
220	P	47.9	Very low	63	Low	104 Å²	104	126.6 Å²	126.6	68%	0.675	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-61.5	122.6	179.1	23.6	-31.1	0	0	0	108.4	H222	P220-H222 PolarHBondContact O-N 2.98Å
221	E	36.8	Very low	61.6	Low	194 Å²	194	131.9 Å²	131.9	91%	0.907	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-60	121.2	172.9	-58.3	-156.2	177.5	0	0	108.1	E219	E219-E221 PolarHBondContact O-N 2.91Å; E219-E221 VanDerWaalsContact O-N 3.15Å
222	H	37.3	Very low	59.9	Low	246 Å²	246	132.5 Å²	132.5	100%	1.139	69%	0.687	S	S	*	*			trans	-125	0	169.4	-81.7	28.7	0	0	0	107.8	P220	P220-H222 PolarHBondContact O-N 2.98Å

Retrieved 222 of 222 residues in 475.8 ms (Link to these results)

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