Q99PR9_RAT Loading...

Voltage-dependent calcium channel gamma-2 subunit

Regulates the trafficking and gating properties of AMPA-selective glutamate receptors (AMPARs). Promotes their targeting to the cell membrane and synapses and modulates their gating properties by slowing their rates of activation, deactivation and desensitization. Does not show subunit-specific AMPA receptor regulation and regulates all AMPAR subunits. Thought to stabilize the calcium channel in an inactivated (closed) state.

AlphaFold DB , UniProt , Accession Q99PR9, Species RAT (Rattus norvegicus, Rat), Gene Cacng2, Length 323 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	44.8	Very low	73.5	Confident	207 Å²	207	97.9 Å²	97.9	100%	1.02	54%	0.536	S	S	*	.				0	-44.7	0	-95.4	81.3	173.5	0	0	114.9	L3	M1-L3 PolarHBondContact O-N 2.75Å; M1-L3 VanDerWaalsContact O-N 3.07Å
2	G	57.3	Low	75	Confident	59 Å²	59	97.8 Å²	97.8	61%	0.608	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	17.7	-151.7	0	0	0	0	0	123.1
3	L	55.1	Low	76.3	Confident	154 Å²	154	90.4 Å²	90.4	81%	0.806	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-35.5	176.2	-135	131.1	0	0	0	112.7	M1 R6 G7	M1-L3 PolarHBondContact O-N 2.75Å; M1-L3 VanDerWaalsContact O-N 3.07Å; L3-R6 PolarHBondContact O-N 3.16Å; L3-G7 PolarHBondContact O-N 3.37Å
4	F	56.1	Low	77.4	Confident	171 Å²	171	86.1 Å²	86.1	75%	0.75	47%	0.471	S	S	*	.	H	α-helix	trans	-68	-45	175.2	-154.1	-95.2	0	0	0	111	R6 G7 V8	F4-R6 PolarHBondContact O-N 3.39Å; F4-G7 PolarHBondContact O-N 3.04Å; F4-V8 HydrophobicContact CD1-CG2 4.13Å; F4-V8 HydrophobicContact CE1-CG2 4.2Å; F4-V8 VanDerWaalsContact O-CG2 3.29Å; F4-V8 WeakPolarHBondContact O-CG2 3.45Å; F4-V8 PolarHBondContact O-N 3.29Å
5	D	79	Confident	78.6	Confident	96 Å²	96	86.3 Å²	86.3	51%	0.513	48%	0.475	S	S	.	.	H	α-helix	trans	-58.4	-34.5	175.8	-73.9	-36.3	0	0	0	113	Q9	D5-Q9 WeakPolarHBondContact O-CB 3.29Å; D5-Q9 PolarHBondContact O-N 2.93Å
6	R	78.4	Confident	79.6	Confident	60 Å²	60	81.6 Å²	81.6	23%	0.226	45%	0.453	C	S	.	.	H	α-helix	trans	-75.8	-40	-177.9	-169.3	179.4	180	141.2	12.8	112.6	L3 F4 V8 Q9 M10	L3-R6 PolarHBondContact O-N 3.16Å; F4-R6 PolarHBondContact O-N 3.39Å; R6-V8 VanDerWaalsContact C-N 3.31Å; R6-Q9 PolarHBondContact O-N 3.44Å; R6-M10 WeakPolarHBondContact O-CB 3.28Å; R6-M10 PolarHBondContact O-N 3.21Å
7	G	82.7	Confident	80.5	Confident	44 Å²	44	77.2 Å²	77.2	45%	0.454	43%	0.43	S	S	.	.	H	α-helix	trans	-61.9	-43.1	172.7	0	0	0	0	0	111	L3 F4 M10 L11	L3-G7 PolarHBondContact O-N 3.37Å; F4-G7 PolarHBondContact O-N 3.04Å; G7-M10 PolarHBondContact O-N 3.23Å; G7-L11 WeakPolarHBondContact O-CB 3.43Å; G7-L11 PolarHBondContact O-N 3.44Å
8	V	88.9	Confident	81.3	Confident	72 Å²	72	80.9 Å²	80.9	44%	0.436	44%	0.441	S	S	.	.	H	α-helix	trans	-62.2	-45.8	175.2	173.9	0	0	0	0	111.4	F4 R6 M10 L11 L12	F4-V8 HydrophobicContact CD1-CG2 4.13Å; F4-V8 HydrophobicContact CE1-CG2 4.2Å; F4-V8 VanDerWaalsContact O-CG2 3.29Å; F4-V8 WeakPolarHBondContact O-CG2 3.45Å; F4-V8 PolarHBondContact O-N 3.29Å; R6-V8 VanDerWaalsContact C-N 3.31Å; V8-M10 VanDerWaalsContact C-N 3.33Å; V8-M10 PolarHBondContact O-N 3.07Å; V8-L11 PolarHBondContact O-N 2.97Å; V8-L12 WeakPolarHBondContact O-CB 3.1Å; V8-L12 PolarHBondContact O-N 3.46Å
9	Q	87.5	Confident	82.1	Confident	37 Å²	37	78.6 Å²	78.6	17%	0.173	43%	0.434	C	S	.	.	H	α-helix	trans	-61.5	-41.2	178	-170.7	172.5	19.5	0	0	111.9	D5 R6 L12 T13 L196	D5-Q9 WeakPolarHBondContact O-CB 3.29Å; D5-Q9 PolarHBondContact O-N 2.93Å; R6-Q9 PolarHBondContact O-N 3.44Å; Q9-L12 PolarHBondContact O-N 3.27Å; Q9-T13 WeakPolarHBondContact O-CB 3.44Å; Q9-T13 PolarHBondContact O-N 2.74Å; Q9-T13 PolarHBondContact O-OG1 2.81Å; Q9-L196 HydrophobicContact CG-CD2 4.38Å
10	M	87.7	Confident	82.8	Confident	64 Å²	64	74.7 Å²	74.7	32%	0.315	41%	0.412	S	S	.	.	H	α-helix	trans	-66.1	-43.6	177.2	-163.6	166.9	94	0	0	111.6	R6 G7 V8 T13 T14 E126 M200	R6-M10 WeakPolarHBondContact O-CB 3.28Å; R6-M10 PolarHBondContact O-N 3.21Å; G7-M10 PolarHBondContact O-N 3.23Å; V8-M10 VanDerWaalsContact C-N 3.33Å; V8-M10 PolarHBondContact O-N 3.07Å; M10-T13 WeakPolarHBondContact O-CB 3.48Å; M10-T13 PolarHBondContact O-N 3.31Å; M10-T14 WeakPolarHBondContact O-CG2 3.47Å; M10-T14 PolarHBondContact O-N 3.18Å; M10-T14 PolarHBondContact O-OG1 3.48Å; M10-E126 HydrophobicContact CE-CG 3.85Å; M10-M200 HydrophobicContact CB-CE 4.37Å; M10-M200 HydrophobicContact CB-SD 4.26Å; M10-M200 HydrophobicContact CG-CE 4.16Å
11	L	90.5	Very high	83.4	Confident	113 Å²	113	73.9 Å²	73.9	59%	0.592	41%	0.405	S	S	*	.	H	α-helix	trans	-64.1	-39.8	176.3	-174.1	134.1	0	0	0	112.2	G7 V8 T13 T14 V15	G7-L11 WeakPolarHBondContact O-CB 3.43Å; G7-L11 PolarHBondContact O-N 3.44Å; V8-L11 PolarHBondContact O-N 2.97Å; L11-T13 VanDerWaalsContact C-N 3.32Å; L11-T13 PolarHBondContact O-N 2.77Å; L11-T14 WeakPolarHBondContact CA-OG1 3.37Å; L11-T14 PolarHBondContact O-N 3.45Å; L11-T14 PolarHBondContact O-OG1 3.29Å; L11-V15 HydrophobicContact CD2-CG2 4.36Å; L11-V15 HydrophobicContact CG-CG2 4.48Å; L11-V15 WeakPolarHBondContact O-CB 3.39Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.3Å; L11-V15 PolarHBondContact O-N 2.8Å
12	L	92.1	Very high	85.9	Confident	96 Å²	96	67 Å²	67	50%	0.503	38%	0.377	S	S	.	.	H	α-helix	trans	-67.7	-35.5	176.2	-163.6	139.4	0	0	0	111.5	V8 Q9 G16 L196	V8-L12 WeakPolarHBondContact O-CB 3.1Å; V8-L12 PolarHBondContact O-N 3.46Å; Q9-L12 PolarHBondContact O-N 3.27Å; L12-G16 PolarHBondContact O-N 3.48Å; L12-L196 HydrophobicContact CD2-CD1 3.45Å; L12-L196 VanDerWaalsContact CD2-CD1 3.45Å
13	T	91.9	Very high	87.6	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.012	36%	0.356	C	S	.	.	H	α-helix	trans	-66.6	-43.4	175	-53.8	0	0	0	0	111.1	Q9 M10 L11 A17 I122 V193 A197	Q9-T13 WeakPolarHBondContact O-CB 3.44Å; Q9-T13 PolarHBondContact O-N 2.74Å; Q9-T13 PolarHBondContact O-OG1 2.81Å; M10-T13 WeakPolarHBondContact O-CB 3.48Å; M10-T13 PolarHBondContact O-N 3.31Å; L11-T13 VanDerWaalsContact C-N 3.32Å; L11-T13 PolarHBondContact O-N 2.77Å; T13-A17 VanDerWaalsContact O-CB 3.28Å; T13-A17 WeakPolarHBondContact O-CB 2.91Å; T13-A17 PolarHBondContact O-N 3.37Å; T13-I122 HydrophobicContact CG2-CD1 4.19Å; T13-V193 HydrophobicContact CG2-CG1 3.74Å; T13-A197 HydrophobicContact CG2-CB 4.48Å
14	T	92.2	Very high	89.5	Confident	31 Å²	31	58.5 Å²	58.5	19%	0.19	32%	0.318	C	S	.	.	H	α-helix	trans	-69.1	-48.6	179	54.2	0	0	0	0	111.8	M10 L11 G16 A17 F18 I122	M10-T14 WeakPolarHBondContact O-CG2 3.47Å; M10-T14 PolarHBondContact O-N 3.18Å; M10-T14 PolarHBondContact O-OG1 3.48Å; L11-T14 WeakPolarHBondContact CA-OG1 3.37Å; L11-T14 PolarHBondContact O-N 3.45Å; L11-T14 PolarHBondContact O-OG1 3.29Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.45Å; T14-A17 PolarHBondContact O-N 3.11Å; T14-F18 WeakPolarHBondContact O-CD2 3.49Å; T14-F18 PolarHBondContact O-N 3.32Å; T14-I122 HydrophobicContact CG2-CG2 3.77Å
15	V	94.7	Very high	91.2	Very high	88 Å²	88	53.3 Å²	53.3	53%	0.533	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-43.2	177.2	174.2	0	0	0	0	110.7	L11 A17 F18 A19	L11-V15 HydrophobicContact CD2-CG2 4.36Å; L11-V15 HydrophobicContact CG-CG2 4.48Å; L11-V15 WeakPolarHBondContact O-CB 3.39Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.3Å; L11-V15 PolarHBondContact O-N 2.8Å; V15-A17 PolarHBondContact O-N 3.14Å; V15-F18 PolarHBondContact O-N 3.42Å; V15-A19 VanDerWaalsContact O-CB 3.32Å; V15-A19 WeakPolarHBondContact O-CB 3.21Å; V15-A19 PolarHBondContact O-N 2.89Å
16	G	94.9	Very high	91.8	Very high	12 Å²	12	52.6 Å²	52.6	12%	0.124	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-39.6	175.3	0	0	0	0	0	112.8	L12 T14 A19 A20 I189	L12-G16 PolarHBondContact O-N 3.48Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.45Å; G16-A19 PolarHBondContact O-N 3.06Å; G16-A20 WeakPolarHBondContact O-CB 3.4Å; G16-A20 PolarHBondContact O-N 2.9Å; G16-I189 WeakPolarHBondContact O-CG2 3.37Å
17	A	94.9	Very high	92.4	Very high	7 Å²	7	49.8 Å²	49.8	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-63.7	-45.5	176.2	0	0	0	0	0	112.4	T13 T14 V15 F21 I122 F142 V193	T13-A17 VanDerWaalsContact O-CB 3.28Å; T13-A17 WeakPolarHBondContact O-CB 2.91Å; T13-A17 PolarHBondContact O-N 3.37Å; T14-A17 PolarHBondContact O-N 3.11Å; V15-A17 PolarHBondContact O-N 3.14Å; A17-F21 WeakPolarHBondContact O-CB 3.33Å; A17-F21 PolarHBondContact O-N 2.84Å; A17-I122 HydrophobicContact CB-CD1 3.85Å; A17-F142 HydrophobicContact CB-CE2 4.1Å; A17-F142 HydrophobicContact CB-CZ 4.13Å; A17-V193 HydrophobicContact CB-CG1 4.28Å
18	F	95	Very high	92.7	Very high	143 Å²	143	48.6 Å²	48.6	63%	0.627	27%	0.269	S	S	*	.	H	α-helix	trans	-63.2	-44.2	174.4	-75.4	-66.8	0	0	0	111.7	T14 V15 F21 S22	T14-F18 WeakPolarHBondContact O-CD2 3.49Å; T14-F18 PolarHBondContact O-N 3.32Å; V15-F18 PolarHBondContact O-N 3.42Å; F18-F21 PolarHBondContact O-N 2.95Å; F18-S22 WeakPolarHBondContact O-CB 3.35Å; F18-S22 PolarHBondContact O-N 3.36Å; F18-S22 PolarHBondContact O-OG 3.41Å; F18-S22 VanDerWaalsContact O-OG 3.06Å
19	A	96.3	Very high	92.5	Very high	37 Å²	37	48.1 Å²	48.1	31%	0.306	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-47	178	0	0	0	0	0	111.9	V15 G16 S22 L23	V15-A19 VanDerWaalsContact O-CB 3.32Å; V15-A19 WeakPolarHBondContact O-CB 3.21Å; V15-A19 PolarHBondContact O-N 2.89Å; G16-A19 PolarHBondContact O-N 3.06Å; A19-S22 PolarHBondContact O-N 2.96Å; A19-L23 WeakPolarHBondContact O-CB 3.32Å; A19-L23 VanDerWaalsContact O-CG 3.24Å; A19-L23 WeakPolarHBondContact O-CG 3.49Å; A19-L23 PolarHBondContact O-N 3Å
20	A	95.9	Very high	92.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-45.7	177.2	0	0	0	0	0	111.7	G16 M24 F142 S186 I189 A190	G16-A20 WeakPolarHBondContact O-CB 3.4Å; G16-A20 PolarHBondContact O-N 2.9Å; A20-M24 VanDerWaalsContact O-CB 3.3Å; A20-M24 WeakPolarHBondContact O-CB 3.42Å; A20-M24 PolarHBondContact O-N 2.88Å; A20-F142 HydrophobicContact CB-CZ 4.02Å; A20-S186 WeakPolarHBondContact O-CB 3.39Å; A20-I189 HydrophobicContact CB-CB 4.33Å; A20-I189 HydrophobicContact CB-CG2 4.01Å; A20-A190 HydrophobicContact CB-CB 4.45Å
21	F	96	Very high	92.1	Very high	59 Å²	59	46.9 Å²	46.9	26%	0.259	28%	0.276	S	S	.	.	H	α-helix	trans	-62.2	-45.9	177.2	177.2	-102.9	0	0	0	112.1	A17 F18 M24 T25 V112 L115 F116	A17-F21 WeakPolarHBondContact O-CB 3.33Å; A17-F21 PolarHBondContact O-N 2.84Å; F18-F21 PolarHBondContact O-N 2.95Å; F21-M24 PolarHBondContact O-N 3.01Å; F21-T25 WeakPolarHBondContact O-CB 3.47Å; F21-T25 PolarHBondContact O-N 3.39Å; F21-T25 PolarHBondContact O-OG1 3.45Å; F21-V112 HydrophobicContact CD2-CG1 4.45Å; F21-V112 HydrophobicContact CE2-CG1 3.79Å; F21-L115 HydrophobicContact CD2-CB 4.19Å; F21-F116 HydrophobicContact CD2-CB 4.33Å; F21-F116 HydrophobicContact CE2-CB 3.83Å; F21-F116 HydrophobicContact CE2-CD2 4.12Å; F21-F116 HydrophobicContact CE2-CG 4.42Å; F21-F116 HydrophobicContact CZ-CD2 4.04Å
22	S	95.9	Very high	91.8	Very high	61 Å²	61	46 Å²	46	43%	0.427	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-47.2	178.4	-64.8	0	0	0	0	112.2	F18 A19 M24 T25 I26	F18-S22 WeakPolarHBondContact O-CB 3.35Å; F18-S22 PolarHBondContact O-N 3.36Å; F18-S22 PolarHBondContact O-OG 3.41Å; F18-S22 VanDerWaalsContact O-OG 3.06Å; A19-S22 PolarHBondContact O-N 2.96Å; S22-M24 VanDerWaalsContact C-N 3.32Å; S22-M24 PolarHBondContact O-N 3.43Å; S22-T25 PolarHBondContact O-N 2.87Å; S22-I26 WeakPolarHBondContact O-CD1 3.24Å; S22-I26 VanDerWaalsContact O-CG1 3.24Å; S22-I26 WeakPolarHBondContact O-CG1 3.48Å; S22-I26 PolarHBondContact O-N 2.85Å
23	L	94.5	Very high	91.4	Very high	32 Å²	32	41.5 Å²	41.5	17%	0.168	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-41.3	178.1	-72.3	173.2	0	0	0	111.7	A19 I26 A27 F182 L185 I189	A19-L23 WeakPolarHBondContact O-CB 3.32Å; A19-L23 VanDerWaalsContact O-CG 3.24Å; A19-L23 WeakPolarHBondContact O-CG 3.49Å; A19-L23 PolarHBondContact O-N 3Å; L23-I26 PolarHBondContact O-N 2.99Å; L23-A27 WeakPolarHBondContact O-CB 3.47Å; L23-A27 PolarHBondContact O-N 2.87Å; L23-F182 HydrophobicContact CD2-CB 4.34Å; L23-F182 HydrophobicContact CD2-CD1 3.83Å; L23-F182 HydrophobicContact CD2-CE1 4.39Å; L23-F182 HydrophobicContact CD2-CG 4.17Å; L23-L185 HydrophobicContact CD1-CD2 3.97Å; L23-L185 HydrophobicContact CD1-CG 4.17Å; L23-I189 HydrophobicContact CD1-CD1 3.88Å
24	M	93.4	Very high	90.7	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-44.6	174.9	-175.6	70.2	94.8	0	0	112	A20 F21 S22 I26 A27 V28 S111 V112 L115 N149	A20-M24 VanDerWaalsContact O-CB 3.3Å; A20-M24 WeakPolarHBondContact O-CB 3.42Å; A20-M24 PolarHBondContact O-N 2.88Å; F21-M24 PolarHBondContact O-N 3.01Å; S22-M24 VanDerWaalsContact C-N 3.32Å; S22-M24 PolarHBondContact O-N 3.43Å; M24-I26 VanDerWaalsContact C-N 3.29Å; M24-I26 PolarHBondContact O-N 3.33Å; M24-A27 WeakPolarHBondContact O-CB 3.24Å; M24-A27 PolarHBondContact O-N 3.44Å; M24-A27 VanDerWaalsContact O-N 3.13Å; M24-V28 HydrophobicContact CG-CG2 4.46Å; M24-V28 PolarHBondContact O-N 3.06Å; M24-V28 HydrophobicContact SD-CG2 4.41Å; M24-S111 WeakPolarHBondContact CE-OG 3.37Å; M24-V112 HydrophobicContact CB-CG2 4.4Å; M24-V112 HydrophobicContact CG-CG2 3.34Å; M24-L115 HydrophobicContact CB-CD1 3.92Å; M24-L115 HydrophobicContact CE-CD1 4.13Å; M24-L115 HydrophobicContact CG-CD1 4.16Å; M24-N149 HydrophobicContact CE-CB 3.54Å; M24-N149 WeakPolarHBondContact CE-ND2 3.4Å; M24-N149 WeakPolarHBondContact CE-OD1 3.4Å
25	T	92.4	Very high	89.9	Confident	63 Å²	63	42.3 Å²	42.3	39%	0.387	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-40.6	179.1	-55.3	0	0	0	0	111	F21 S22 G29	F21-T25 WeakPolarHBondContact O-CB 3.47Å; F21-T25 PolarHBondContact O-N 3.39Å; F21-T25 PolarHBondContact O-OG1 3.45Å; S22-T25 PolarHBondContact O-N 2.87Å; T25-G29 WeakPolarHBondContact O-CA 3.33Å; T25-G29 PolarHBondContact O-N 2.97Å
26	I	92.4	Very high	88.6	Confident	81 Å²	81	38.8 Å²	38.8	42%	0.415	22%	0.221	S	C	.	.	H	α-helix	trans	-62.8	-45.6	173.2	-67.3	163.5	0	0	0	109.9	S22 L23 M24 V28 G29 T30 F182	S22-I26 WeakPolarHBondContact O-CD1 3.24Å; S22-I26 VanDerWaalsContact O-CG1 3.24Å; S22-I26 WeakPolarHBondContact O-CG1 3.48Å; S22-I26 PolarHBondContact O-N 2.85Å; L23-I26 PolarHBondContact O-N 2.99Å; M24-I26 VanDerWaalsContact C-N 3.29Å; M24-I26 PolarHBondContact O-N 3.33Å; I26-V28 PolarHBondContact O-N 3.34Å; I26-G29 PolarHBondContact O-N 2.92Å; I26-T30 HydrophobicContact CG2-CG2 4.03Å; I26-T30 VanDerWaalsContact O-CB 3.32Å; I26-T30 WeakPolarHBondContact O-CB 3.38Å; I26-T30 VanDerWaalsContact O-CG2 3.3Å; I26-T30 WeakPolarHBondContact O-CG2 3.26Å; I26-T30 PolarHBondContact O-N 2.89Å; I26-T30 PolarHBondContact O-OG1 2.75Å; I26-F182 HydrophobicContact CG2-CD2 4.37Å
27	A	90.8	Very high	87	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.7	-53.8	178.1	0	0	0	0	0	110.7	L23 M24 G29 W33 S179	L23-A27 WeakPolarHBondContact O-CB 3.47Å; L23-A27 PolarHBondContact O-N 2.87Å; M24-A27 WeakPolarHBondContact O-CB 3.24Å; M24-A27 PolarHBondContact O-N 3.44Å; M24-A27 VanDerWaalsContact O-N 3.13Å; A27-G29 PolarHBondContact O-N 3.36Å; A27-W33 HydrophobicContact CB-CZ2 4.35Å; A27-W33 PolarHBondContact O-NE1 3.43Å; A27-S179 VanDerWaalsContact CB-O 3.3Å; A27-S179 WeakPolarHBondContact CB-O 3.42Å
28	V	88.1	Confident	85.5	Confident	19 Å²	19	45.2 Å²	45.2	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-33.8	-178.3	177.2	0	0	0	0	113.1	M24 I26 L63 W64 P108 V112	M24-V28 HydrophobicContact CG-CG2 4.46Å; M24-V28 PolarHBondContact O-N 3.06Å; M24-V28 HydrophobicContact SD-CG2 4.41Å; I26-V28 PolarHBondContact O-N 3.34Å; V28-L63 HydrophobicContact CG1-CD2 4.24Å; V28-W64 HydrophobicContact CG1-CZ2 4.28Å; V28-W64 PolarHBondContact O-NE1 3.5Å; V28-P108 HydrophobicContact CG2-CB 4.19Å; V28-V112 HydrophobicContact CG2-CG2 4.06Å
29	G	84.8	Confident	83.6	Confident	62 Å²	62	42.7 Å²	42.7	64%	0.639	25%	0.245	S	C	*	.	H	α-helix	trans	-85.1	-13.4	-175.5	0	0	0	0	0	115.1	T25 I26 A27	T25-G29 WeakPolarHBondContact O-CA 3.33Å; T25-G29 PolarHBondContact O-N 2.97Å; I26-G29 PolarHBondContact O-N 2.92Å; A27-G29 PolarHBondContact O-N 3.36Å
30	T	86.8	Confident	81.7	Confident	41 Å²	41	42.6 Å²	42.6	25%	0.252	24%	0.241	S	C	.	.	S	Bend	trans	-107	148.7	-179.3	56.6	0	0	0	0	112	I26 Y32 S179	I26-T30 HydrophobicContact CG2-CG2 4.03Å; I26-T30 VanDerWaalsContact O-CB 3.32Å; I26-T30 WeakPolarHBondContact O-CB 3.38Å; I26-T30 VanDerWaalsContact O-CG2 3.3Å; I26-T30 WeakPolarHBondContact O-CG2 3.26Å; I26-T30 PolarHBondContact O-N 2.89Å; I26-T30 PolarHBondContact O-OG1 2.75Å; T30-Y32 VanDerWaalsContact C-N 3.28Å; T30-Y32 PolarHBondContact O-N 3.27Å; T30-S179 WeakPolarHBondContact OG1-CB 3.41Å; T30-S179 PolarHBondContact OG1-OG 3.2Å
31	D	81.3	Confident	79.7	Confident	34 Å²	34	51 Å²	51	18%	0.182	28%	0.278	C	S	.	.	S	Bend	trans	-90.6	20.4	-175.3	-62.1	-44.2	0	0	0	113.9	H60 S61 G62	D31-H60 PolarHBondContact O-CD2 3.48Å; D31-H60 VanDerWaalsContact O-CD2 3.28Å; D31-S61 CarbonylContact O-C 3.59Å; D31-S61 VanDerWaalsContact O-O 3.09Å; D31-G62 WeakPolarHBondContact O-CA 3.44Å; D31-G62 PolarHBondContact O-N 2.87Å
32	Y	83.4	Confident	77.4	Confident	95 Å²	95	51.1 Å²	51.1	37%	0.373	28%	0.284	S	S	.	.			trans	-106.6	47.7	-175.6	-57.1	-82.9	0	0	0	113	T30 Y35 H60 G177 W178 S179	T30-Y32 VanDerWaalsContact C-N 3.28Å; T30-Y32 PolarHBondContact O-N 3.27Å; Y32-Y35 HydrophobicContact CD1-CE1 4.29Å; Y32-H60 HydrophobicContact CD1-CB 3.98Å; Y32-H60 AromaticContact CD1-CD2 3.7Å; Y32-H60 AromaticContact CD1-CG 3.9Å; Y32-H60 HydrophobicContact CE1-CB 4.33Å; Y32-H60 AromaticContact CE1-CD2 3.53Å; Y32-H60 AromaticContact CE1-CG 3.82Å; Y32-H60 AromaticContact CE1-NE2 3.71Å; Y32-H60 AromaticContact CZ-NE2 3.86Å; Y32-G177 CarbonylContact O-C 3.58Å; Y32-G177 VanDerWaalsContact O-C 3.23Å; Y32-G177 WeakPolarHBondContact O-CA 3.36Å; Y32-W178 PolarHBondContact O-N 2.92Å; Y32-S179 WeakPolarHBondContact CB-OG 3.48Å; Y32-S179 VanDerWaalsContact O-CB 3.26Å; Y32-S179 WeakPolarHBondContact O-CB 3.45Å; Y32-S179 PolarHBondContact O-N 2.71Å; Y32-S179 PolarHBondContact O-OG 2.83Å
33	W	84	Confident	75	Confident	1 Å²	1	57.9 Å²	57.9	0%	0.004	31%	0.305	C	S	.	.	S	Bend	trans	-78.9	-34.8	174.1	-76.7	57.5	0	0	0	111.4	A27 S61 L63 Y156 G177 F180	A27-W33 HydrophobicContact CB-CZ2 4.35Å; A27-W33 PolarHBondContact O-NE1 3.43Å; W33-S61 WeakPolarHBondContact CB-O 3.46Å; W33-S61 PolarHBondContact N-O 3.46Å; W33-S61 VanDerWaalsContact N-O 3.1Å; W33-L63 HydrophobicContact CZ2-CD2 4.38Å; W33-Y156 HydrophobicContact CB-CE1 4.36Å; W33-Y156 VanDerWaalsContact CB-OH 3.29Å; W33-Y156 WeakPolarHBondContact CB-OH 2.92Å; W33-Y156 AromaticContact CE3-CD1 3.91Å; W33-Y156 HydrophobicContact CE3-CD1 3.91Å; W33-Y156 HydrophobicContact CE3-CD2 4.02Å; W33-Y156 AromaticContact CE3-CE1 3.82Å; W33-Y156 HydrophobicContact CE3-CE1 3.82Å; W33-Y156 AromaticContact CE3-CE2 3.93Å; W33-Y156 HydrophobicContact CE3-CE2 3.93Å; W33-Y156 HydrophobicContact CE3-CG 4.01Å; W33-Y156 AromaticContact CE3-CZ 3.83Å; W33-Y156 HydrophobicContact CZ3-CD1 4.29Å; W33-Y156 HydrophobicContact CZ3-CD2 4.3Å; W33-Y156 HydrophobicContact CZ3-CG 4.12Å; W33-G177 PolarHBondContact O-N 3.44Å; W33-F180 HydrophobicContact CE3-CD2 4.01Å; W33-F180 HydrophobicContact CZ3-CD2 4.31Å
34	L	78.1	Confident	72.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	135.8	-169.9	-158.3	138.8	0	0	0	112.8	H60 S61 Y156 Y174 Y176	L34-H60 CarbonylContact O-C 2.98Å; L34-H60 WeakPolarHBondContact O-CA 3.33Å; L34-S61 PolarHBondContact N-O 2.95Å; L34-S61 VanDerWaalsContact N-O 3.1Å; L34-S61 PolarHBondContact O-N 2.92Å; L34-Y156 WeakPolarHBondContact CB-OH 3.28Å; L34-Y156 HydrophobicContact CD1-CE1 4.1Å; L34-Y174 HydrophobicContact CD1-CD1 3.37Å; L34-Y174 HydrophobicContact CD1-CE1 2.97Å; L34-Y174 HydrophobicContact CD1-CG 4.48Å; L34-Y174 HydrophobicContact CD2-CD1 3.48Å; L34-Y174 VanDerWaalsContact CD2-CD1 3.48Å; L34-Y174 HydrophobicContact CD2-CD2 3.83Å; L34-Y174 HydrophobicContact CD2-CE1 3.1Å; L34-Y174 HydrophobicContact CD2-CE2 3.46Å; L34-Y174 VanDerWaalsContact CD2-CE2 3.46Å; L34-Y174 HydrophobicContact CD2-CG 3.82Å; L34-Y174 WeakPolarHBondContact CD2-OH 3.38Å; L34-Y174 HydrophobicContact CG-CD1 3.73Å; L34-Y174 HydrophobicContact CG-CE1 3.49Å; L34-Y174 VanDerWaalsContact CG-CE1 3.49Å; L34-Y174 HydrophobicContact CG-CG 4.42Å; L34-Y176 HydrophobicContact CD1-CD1 4.3Å; L34-Y176 HydrophobicContact CD1-CE1 4.26Å
35	Y	75.1	Confident	69.9	Low	51 Å²	51	66.9 Å²	66.9	20%	0.2	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117.8	169.3	-62.8	-73.6	0	0	0	110.1	Y32 T59 H60 L69 S175	Y32-Y35 HydrophobicContact CD1-CE1 4.29Å; Y35-T59 WeakPolarHBondContact CA-O 3.32Å; Y35-H60 HydrophobicContact CD1-CB 4.03Å; Y35-H60 HydrophobicContact CE1-CB 3.9Å; Y35-L69 HydrophobicContact CD1-CD1 4.17Å; Y35-L69 HydrophobicContact CE1-CD1 3.96Å; Y35-S175 WeakPolarHBondContact CB-O 3.24Å; Y35-S175 PolarHBondContact N-O 2.97Å; Y35-S175 PolarHBondContact O-N 3.15Å; Y35-S175 VanDerWaalsContact O-N 3.08Å
36	S	67.5	Low	67.2	Low	14 Å²	14	67.9 Å²	67.9	10%	0.098	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.2	173.6	-177.9	0	0	0	0	109.4	T59 Y174	S36-T59 PolarHBondContact N-O 3.45Å; S36-T59 PolarHBondContact O-N 2.94Å; S36-T59 PolarHBondContact O-OG1 2.94Å; S36-Y174 VanDerWaalsContact CB-CE2 3.47Å; S36-Y174 WeakPolarHBondContact OG-CE2 3.22Å
37	R	61.4	Low	64.6	Low	127 Å²	127	72.6 Å²	72.6	48%	0.479	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.8	162.9	-74.2	-169.2	174.2	143.6	1.7	109.6	V57 M58	R37-V57 WeakPolarHBondContact CA-O 3.33Å; R37-M58 HydrophobicContact CG-CG 4.19Å; R37-M58 HydrophobicContact CG-SD 4.18Å
38	G	62.1	Low	62.7	Low	27 Å²	27	79.6 Å²	79.6	28%	0.278	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	169.8	-175.9	0	0	0	0	0	112.5	V57	G38-V57 PolarHBondContact N-O 3.24Å; G38-V57 PolarHBondContact O-N 2.9Å
39	V	56.2	Low	60.3	Low	90 Å²	90	86.6 Å²	86.6	55%	0.545	46%	0.464	S	S	.	.			trans	-92.8	112.7	176.3	-114.3	0	0	0	0	108.8	K41	V39-K41 PolarHBondContact O-N 2.93Å
40	C	55.6	Low	58	Low	35 Å²	35	87.9 Å²	87.9	24%	0.236	46%	0.459	C	S	.	.			trans	-77.6	86.7	173.8	-159.4	0	0	0	0	108.6	C68	C40-C68 HydrophobicContact CB-CB 3.93Å; C40-C68 WeakPolarHBondContact CB-SG 3.29Å; C40-C68 WeakPolarHBondContact SG-CB 3.28Å; C40-C68 CovalentContact SG-SG 2.03Å; C40-C68 PolarHBondContact SG-SG 3.34Å
41	K	53	Low	55.8	Low	176 Å²	176	92.1 Å²	92.1	77%	0.765	49%	0.49	S	S	*	.			trans	-92.2	120.9	174.7	-80.3	-173	177.6	-179.6	0	110.4	V39	V39-K41 PolarHBondContact O-N 2.93Å
42	T	49	Very low	53.8	Low	62 Å²	62	98.8 Å²	98.8	38%	0.38	52%	0.518	S	S	.	.			trans	-72.9	131.8	162.7	44.8	0	0	0	0	109.4	S44 F73	T42-S44 PolarHBondContact O-N 3.25Å; T42-F73 HydrophobicContact CG2-CD1 3.92Å; T42-F73 HydrophobicContact CG2-CE1 3.73Å; T42-F73 HydrophobicContact CG2-CE2 4.37Å; T42-F73 HydrophobicContact CG2-CG 4.3Å; T42-F73 HydrophobicContact CG2-CZ 3.96Å; T42-F73 VanDerWaalsContact OG1-CZ 3.27Å; T42-F73 WeakPolarHBondContact OG1-CZ 3.35Å
43	K	44.4	Very low	51.7	Low	203 Å²	203	103.2 Å²	103.2	88%	0.883	54%	0.539	S	S	*	.			trans	-75.5	70.8	167.1	-159.1	177.3	-172.9	177	0	107.7	V45	K43-V45 PolarHBondContact O-N 3.49Å
44	S	38.9	Very low	49.8	Very low	79 Å²	79	109.8 Å²	109.8	55%	0.552	57%	0.574	S	S	*	*			trans	-76	118.1	168	48.9	0	0	0	0	107.8	T42 S46	T42-S44 PolarHBondContact O-N 3.25Å; S44-S46 PolarHBondContact O-N 3.16Å
45	V	42.2	Very low	48.4	Very low	144 Å²	144	115.6 Å²	115.6	87%	0.873	60%	0.601	S	S	*	*	S	Bend	trans	-68.5	79.5	167.3	178	0	0	0	0	107.3	K43	K43-V45 PolarHBondContact O-N 3.49Å
46	S	36.6	Very low	47.4	Very low	84 Å²	84	117.9 Å²	117.9	59%	0.587	61%	0.614	S	S	*	*			trans	-179.9	113.2	161	20.7	0	0	0	0	109.5	S44	S44-S46 PolarHBondContact O-N 3.16Å
47	E	37.4	Very low	47	Very low	181 Å²	181	117.8 Å²	117.8	85%	0.846	61%	0.612	S	S	*	*			trans	46.2	122.8	137.9	-63.7	178.4	172.8	0	0	120
48	N	50.3	Low	47.1	Very low	146 Å²	146	114.9 Å²	114.9	78%	0.781	61%	0.605	S	S	*	*				35.6	140	129.4	-65.2	-19.8	0	0	0	119.5
49	E	37.4	Very low	47.6	Very low	167 Å²	167	114.2 Å²	114.2	78%	0.78	60%	0.596	S	S	*	*			trans	77.5	87.9	169.9	-55.5	-71.1	146.6	0	0	115
50	T	36.5	Very low	48.5	Very low	89 Å²	89	110.7 Å²	110.7	55%	0.546	57%	0.573	S	S	.	*				167.3	132.1	97.3	38.9	0	0	0	0	110.3	K52	T50-K52 PolarHBondContact O-N 2.96Å
51	S	41.3	Very low	49.4	Very low	130 Å²	130	109.8 Å²	109.8	91%	0.909	57%	0.567	S	S	*	*			trans	-52.2	55.8	156.2	42.9	0	0	0	0	113	K53	S51-K53 PolarHBondContact O-N 2.93Å
52	K	39.1	Very low	50.6	Low	174 Å²	174	101.5 Å²	101.5	76%	0.757	53%	0.532	S	S	*	.			trans	-86.2	100.2	170.1	-82.2	178.1	179.9	170.7	0	108	T50	T50-K52 PolarHBondContact O-N 2.96Å
53	K	39.7	Very low	51.6	Low	187 Å²	187	99 Å²	99	81%	0.813	52%	0.517	S	S	*	.			trans	19	106.9	168.4	-78.1	-179.9	174.5	179	0	113.8	S51 E55	S51-K53 PolarHBondContact O-N 2.93Å; K53-E55 PolarHBondContact O-N 3.41Å
54	N	43.4	Very low	53.1	Low	140 Å²	140	93.8 Å²	93.8	75%	0.749	49%	0.491	S	S	*	.			trans	-59.8	70.9	157.9	-59.7	-52.3	0	0	0	108.8	E56	N54-E56 PolarHBondContact O-N 3.5Å
55	E	49.6	Very low	54.9	Low	122 Å²	122	96.4 Å²	96.4	57%	0.57	49%	0.489	S	S	*	.			trans	-70.5	121.5	171.5	-161.9	162.9	-149.4	0	0	105.5	K53 V57	K53-E55 PolarHBondContact O-N 3.41Å; E55-V57 PolarHBondContact O-N 2.65Å
56	E	52.9	Low	56.6	Low	99 Å²	99	91.2 Å²	91.2	46%	0.463	46%	0.458	S	S	.	.			trans	-66.7	87.6	176.4	-64.1	-166.8	151.5	0	0	108.4	N54 K170	N54-E56 PolarHBondContact O-N 3.5Å; E56-K170 WeakPolarHBondContact OE1-CE 3.44Å; E56-K170 IonicContact OE1-NZ 2.72Å; E56-K170 PolarHBondContact OE1-NZ 3.29Å
57	V	59.3	Low	58.6	Low	11 Å²	11	87.4 Å²	87.4	7%	0.067	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.3	-177.9	160.7	0	0	0	0	109.4	R37 G38 E55 T59 E70	R37-V57 WeakPolarHBondContact CA-O 3.33Å; G38-V57 PolarHBondContact N-O 3.24Å; G38-V57 PolarHBondContact O-N 2.9Å; E55-V57 PolarHBondContact O-N 2.65Å; V57-T59 HydrophobicContact CG1-CG2 4.25Å; V57-E70 HydrophobicContact CB-CB 4.47Å; V57-E70 HydrophobicContact CG1-CB 3.96Å; V57-E70 WeakPolarHBondContact CG1-O 3.29Å; V57-E70 HydrophobicContact CG2-CB 4.43Å; V57-E70 WeakPolarHBondContact CG2-O 2.98Å
58	M	64.9	Low	60.5	Low	66 Å²	66	79.3 Å²	79.3	33%	0.325	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	129.4	169.4	-65.8	-116.5	-72.2	0	0	109.8	R37 L69	R37-M58 HydrophobicContact CG-CG 4.19Å; R37-M58 HydrophobicContact CG-SD 4.18Å; M58-L69 WeakPolarHBondContact O-CB 3.39Å; M58-L69 PolarHBondContact O-N 2.9Å
59	T	71.8	Confident	61.5	Low	13 Å²	13	75.4 Å²	75.4	8%	0.08	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143.6	175.5	59.9	0	0	0	0	109.1	Y35 S36 V57 C68	Y35-T59 WeakPolarHBondContact CA-O 3.32Å; S36-T59 PolarHBondContact N-O 3.45Å; S36-T59 PolarHBondContact O-N 2.94Å; S36-T59 PolarHBondContact O-OG1 2.94Å; V57-T59 HydrophobicContact CG1-CG2 4.25Å; T59-C68 HydrophobicContact CG2-CB 4.39Å
60	H	75.9	Confident	62.8	Low	16 Å²	16	72.5 Å²	72.5	7%	0.074	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.4	166.5	61.2	-78.1	0	0	0	109	D31 Y32 L34 Y35 T66 C67 L69	D31-H60 PolarHBondContact O-CD2 3.48Å; D31-H60 VanDerWaalsContact O-CD2 3.28Å; Y32-H60 HydrophobicContact CD1-CB 3.98Å; Y32-H60 AromaticContact CD1-CD2 3.7Å; Y32-H60 AromaticContact CD1-CG 3.9Å; Y32-H60 HydrophobicContact CE1-CB 4.33Å; Y32-H60 AromaticContact CE1-CD2 3.53Å; Y32-H60 AromaticContact CE1-CG 3.82Å; Y32-H60 AromaticContact CE1-NE2 3.71Å; Y32-H60 AromaticContact CZ-NE2 3.86Å; L34-H60 CarbonylContact O-C 2.98Å; L34-H60 WeakPolarHBondContact O-CA 3.33Å; Y35-H60 HydrophobicContact CD1-CB 4.03Å; Y35-H60 HydrophobicContact CE1-CB 3.9Å; H60-T66 WeakPolarHBondContact O-CA 3.37Å; H60-C67 WeakPolarHBondContact CE1-CB 3.4Å; H60-C67 PolarHBondContact N-O 2.94Å; H60-C67 PolarHBondContact ND1-O 3.18Å; H60-C67 VanDerWaalsContact NE2-CB 3.34Å; H60-C67 WeakPolarHBondContact NE2-CB 3.4Å; H60-C67 PolarHBondContact O-N 3.5Å; H60-L69 HydrophobicContact CB-CD1 3.96Å; H60-L69 VanDerWaalsContact ND1-CD1 3.31Å; H60-L69 WeakPolarHBondContact ND1-CD1 3.46Å; H60-L69 VanDerWaalsContact ND1-CG 3.28Å; H60-L69 WeakPolarHBondContact ND1-CG 3.38Å
61	S	73.3	Confident	64.1	Low	16 Å²	16	69.8 Å²	69.8	11%	0.112	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.1	177.2	-60.6	0	0	0	0	109	D31 W33 L34 T66	D31-S61 CarbonylContact O-C 3.59Å; D31-S61 VanDerWaalsContact O-O 3.09Å; W33-S61 WeakPolarHBondContact CB-O 3.46Å; W33-S61 PolarHBondContact N-O 3.46Å; W33-S61 VanDerWaalsContact N-O 3.1Å; L34-S61 PolarHBondContact N-O 2.95Å; L34-S61 VanDerWaalsContact N-O 3.1Å; L34-S61 PolarHBondContact O-N 2.92Å; S61-T66 VanDerWaalsContact OG-CG2 3.32Å; S61-T66 WeakPolarHBondContact OG-CG2 3.37Å; S61-T66 PolarHBondContact OG-OG1 2.84Å
62	G	77.8	Confident	64.9	Low	3 Å²	3	71.6 Å²	71.6	3%	0.031	35%	0.349	C	S	.	.			trans	-86	-162.5	166.4	0	0	0	0	0	112.3	D31 R65	D31-G62 WeakPolarHBondContact O-CA 3.44Å; D31-G62 PolarHBondContact O-N 2.87Å; G62-R65 WeakPolarHBondContact CA-O 3.34Å; G62-R65 PolarHBondContact N-O 3.4Å
63	L	71.4	Confident	66	Low	10 Å²	10	67 Å²	67	5%	0.052	33%	0.329	C	S	.	.	S	Bend	trans	-81.4	-28.5	171.8	-163.2	61.3	0	0	0	111.7	V28 W33 S105 P108 Y156	V28-L63 HydrophobicContact CG1-CD2 4.24Å; W33-L63 HydrophobicContact CZ2-CD2 4.38Å; L63-S105 VanDerWaalsContact CG-CB 3.46Å; L63-P108 HydrophobicContact CD2-CB 4.45Å; L63-Y156 HydrophobicContact CD1-CD2 4.19Å; L63-Y156 HydrophobicContact CD1-CE2 4.39Å
64	W	76.1	Confident	67.3	Low	92 Å²	92	66 Å²	66	35%	0.348	33%	0.325	S	S	.	.	S	Bend	trans	-118.4	-33.8	-171.5	-45.2	90.2	0	0	0	113.2	V28 I80 S105 I109	V28-W64 HydrophobicContact CG1-CZ2 4.28Å; V28-W64 PolarHBondContact O-NE1 3.5Å; W64-I80 PolarHBondContact O-N 3.25Å; W64-S105 VanDerWaalsContact CH2-OG 3.27Å; W64-S105 WeakPolarHBondContact CH2-OG 3.32Å; W64-S105 VanDerWaalsContact CZ2-OG 3.27Å; W64-S105 WeakPolarHBondContact CZ2-OG 3.11Å; W64-I109 HydrophobicContact CH2-CD1 3.47Å; W64-I109 VanDerWaalsContact CH2-CD1 3.47Å; W64-I109 HydrophobicContact CH2-CG1 4.16Å; W64-I109 HydrophobicContact CZ2-CD1 3.9Å; W64-I109 HydrophobicContact CZ2-CG1 4.09Å
65	R	76.4	Confident	68.5	Low	135 Å²	135	62.2 Å²	62.2	51%	0.509	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.9	-172.3	-62.4	176.6	178.3	-171.3	-1.2	109.9	G62 K78	G62-R65 WeakPolarHBondContact CA-O 3.34Å; G62-R65 PolarHBondContact N-O 3.4Å; R65-K78 WeakPolarHBondContact CA-O 3.46Å
66	T	77.4	Confident	69.6	Low	34 Å²	34	60.5 Å²	60.5	21%	0.209	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.3	169.9	-59.8	0	0	0	0	108.4	H60 S61 C77 K78 I80	H60-T66 WeakPolarHBondContact O-CA 3.37Å; S61-T66 VanDerWaalsContact OG-CG2 3.32Å; S61-T66 WeakPolarHBondContact OG-CG2 3.37Å; S61-T66 PolarHBondContact OG-OG1 2.84Å; T66-C77 CarbonylContact O-C 3.23Å; T66-C77 WeakPolarHBondContact O-CA 3.41Å; T66-K78 PolarHBondContact N-O 3.06Å; T66-K78 PolarHBondContact O-N 3.35Å; T66-I80 WeakPolarHBondContact OG1-CD1 3.4Å; T66-I80 VanDerWaalsContact OG1-CG1 3.27Å; T66-I80 WeakPolarHBondContact OG1-CG1 3.34Å
67	C	78.6	Confident	70.7	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.034	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.5	-177.4	-59.3	0	0	0	0	110.9	H60 L76 C77	H60-C67 WeakPolarHBondContact CE1-CB 3.4Å; H60-C67 PolarHBondContact N-O 2.94Å; H60-C67 PolarHBondContact ND1-O 3.18Å; H60-C67 VanDerWaalsContact NE2-CB 3.34Å; H60-C67 WeakPolarHBondContact NE2-CB 3.4Å; H60-C67 PolarHBondContact O-N 3.5Å; C67-L76 WeakPolarHBondContact CA-O 3.28Å; C67-C77 HydrophobicContact CB-CB 4.17Å; C67-C77 WeakPolarHBondContact CB-SG 3.36Å; C67-C77 WeakPolarHBondContact SG-CB 3.23Å; C67-C77 CovalentContact SG-SG 2.04Å; C67-C77 PolarHBondContact SG-SG 3.02Å
68	C	77.8	Confident	71.3	Confident	10 Å²	10	64.9 Å²	64.9	7%	0.068	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.2	-176.7	-61.6	0	0	0	0	111.2	C40 T59 G75 L76	C40-C68 HydrophobicContact CB-CB 3.93Å; C40-C68 WeakPolarHBondContact CB-SG 3.29Å; C40-C68 WeakPolarHBondContact SG-CB 3.28Å; C40-C68 CovalentContact SG-SG 2.03Å; C40-C68 PolarHBondContact SG-SG 3.34Å; T59-C68 HydrophobicContact CG2-CB 4.39Å; C68-G75 PolarHBondContact O-N 3.47Å; C68-L76 PolarHBondContact N-O 2.86Å; C68-L76 VanDerWaalsContact N-O 3.09Å
69	L	71.6	Confident	71.5	Confident	65 Å²	65	67.6 Å²	67.6	34%	0.34	35%	0.349	S	S	.	.			trans	-89.4	-26.1	-177.9	-76.5	147.6	0	0	0	112.8	Y35 M58 H60 K74	Y35-L69 HydrophobicContact CD1-CD1 4.17Å; Y35-L69 HydrophobicContact CE1-CD1 3.96Å; M58-L69 WeakPolarHBondContact O-CB 3.39Å; M58-L69 PolarHBondContact O-N 2.9Å; H60-L69 HydrophobicContact CB-CD1 3.96Å; H60-L69 VanDerWaalsContact ND1-CD1 3.31Å; H60-L69 WeakPolarHBondContact ND1-CD1 3.46Å; H60-L69 VanDerWaalsContact ND1-CG 3.28Å; H60-L69 WeakPolarHBondContact ND1-CG 3.38Å; L69-K74 WeakPolarHBondContact O-CG 3.23Å
70	E	63.6	Low	71.2	Confident	105 Å²	105	69 Å²	69	49%	0.491	36%	0.355	S	S	.	.	S	Bend	trans	-135.3	162.9	-168.5	-155.3	146.1	-152	0	0	112	V57	V57-E70 HydrophobicContact CB-CB 4.47Å; V57-E70 HydrophobicContact CG1-CB 3.96Å; V57-E70 WeakPolarHBondContact CG1-O 3.29Å; V57-E70 HydrophobicContact CG2-CB 4.43Å; V57-E70 WeakPolarHBondContact CG2-O 2.98Å
71	G	64.2	Low	70.1	Confident	32 Å²	32	73.3 Å²	73.3	33%	0.33	38%	0.379	S	S	.	.	S	Bend	trans	83.5	-175.7	-176.6	0	0	0	0	0	115.8	F73 K74	G71-F73 PolarHBondContact O-N 3.41Å; G71-K74 PolarHBondContact O-N 3.2Å
72	N	59	Low	69.2	Low	169 Å²	169	74.6 Å²	74.6	90%	0.904	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.9	-176.3	-98	15.5	0	0	0	114.8
73	F	60.8	Low	67.6	Low	78 Å²	78	81.9 Å²	81.9	34%	0.342	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	29.4	-175.1	-65.2	-62.7	0	0	0	112.6	T42 G71 G75 L76	T42-F73 HydrophobicContact CG2-CD1 3.92Å; T42-F73 HydrophobicContact CG2-CE1 3.73Å; T42-F73 HydrophobicContact CG2-CE2 4.37Å; T42-F73 HydrophobicContact CG2-CG 4.3Å; T42-F73 HydrophobicContact CG2-CZ 3.96Å; T42-F73 VanDerWaalsContact OG1-CZ 3.27Å; T42-F73 WeakPolarHBondContact OG1-CZ 3.35Å; G71-F73 PolarHBondContact O-N 3.41Å; F73-G75 PolarHBondContact O-N 2.81Å; F73-L76 HydrophobicContact CB-CD1 3.49Å; F73-L76 VanDerWaalsContact CB-CD1 3.49Å; F73-L76 HydrophobicContact CD1-CD1 3.37Å; F73-L76 HydrophobicContact CE1-CD1 4.45Å; F73-L76 HydrophobicContact CG-CD1 3.84Å; F73-L76 WeakPolarHBondContact O-CB 2.92Å; F73-L76 PolarHBondContact O-N 3.26Å; F73-L76 VanDerWaalsContact O-N 3.15Å
74	K	67.3	Low	66.6	Low	166 Å²	166	85.1 Å²	85.1	72%	0.722	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	125.8	177.8	-177.3	172.6	-177.6	177	0	111.4	L69 G71	L69-K74 WeakPolarHBondContact O-CG 3.23Å; G71-K74 PolarHBondContact O-N 3.2Å
75	G	68.7	Low	65.1	Low	59 Å²	59	89.6 Å²	89.6	61%	0.608	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	0	178.9	0	0	0	0	0	115.3	C68 F73 C77	C68-G75 PolarHBondContact O-N 3.47Å; F73-G75 PolarHBondContact O-N 2.81Å; G75-C77 PolarHBondContact O-N 3.12Å
76	L	73.5	Confident	63.5	Low	87 Å²	87	90.4 Å²	90.4	46%	0.455	48%	0.476	S	S	.	.			trans	-75.1	124.1	169.2	-85.2	140.2	0	0	0	110.3	C67 C68 F73	C67-L76 WeakPolarHBondContact CA-O 3.28Å; C68-L76 PolarHBondContact N-O 2.86Å; C68-L76 VanDerWaalsContact N-O 3.09Å; F73-L76 HydrophobicContact CB-CD1 3.49Å; F73-L76 VanDerWaalsContact CB-CD1 3.49Å; F73-L76 HydrophobicContact CD1-CD1 3.37Å; F73-L76 HydrophobicContact CE1-CD1 4.45Å; F73-L76 HydrophobicContact CG-CD1 3.84Å; F73-L76 WeakPolarHBondContact O-CB 2.92Å; F73-L76 PolarHBondContact O-N 3.26Å; F73-L76 VanDerWaalsContact O-N 3.15Å
77	C	75.1	Confident	62.1	Low	71 Å²	71	91.5 Å²	91.5	48%	0.48	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124	174.2	-65.7	0	0	0	0	109.1	T66 C67 G75	T66-C77 CarbonylContact O-C 3.23Å; T66-C77 WeakPolarHBondContact O-CA 3.41Å; C67-C77 HydrophobicContact CB-CB 4.17Å; C67-C77 WeakPolarHBondContact CB-SG 3.36Å; C67-C77 WeakPolarHBondContact SG-CB 3.23Å; C67-C77 CovalentContact SG-SG 2.04Å; C67-C77 PolarHBondContact SG-SG 3.02Å; G75-C77 PolarHBondContact O-N 3.12Å
78	K	72.1	Confident	60.4	Low	131 Å²	131	98.6 Å²	98.6	57%	0.57	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.4	174.5	-161.2	-171.7	170.8	-160.1	0	109.1	R65 T66 D81	R65-K78 WeakPolarHBondContact CA-O 3.46Å; T66-K78 PolarHBondContact N-O 3.06Å; T66-K78 PolarHBondContact O-N 3.35Å; K78-D81 VanDerWaalsContact CE-OD2 3.27Å; K78-D81 WeakPolarHBondContact CE-OD2 3.48Å; K78-D81 IonicContact NZ-OD2 2.66Å; K78-D81 PolarHBondContact NZ-OD2 3.36Å
79	Q	69.9	Low	59	Low	122 Å²	122	108.8 Å²	108.8	57%	0.57	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66	136.6	168.6	-170.4	144.4	2.6	0	0	108.8	D81	Q79-D81 PolarHBondContact O-N 3.08Å; Q79-D81 VanDerWaalsContact O-N 3.1Å
80	I	64.8	Low	57.8	Low	42 Å²	42	114.9 Å²	114.9	22%	0.215	59%	0.591	C	S	.	*			trans	-70.6	110.2	-178.5	-59.6	170.9	0	0	0	107.7	W64 T66 H82	W64-I80 PolarHBondContact O-N 3.25Å; T66-I80 WeakPolarHBondContact OG1-CD1 3.4Å; T66-I80 VanDerWaalsContact OG1-CG1 3.27Å; T66-I80 WeakPolarHBondContact OG1-CG1 3.34Å; I80-H82 PolarHBondContact O-N 2.89Å; I80-H82 VanDerWaalsContact O-N 3.13Å; I80-H82 PolarHBondContact O-ND1 3.39Å
81	D	53.4	Low	57.2	Low	107 Å²	107	111 Å²	111	57%	0.572	58%	0.576	S	S	*	*			trans	-72.2	102.3	170.2	-65.3	-39.2	0	0	0	107.4	K78 Q79 F83	K78-D81 VanDerWaalsContact CE-OD2 3.27Å; K78-D81 WeakPolarHBondContact CE-OD2 3.48Å; K78-D81 IonicContact NZ-OD2 2.66Å; K78-D81 PolarHBondContact NZ-OD2 3.36Å; Q79-D81 PolarHBondContact O-N 3.08Å; Q79-D81 VanDerWaalsContact O-N 3.1Å; D81-F83 PolarHBondContact O-N 3.42Å
82	H	54.8	Low	57	Low	43 Å²	43	115.8 Å²	115.8	20%	0.199	59%	0.594	C	S	.	*	S	Bend	trans	-76.2	-2.8	-174.4	-78.5	80.7	0	0	0	114	I80 A103	I80-H82 PolarHBondContact O-N 2.89Å; I80-H82 VanDerWaalsContact O-N 3.13Å; I80-H82 PolarHBondContact O-ND1 3.39Å; H82-A103 HydrophobicContact CB-CB 3.68Å; H82-A103 WeakPolarHBondContact CD2-CA 3.24Å; H82-A103 WeakPolarHBondContact CD2-CB 3.34Å; H82-A103 VanDerWaalsContact NE2-CA 3.33Å; H82-A103 WeakPolarHBondContact NE2-CA 3.41Å
83	F	43.1	Very low	57.1	Low	157 Å²	157	113.7 Å²	113.7	69%	0.689	59%	0.588	S	S	*	*			trans	-119.9	98.1	173.5	-84.5	-92	0	0	0	108.6	D81 E85	D81-F83 PolarHBondContact O-N 3.42Å; F83-E85 PolarHBondContact O-N 3.49Å
84	P	50	Low	56.9	Low	78 Å²	78	112.7 Å²	112.7	51%	0.506	59%	0.594	S	S	.	*			trans	-70.2	111.1	155.3	29.1	-26.9	0	0	0	106.5	D86	P84-D86 PolarHBondContact O-N 3.35Å; P84-D86 VanDerWaalsContact O-N 3.07Å
85	E	45.7	Very low	56.7	Low	185 Å²	185	108.5 Å²	108.5	86%	0.864	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	1	-177.9	-158.7	156.9	176.4	0	0	113.4	F83	F83-E85 PolarHBondContact O-N 3.49Å
86	D	42.6	Very low	56.3	Low	153 Å²	153	110 Å²	110	82%	0.818	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.6	20.3	-171.4	-54.3	-44.7	0	0	0	114.1	P84	P84-D86 PolarHBondContact O-N 3.35Å; P84-D86 VanDerWaalsContact O-N 3.07Å
87	A	48.3	Very low	55.7	Low	56 Å²	56	112.4 Å²	112.4	46%	0.463	57%	0.572	S	S	.	*	S	Bend	trans	-103.8	113.8	172.4	0	0	0	0	0	109.9
88	D	43	Very low	55.1	Low	154 Å²	154	112.1 Å²	112.1	82%	0.824	57%	0.565	S	S	*	*			trans	-48.8	149.6	-171.8	-63.3	-57.2	0	0	0	114.9	E90	D88-E90 PolarHBondContact O-N 2.99Å
89	Y	47.7	Very low	54.5	Low	225 Å²	225	109.6 Å²	109.6	88%	0.882	55%	0.552	S	S	*	*	S	Bend	trans	-66.3	52.4	-165.5	-133.3	-94.9	0	0	0	114.8
90	E	46.8	Very low	53.9	Low	193 Å²	193	106.1 Å²	106.1	90%	0.902	55%	0.545	S	S	*	.			trans	-149.1	56.6	168.4	-78.7	-140	165	0	0	112.2	D88	D88-E90 PolarHBondContact O-N 2.99Å
91	A	50.6	Low	53.7	Low	22 Å²	22	105 Å²	105	18%	0.182	54%	0.539	C	S	.	.			trans	-95.4	124.8	162.1	0	0	0	0	0	108.6	T93 E95 Y96	A91-T93 PolarHBondContact O-N 3.18Å; A91-E95 HydrophobicContact CB-CB 4.25Å; A91-Y96 HydrophobicContact CB-CD2 3.76Å; A91-Y96 HydrophobicContact CB-CE2 3.3Å; A91-Y96 VanDerWaalsContact O-CD2 3.23Å; A91-Y96 WeakPolarHBondContact O-CD2 3.41Å; A91-Y96 WeakPolarHBondContact O-CE2 3.5Å
92	D	60.3	Low	54	Low	134 Å²	134	102.8 Å²	102.8	72%	0.717	52%	0.523	S	S	*	.			trans	-51.2	138.8	172.9	-84.4	-42.7	0	0	0	109.1	A94 E95 Y96	D92-A94 CarbonylContact O-C 3.57Å; D92-A94 PolarHBondContact O-N 3.43Å; D92-E95 PolarHBondContact O-N 3.36Å; D92-Y96 PolarHBondContact O-N 3.44Å
93	T	59.8	Low	54	Low	124 Å²	124	102.3 Å²	102.3	76%	0.761	53%	0.527	S	S	*	.	H	α-helix	trans	-47.1	-25.6	178.4	51.1	0	0	0	0	113.7	A91 F97	A91-T93 PolarHBondContact O-N 3.18Å; T93-F97 VanDerWaalsContact O-CB 3.3Å; T93-F97 WeakPolarHBondContact O-CB 3.24Å; T93-F97 PolarHBondContact O-N 3.4Å
94	A	58.4	Low	54.8	Low	58 Å²	58	96.7 Å²	96.7	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-66.5	-39.3	172	0	0	0	0	0	114.4	D92 F97 L98	D92-A94 CarbonylContact O-C 3.57Å; D92-A94 PolarHBondContact O-N 3.43Å; A94-F97 PolarHBondContact O-N 3.12Å; A94-L98 WeakPolarHBondContact O-CB 3.39Å; A94-L98 VanDerWaalsContact O-CG 3.26Å; A94-L98 WeakPolarHBondContact O-CG 3.17Å; A94-L98 PolarHBondContact O-N 3.25Å
95	E	62.3	Low	55.9	Low	77 Å²	77	93.1 Å²	93.1	36%	0.36	48%	0.484	S	S	.	.	H	α-helix	trans	-71.1	-39.6	177.1	-165.5	-178	165.6	0	0	111	A91 D92 L98 R99	A91-E95 HydrophobicContact CB-CB 4.25Å; D92-E95 PolarHBondContact O-N 3.36Å; E95-L98 PolarHBondContact O-N 3.4Å; E95-R99 WeakPolarHBondContact O-CB 3.49Å; E95-R99 WeakPolarHBondContact O-CG 3.3Å; E95-R99 PolarHBondContact O-N 2.91Å; E95-R99 IonicContact OE1-CZ 3.01Å; E95-R99 IonicContact OE1-NE 2.71Å; E95-R99 IonicContact OE1-NH2 3.97Å; E95-R99 PolarHBondContact OE1-NH2 2.92Å
96	Y	60.1	Low	57.7	Low	91 Å²	91	88.2 Å²	88.2	36%	0.357	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-42.7	170.1	-76.5	-72.3	0	0	0	112.2	A91 D92 R99 A100	A91-Y96 HydrophobicContact CB-CD2 3.76Å; A91-Y96 HydrophobicContact CB-CE2 3.3Å; A91-Y96 VanDerWaalsContact O-CD2 3.23Å; A91-Y96 WeakPolarHBondContact O-CD2 3.41Å; A91-Y96 WeakPolarHBondContact O-CE2 3.5Å; D92-Y96 PolarHBondContact O-N 3.44Å; Y96-R99 PolarHBondContact O-N 2.87Å; Y96-A100 WeakPolarHBondContact O-CB 3.37Å; Y96-A100 PolarHBondContact O-N 3.38Å
97	F	60.1	Low	59.9	Low	138 Å²	138	84.1 Å²	84.1	61%	0.605	44%	0.438	S	S	*	.	H	α-helix	trans	-63.7	-45.2	176.7	-175.2	-101.9	0	0	0	111.7	T93 A94 R99 A100 V101	T93-F97 VanDerWaalsContact O-CB 3.3Å; T93-F97 WeakPolarHBondContact O-CB 3.24Å; T93-F97 PolarHBondContact O-N 3.4Å; A94-F97 PolarHBondContact O-N 3.12Å; F97-R99 VanDerWaalsContact C-N 3.35Å; F97-R99 PolarHBondContact O-N 2.65Å; F97-A100 PolarHBondContact O-N 3.32Å; F97-V101 HydrophobicContact CD1-CG2 4.05Å; F97-V101 HydrophobicContact CD2-CG2 4.46Å; F97-V101 HydrophobicContact CE1-CG2 3.74Å; F97-V101 HydrophobicContact CE2-CG2 4.17Å; F97-V101 HydrophobicContact CG-CG2 4.4Å; F97-V101 HydrophobicContact CZ-CG2 3.8Å; F97-V101 WeakPolarHBondContact O-CB 3.31Å; F97-V101 WeakPolarHBondContact O-CG2 3.41Å; F97-V101 PolarHBondContact O-N 2.78Å
98	L	62.5	Low	61.7	Low	65 Å²	65	81.8 Å²	81.8	34%	0.34	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-38.6	176.9	-73.4	169.7	0	0	0	112.3	A94 E95 R102 V155	A94-L98 WeakPolarHBondContact O-CB 3.39Å; A94-L98 VanDerWaalsContact O-CG 3.26Å; A94-L98 WeakPolarHBondContact O-CG 3.17Å; A94-L98 PolarHBondContact O-N 3.25Å; E95-L98 PolarHBondContact O-N 3.4Å; L98-R102 WeakPolarHBondContact O-CB 3.28Å; L98-R102 PolarHBondContact O-N 2.95Å; L98-V155 HydrophobicContact CD2-CG1 4.22Å
99	R	60.3	Low	63.9	Low	77 Å²	77	77.1 Å²	77.1	29%	0.291	39%	0.392	S	S	.	.	H	α-helix	trans	-66.3	-40.5	173.7	-73.9	179.8	-174.1	-174.8	5.1	112.3	E95 Y96 F97 R102 A103	E95-R99 WeakPolarHBondContact O-CB 3.49Å; E95-R99 WeakPolarHBondContact O-CG 3.3Å; E95-R99 PolarHBondContact O-N 2.91Å; E95-R99 IonicContact OE1-CZ 3.01Å; E95-R99 IonicContact OE1-NE 2.71Å; E95-R99 IonicContact OE1-NH2 3.97Å; E95-R99 PolarHBondContact OE1-NH2 2.92Å; Y96-R99 PolarHBondContact O-N 2.87Å; F97-R99 VanDerWaalsContact C-N 3.35Å; F97-R99 PolarHBondContact O-N 2.65Å; R99-R102 PolarHBondContact O-N 3Å; R99-A103 WeakPolarHBondContact O-CB 3.46Å; R99-A103 PolarHBondContact O-N 3.44Å
100	A	56.7	Low	66	Low	50 Å²	50	70.1 Å²	70.1	41%	0.413	37%	0.37	S	S	.	.	H	α-helix	trans	-68.5	-38.8	177	0	0	0	0	0	112.8	Y96 F97 A103 S104	Y96-A100 WeakPolarHBondContact O-CB 3.37Å; Y96-A100 PolarHBondContact O-N 3.38Å; F97-A100 PolarHBondContact O-N 3.32Å; A100-A103 PolarHBondContact O-N 3.17Å; A100-S104 WeakPolarHBondContact O-CB 3.3Å; A100-S104 PolarHBondContact O-N 3.05Å; A100-S104 PolarHBondContact O-OG 3.25Å
101	V	60.5	Low	68.2	Low	17 Å²	17	61 Å²	61	10%	0.103	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-37.1	176.3	171.5	0	0	0	0	111.3	F97 S104 S105 F107 V155	F97-V101 HydrophobicContact CD1-CG2 4.05Å; F97-V101 HydrophobicContact CD2-CG2 4.46Å; F97-V101 HydrophobicContact CE1-CG2 3.74Å; F97-V101 HydrophobicContact CE2-CG2 4.17Å; F97-V101 HydrophobicContact CG-CG2 4.4Å; F97-V101 HydrophobicContact CZ-CG2 3.8Å; F97-V101 WeakPolarHBondContact O-CB 3.31Å; F97-V101 WeakPolarHBondContact O-CG2 3.41Å; F97-V101 PolarHBondContact O-N 2.78Å; V101-S104 PolarHBondContact O-OG 3.11Å; V101-S105 PolarHBondContact O-N 2.88Å; V101-S105 VanDerWaalsContact O-N 3.15Å; V101-F107 HydrophobicContact CG1-CD2 3.55Å; V101-F107 HydrophobicContact CG1-CE2 3.39Å; V101-F107 HydrophobicContact CG2-CE2 4.48Å; V101-V155 HydrophobicContact CB-CG1 4.37Å; V101-V155 HydrophobicContact CG1-CG1 3.73Å
102	R	60.5	Low	70.3	Confident	61 Å²	61	61.2 Å²	61.2	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-47.3	171	178.4	-176.1	176.4	161.2	6.9	111.9	L98 R99 S104 S105 A159 N160	L98-R102 WeakPolarHBondContact O-CB 3.28Å; L98-R102 PolarHBondContact O-N 2.95Å; R99-R102 PolarHBondContact O-N 3Å; R102-S104 VanDerWaalsContact C-N 3.26Å; R102-S104 PolarHBondContact O-N 3.38Å; R102-S105 PolarHBondContact O-N 3.21Å; R102-A159 HydrophobicContact CB-CB 4.44Å; R102-A159 PolarHBondContact NH1-O 3.13Å; R102-A159 VanDerWaalsContact NH1-O 3.13Å; R102-N160 PolarHBondContact NH1-OD1 2.85Å; R102-N160 VanDerWaalsContact NH1-OD1 3.07Å; R102-N160 PolarHBondContact NH2-OD1 3.35Å
103	A	55.2	Low	71.9	Confident	34 Å²	34	59 Å²	59	28%	0.281	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-36.4	-178.1	0	0	0	0	0	113.6	H82 R99 A100	H82-A103 HydrophobicContact CB-CB 3.68Å; H82-A103 WeakPolarHBondContact CD2-CA 3.24Å; H82-A103 WeakPolarHBondContact CD2-CB 3.34Å; H82-A103 VanDerWaalsContact NE2-CA 3.33Å; H82-A103 WeakPolarHBondContact NE2-CA 3.41Å; R99-A103 WeakPolarHBondContact O-CB 3.46Å; R99-A103 PolarHBondContact O-N 3.44Å; A100-A103 PolarHBondContact O-N 3.17Å
104	S	59.5	Low	73.6	Confident	39 Å²	39	55.3 Å²	55.3	27%	0.273	29%	0.289	S	S	.	.	H	α-helix	trans	-90.7	-15.9	-175.3	60.3	0	0	0	0	112.2	A100 V101 R102 I106 I109	A100-S104 WeakPolarHBondContact O-CB 3.3Å; A100-S104 PolarHBondContact O-N 3.05Å; A100-S104 PolarHBondContact O-OG 3.25Å; V101-S104 PolarHBondContact O-OG 3.11Å; R102-S104 VanDerWaalsContact C-N 3.26Å; R102-S104 PolarHBondContact O-N 3.38Å; S104-I106 VanDerWaalsContact CB-CG1 3.49Å; S104-I106 PolarHBondContact O-N 3.43Å; S104-I106 WeakPolarHBondContact OG-CD1 3.38Å; S104-I106 VanDerWaalsContact OG-CG1 3.25Å; S104-I106 WeakPolarHBondContact OG-CG1 3.29Å; S104-I109 VanDerWaalsContact O-CD1 3.24Å; S104-I109 WeakPolarHBondContact O-CD1 3.37Å
105	S	73.3	Confident	75.3	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.021	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.8	32.7	-176.9	59	0	0	0	0	113.8	L63 W64 V101 R102 F107 P108 I109	L63-S105 VanDerWaalsContact CG-CB 3.46Å; W64-S105 VanDerWaalsContact CH2-OG 3.27Å; W64-S105 WeakPolarHBondContact CH2-OG 3.32Å; W64-S105 VanDerWaalsContact CZ2-OG 3.27Å; W64-S105 WeakPolarHBondContact CZ2-OG 3.11Å; V101-S105 PolarHBondContact O-N 2.88Å; V101-S105 VanDerWaalsContact O-N 3.15Å; R102-S105 PolarHBondContact O-N 3.21Å; S105-F107 VanDerWaalsContact C-N 3.28Å; S105-F107 PolarHBondContact O-N 3.47Å; S105-P108 VanDerWaalsContact O-CD 3.25Å; S105-P108 WeakPolarHBondContact O-CD 3.42Å; S105-I109 WeakPolarHBondContact O-CD1 3.44Å; S105-I109 WeakPolarHBondContact O-CG1 3.23Å; S105-I109 PolarHBondContact O-N 3.19Å; S105-I109 WeakPolarHBondContact OG-CD1 3.45Å
106	I	83.8	Confident	76.9	Confident	82 Å²	82	54 Å²	54	42%	0.421	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-41.8	-170	-71.3	163.7	0	0	0	110.2	S104 I109 L110	S104-I106 VanDerWaalsContact CB-CG1 3.49Å; S104-I106 PolarHBondContact O-N 3.43Å; S104-I106 WeakPolarHBondContact OG-CD1 3.38Å; S104-I106 VanDerWaalsContact OG-CG1 3.25Å; S104-I106 WeakPolarHBondContact OG-CG1 3.29Å; I106-I109 PolarHBondContact O-N 3.37Å; I106-L110 HydrophobicContact CG2-CD1 3.57Å; I106-L110 HydrophobicContact CG2-CG 3.92Å; I106-L110 VanDerWaalsContact O-CB 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.36Å; I106-L110 WeakPolarHBondContact O-CG 3.41Å; I106-L110 PolarHBondContact O-N 2.94Å
107	F	87.8	Confident	78.5	Confident	67 Å²	67	53.8 Å²	53.8	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-65.1	-50.7	-177.5	-63.4	-60.2	0	0	0	113.2	V101 S105 I109 L110 S111 I151	V101-F107 HydrophobicContact CG1-CD2 3.55Å; V101-F107 HydrophobicContact CG1-CE2 3.39Å; V101-F107 HydrophobicContact CG2-CE2 4.48Å; S105-F107 VanDerWaalsContact C-N 3.28Å; S105-F107 PolarHBondContact O-N 3.47Å; F107-I109 PolarHBondContact O-N 3.41Å; F107-L110 PolarHBondContact O-N 2.86Å; F107-S111 PolarHBondContact O-N 2.85Å; F107-I151 HydrophobicContact CD1-CG2 4.43Å; F107-I151 HydrophobicContact CD2-CG2 4.12Å; F107-I151 HydrophobicContact CE2-CG2 4.28Å; F107-I151 HydrophobicContact CG-CG2 4.2Å
108	P	87.4	Confident	80.1	Confident	7 Å²	7	47.2 Å²	47.2	5%	0.045	25%	0.246	C	C	.	.	H	α-helix	trans	-58.1	-40.5	170.2	-27.8	34.6	0	0	0	114.1	V28 L63 S105 S111 V112	V28-P108 HydrophobicContact CG2-CB 4.19Å; L63-P108 HydrophobicContact CD2-CB 4.45Å; S105-P108 VanDerWaalsContact O-CD 3.25Å; S105-P108 WeakPolarHBondContact O-CD 3.42Å; P108-S111 WeakPolarHBondContact CA-OG 3.42Å; P108-S111 WeakPolarHBondContact O-CB 3.44Å; P108-S111 PolarHBondContact O-N 3.26Å; P108-S111 PolarHBondContact O-OG 2.9Å; P108-V112 WeakPolarHBondContact O-CG2 3.39Å; P108-V112 PolarHBondContact O-N 3.46Å; P108-V112 VanDerWaalsContact O-N 3.08Å
109	I	89.2	Confident	81.6	Confident	55 Å²	55	45.4 Å²	45.4	28%	0.282	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-47	178.8	-62.4	160.9	0	0	0	111.1	W64 S104 S105 I106 F107 S111 V112 I113	W64-I109 HydrophobicContact CH2-CD1 3.47Å; W64-I109 VanDerWaalsContact CH2-CD1 3.47Å; W64-I109 HydrophobicContact CH2-CG1 4.16Å; W64-I109 HydrophobicContact CZ2-CD1 3.9Å; W64-I109 HydrophobicContact CZ2-CG1 4.09Å; S104-I109 VanDerWaalsContact O-CD1 3.24Å; S104-I109 WeakPolarHBondContact O-CD1 3.37Å; S105-I109 WeakPolarHBondContact O-CD1 3.44Å; S105-I109 WeakPolarHBondContact O-CG1 3.23Å; S105-I109 PolarHBondContact O-N 3.19Å; S105-I109 WeakPolarHBondContact OG-CD1 3.45Å; I106-I109 PolarHBondContact O-N 3.37Å; F107-I109 PolarHBondContact O-N 3.41Å; I109-S111 PolarHBondContact O-N 2.9Å; I109-V112 PolarHBondContact O-N 3.06Å; I109-V112 VanDerWaalsContact O-N 3.13Å; I109-I113 HydrophobicContact CG2-CD1 4.02Å; I109-I113 WeakPolarHBondContact O-CG1 3.36Å; I109-I113 PolarHBondContact O-N 2.9Å
110	L	90.7	Very high	83.1	Confident	79 Å²	79	45.7 Å²	45.7	41%	0.414	25%	0.25	S	C	.	.	H	α-helix	trans	-58.9	-38.1	175.8	-72.1	178.9	0	0	0	110.7	I106 F107 V112 I113 L114	I106-L110 HydrophobicContact CG2-CD1 3.57Å; I106-L110 HydrophobicContact CG2-CG 3.92Å; I106-L110 VanDerWaalsContact O-CB 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.36Å; I106-L110 WeakPolarHBondContact O-CG 3.41Å; I106-L110 PolarHBondContact O-N 2.94Å; F107-L110 PolarHBondContact O-N 2.86Å; L110-V112 PolarHBondContact O-N 3.23Å; L110-I113 PolarHBondContact O-N 3.39Å; L110-L114 WeakPolarHBondContact O-CB 3.31Å; L110-L114 VanDerWaalsContact O-CG 3.26Å; L110-L114 WeakPolarHBondContact O-CG 3.1Å; L110-L114 PolarHBondContact O-N 3.36Å
111	S	93.3	Very high	84.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-41.1	175.9	79.5	0	0	0	0	112.5	M24 F107 P108 I109 I113 L114 L115 A145 S148	M24-S111 WeakPolarHBondContact CE-OG 3.37Å; F107-S111 PolarHBondContact O-N 2.85Å; P108-S111 WeakPolarHBondContact CA-OG 3.42Å; P108-S111 WeakPolarHBondContact O-CB 3.44Å; P108-S111 PolarHBondContact O-N 3.26Å; P108-S111 PolarHBondContact O-OG 2.9Å; I109-S111 PolarHBondContact O-N 2.9Å; S111-I113 PolarHBondContact O-N 2.85Å; S111-L114 PolarHBondContact O-N 3.01Å; S111-L115 WeakPolarHBondContact O-CB 3.48Å; S111-L115 VanDerWaalsContact O-CG 3.29Å; S111-L115 WeakPolarHBondContact O-CG 3.16Å; S111-L115 PolarHBondContact O-N 3.42Å; S111-A145 WeakPolarHBondContact CB-O 3.31Å; S111-S148 WeakPolarHBondContact CB-OG 3.43Å
112	V	93.8	Very high	86.3	Confident	27 Å²	27	44.3 Å²	44.3	16%	0.164	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-43.5	175	175.8	0	0	0	0	111	F21 M24 V28 P108 I109 L110 L115 F116	F21-V112 HydrophobicContact CD2-CG1 4.45Å; F21-V112 HydrophobicContact CE2-CG1 3.79Å; M24-V112 HydrophobicContact CB-CG2 4.4Å; M24-V112 HydrophobicContact CG-CG2 3.34Å; V28-V112 HydrophobicContact CG2-CG2 4.06Å; P108-V112 WeakPolarHBondContact O-CG2 3.39Å; P108-V112 PolarHBondContact O-N 3.46Å; P108-V112 VanDerWaalsContact O-N 3.08Å; I109-V112 PolarHBondContact O-N 3.06Å; I109-V112 VanDerWaalsContact O-N 3.13Å; L110-V112 PolarHBondContact O-N 3.23Å; V112-L115 PolarHBondContact O-N 3.43Å; V112-F116 WeakPolarHBondContact O-CB 3.15Å; V112-F116 PolarHBondContact O-N 2.93Å
113	I	94.4	Very high	87.7	Confident	89 Å²	89	43.2 Å²	43.2	46%	0.456	24%	0.24	S	C	.	.	H	α-helix	trans	-64.3	-44	178.7	-64.2	167.8	0	0	0	110.5	I109 L110 S111 F116 M117	I109-I113 HydrophobicContact CG2-CD1 4.02Å; I109-I113 WeakPolarHBondContact O-CG1 3.36Å; I109-I113 PolarHBondContact O-N 2.9Å; L110-I113 PolarHBondContact O-N 3.39Å; S111-I113 PolarHBondContact O-N 2.85Å; I113-F116 WeakPolarHBondContact O-CB 3.35Å; I113-F116 PolarHBondContact O-N 2.87Å; I113-M117 WeakPolarHBondContact O-CG 3.36Å; I113-M117 PolarHBondContact O-N 2.82Å
114	L	94.7	Very high	89.3	Confident	46 Å²	46	43.3 Å²	43.3	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-39.2	177.4	-70.1	172.1	0	0	0	112	L110 S111 F116 M117 G118 F141 A145	L110-L114 WeakPolarHBondContact O-CB 3.31Å; L110-L114 VanDerWaalsContact O-CG 3.26Å; L110-L114 WeakPolarHBondContact O-CG 3.1Å; L110-L114 PolarHBondContact O-N 3.36Å; S111-L114 PolarHBondContact O-N 3.01Å; L114-F116 VanDerWaalsContact C-N 3.34Å; L114-M117 PolarHBondContact O-N 3.46Å; L114-G118 PolarHBondContact O-N 3.32Å; L114-F141 HydrophobicContact CD2-CD1 4.28Å; L114-A145 HydrophobicContact CB-CB 3.59Å
115	L	94.9	Very high	90.6	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-42.4	172.2	-74.3	175.7	0	0	0	111.3	F21 M24 S111 V112 G118 G119 F142 A145 A190	F21-L115 HydrophobicContact CD2-CB 4.19Å; M24-L115 HydrophobicContact CB-CD1 3.92Å; M24-L115 HydrophobicContact CE-CD1 4.13Å; M24-L115 HydrophobicContact CG-CD1 4.16Å; S111-L115 WeakPolarHBondContact O-CB 3.48Å; S111-L115 VanDerWaalsContact O-CG 3.29Å; S111-L115 WeakPolarHBondContact O-CG 3.16Å; S111-L115 PolarHBondContact O-N 3.42Å; V112-L115 PolarHBondContact O-N 3.43Å; L115-G118 PolarHBondContact O-N 3.47Å; L115-G119 PolarHBondContact O-N 3.25Å; L115-F142 HydrophobicContact CD2-CD2 3.75Å; L115-F142 HydrophobicContact CD2-CE1 4.28Å; L115-F142 HydrophobicContact CD2-CE2 3.37Å; L115-F142 HydrophobicContact CD2-CG 4.32Å; L115-F142 HydrophobicContact CD2-CZ 3.66Å; L115-A145 HydrophobicContact CD2-CB 3.74Å; L115-A145 HydrophobicContact CG-CB 3.75Å; L115-A190 HydrophobicContact CD2-CB 4.07Å
116	F	95.4	Very high	91.1	Very high	105 Å²	105	47.4 Å²	47.4	46%	0.461	26%	0.258	S	S	.	.	H	α-helix	trans	-63.4	-48.3	177	-177.8	-108.9	0	0	0	111.6	F21 V112 I113 L114 G118 G119 L120	F21-F116 HydrophobicContact CD2-CB 4.33Å; F21-F116 HydrophobicContact CE2-CB 3.83Å; F21-F116 HydrophobicContact CE2-CD2 4.12Å; F21-F116 HydrophobicContact CE2-CG 4.42Å; F21-F116 HydrophobicContact CZ-CD2 4.04Å; V112-F116 WeakPolarHBondContact O-CB 3.15Å; V112-F116 PolarHBondContact O-N 2.93Å; I113-F116 WeakPolarHBondContact O-CB 3.35Å; I113-F116 PolarHBondContact O-N 2.87Å; L114-F116 VanDerWaalsContact C-N 3.34Å; F116-G118 VanDerWaalsContact C-N 3.32Å; F116-G118 PolarHBondContact O-N 3.14Å; F116-G119 PolarHBondContact O-N 2.9Å; F116-L120 HydrophobicContact CD1-CD1 3.92Å; F116-L120 HydrophobicContact CD1-CG 4.43Å; F116-L120 HydrophobicContact CE1-CD1 3.44Å; F116-L120 VanDerWaalsContact CE1-CD1 3.44Å; F116-L120 HydrophobicContact CE1-CG 4.12Å; F116-L120 HydrophobicContact CE2-CG 4.47Å; F116-L120 HydrophobicContact CZ-CD1 3.83Å; F116-L120 HydrophobicContact CZ-CD2 4.26Å; F116-L120 HydrophobicContact CZ-CG 4.13Å; F116-L120 WeakPolarHBondContact O-CG 3.31Å; F116-L120 PolarHBondContact O-N 3.47Å
117	M	94.6	Very high	91.1	Very high	86 Å²	86	51.7 Å²	51.7	42%	0.424	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-38.7	176.3	-70.2	-59.3	-66.7	0	0	112.1	I113 L114 L120 C121	I113-M117 WeakPolarHBondContact O-CG 3.36Å; I113-M117 PolarHBondContact O-N 2.82Å; L114-M117 PolarHBondContact O-N 3.46Å; M117-L120 PolarHBondContact O-N 3.19Å; M117-L120 HydrophobicContact SD-CD1 4.2Å; M117-C121 WeakPolarHBondContact O-CB 3.34Å; M117-C121 PolarHBondContact O-N 3.41Å; M117-C121 PolarHBondContact O-SG 2.84Å
118	G	94.3	Very high	90.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-46.1	173.1	0	0	0	0	0	112.1	L114 L115 F116 C121 I122	L114-G118 PolarHBondContact O-N 3.32Å; L115-G118 PolarHBondContact O-N 3.47Å; F116-G118 VanDerWaalsContact C-N 3.32Å; F116-G118 PolarHBondContact O-N 3.14Å; G118-C121 WeakPolarHBondContact O-CB 3.32Å; G118-C121 PolarHBondContact O-N 3.47Å; G118-C121 VanDerWaalsContact O-N 3.17Å; G118-I122 WeakPolarHBondContact O-CG1 3.41Å; G118-I122 PolarHBondContact O-N 3.49Å
119	G	93	Very high	90	Very high	26 Å²	26	62.5 Å²	62.5	27%	0.268	32%	0.317	S	S	.	.	H	α-helix	trans	-61.3	-43.7	175.1	0	0	0	0	0	113	L115 F116 C121 I122 A123	L115-G119 PolarHBondContact O-N 3.25Å; F116-G119 PolarHBondContact O-N 2.9Å; G119-C121 VanDerWaalsContact C-N 3.29Å; G119-C121 PolarHBondContact O-N 3.34Å; G119-I122 PolarHBondContact O-N 3.36Å; G119-A123 PolarHBondContact O-N 2.96Å
120	L	92.7	Very high	88.9	Confident	84 Å²	84	65.3 Å²	65.3	44%	0.44	34%	0.337	S	S	.	.	H	α-helix	trans	-60.7	-39.6	172.9	-72.2	-179.4	0	0	0	111.8	F116 M117 A123 A124	F116-L120 HydrophobicContact CD1-CD1 3.92Å; F116-L120 HydrophobicContact CD1-CG 4.43Å; F116-L120 HydrophobicContact CE1-CD1 3.44Å; F116-L120 VanDerWaalsContact CE1-CD1 3.44Å; F116-L120 HydrophobicContact CE1-CG 4.12Å; F116-L120 HydrophobicContact CE2-CG 4.47Å; F116-L120 HydrophobicContact CZ-CD1 3.83Å; F116-L120 HydrophobicContact CZ-CD2 4.26Å; F116-L120 HydrophobicContact CZ-CG 4.13Å; F116-L120 WeakPolarHBondContact O-CG 3.31Å; F116-L120 PolarHBondContact O-N 3.47Å; M117-L120 PolarHBondContact O-N 3.19Å; M117-L120 HydrophobicContact SD-CD1 4.2Å; L120-A123 PolarHBondContact O-N 3.44Å; L120-A124 VanDerWaalsContact O-CB 3.23Å; L120-A124 WeakPolarHBondContact O-CB 3.4Å; L120-A124 PolarHBondContact O-N 3.24Å
121	C	92.4	Very high	88.3	Confident	23 Å²	23	69.8 Å²	69.8	16%	0.155	35%	0.348	C	S	.	.	H	α-helix	trans	-66.7	-37.1	175.9	-69.4	0	0	0	0	112	M117 G118 G119 S125 I134 A138	M117-C121 WeakPolarHBondContact O-CB 3.34Å; M117-C121 PolarHBondContact O-N 3.41Å; M117-C121 PolarHBondContact O-SG 2.84Å; G118-C121 WeakPolarHBondContact O-CB 3.32Å; G118-C121 PolarHBondContact O-N 3.47Å; G118-C121 VanDerWaalsContact O-N 3.17Å; G119-C121 VanDerWaalsContact C-N 3.29Å; G119-C121 PolarHBondContact O-N 3.34Å; C121-S125 VanDerWaalsContact O-CB 3.29Å; C121-S125 WeakPolarHBondContact O-CB 3.3Å; C121-S125 PolarHBondContact O-N 3.21Å; C121-I134 HydrophobicContact CB-CG2 4.4Å; C121-I134 WeakPolarHBondContact O-CG2 3.32Å; C121-A138 HydrophobicContact CB-CB 3.65Å
122	I	90.6	Very high	87.4	Confident	14 Å²	14	72.6 Å²	72.6	7%	0.072	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-49.7	173.3	-66.1	166.5	0	0	0	109.9	T13 T14 A17 G118 G119 A124 S125 E126 A138	T13-I122 HydrophobicContact CG2-CD1 4.19Å; T14-I122 HydrophobicContact CG2-CG2 3.77Å; A17-I122 HydrophobicContact CB-CD1 3.85Å; G118-I122 WeakPolarHBondContact O-CG1 3.41Å; G118-I122 PolarHBondContact O-N 3.49Å; G119-I122 PolarHBondContact O-N 3.36Å; I122-A124 PolarHBondContact O-N 2.84Å; I122-S125 WeakPolarHBondContact O-CB 3.49Å; I122-S125 PolarHBondContact O-N 2.88Å; I122-S125 VanDerWaalsContact O-N 3.12Å; I122-S125 PolarHBondContact O-OG 3.19Å; I122-E126 PolarHBondContact O-N 2.91Å; I122-A138 HydrophobicContact CG1-CB 3.97Å
123	A	89.9	Confident	86.9	Confident	39 Å²	39	77 Å²	77	32%	0.322	38%	0.384	S	S	.	.	H	α-helix	trans	-59.7	-46.6	177.4	0	0	0	0	0	111.6	G119 L120 S125 E126 F127	G119-A123 PolarHBondContact O-N 2.96Å; L120-A123 PolarHBondContact O-N 3.44Å; A123-S125 VanDerWaalsContact C-N 3.26Å; A123-S125 PolarHBondContact O-N 3Å; A123-E126 WeakPolarHBondContact O-CB 3.16Å; A123-E126 PolarHBondContact O-N 2.89Å; A123-E126 VanDerWaalsContact O-N 3.12Å; A123-F127 WeakPolarHBondContact O-CD2 3.26Å; A123-F127 PolarHBondContact O-N 3.17Å
124	A	89.4	Confident	86.7	Confident	35 Å²	35	74.8 Å²	74.8	29%	0.289	37%	0.372	S	S	.	.	H	α-helix	trans	-62	-33.4	176.2	0	0	0	0	0	112.5	L120 I122 E126 F127 Y128	L120-A124 VanDerWaalsContact O-CB 3.23Å; L120-A124 WeakPolarHBondContact O-CB 3.4Å; L120-A124 PolarHBondContact O-N 3.24Å; I122-A124 PolarHBondContact O-N 2.84Å; A124-E126 VanDerWaalsContact C-N 3.25Å; A124-E126 PolarHBondContact O-N 3.42Å; A124-F127 PolarHBondContact O-N 3.1Å; A124-Y128 WeakPolarHBondContact O-CD2 3.47Å; A124-Y128 PolarHBondContact O-N 3.12Å
125	S	87.5	Confident	86.4	Confident	23 Å²	23	73.7 Å²	73.7	16%	0.161	37%	0.367	C	S	.	.	H	α-helix	trans	-67.7	-25.6	177.2	80.1	0	0	0	0	113.2	C121 I122 A123	C121-S125 VanDerWaalsContact O-CB 3.29Å; C121-S125 WeakPolarHBondContact O-CB 3.3Å; C121-S125 PolarHBondContact O-N 3.21Å; I122-S125 WeakPolarHBondContact O-CB 3.49Å; I122-S125 PolarHBondContact O-N 2.88Å; I122-S125 VanDerWaalsContact O-N 3.12Å; I122-S125 PolarHBondContact O-OG 3.19Å; A123-S125 VanDerWaalsContact C-N 3.26Å; A123-S125 PolarHBondContact O-N 3Å
126	E	83.4	Confident	86.2	Confident	106 Å²	106	76.8 Å²	76.8	50%	0.495	38%	0.383	S	S	.	.	H	α-helix	trans	-71.3	-44.4	174.6	-172.7	168.1	-169.6	0	0	111.1	M10 I122 A123 A124	M10-E126 HydrophobicContact CE-CG 3.85Å; I122-E126 PolarHBondContact O-N 2.91Å; A123-E126 WeakPolarHBondContact O-CB 3.16Å; A123-E126 PolarHBondContact O-N 2.89Å; A123-E126 VanDerWaalsContact O-N 3.12Å; A124-E126 VanDerWaalsContact C-N 3.25Å; A124-E126 PolarHBondContact O-N 3.42Å
127	F	83.9	Confident	86	Confident	171 Å²	171	73.5 Å²	73.5	75%	0.75	37%	0.373	S	S	*	.	H	α-helix	trans	-70.7	-44.4	176.2	-66.1	-74.7	0	0	0	112.5	A123 A124 K129	A123-F127 WeakPolarHBondContact O-CD2 3.26Å; A123-F127 PolarHBondContact O-N 3.17Å; A124-F127 PolarHBondContact O-N 3.1Å; F127-K129 PolarHBondContact O-N 2.8Å
128	Y	79.9	Confident	85.9	Confident	152 Å²	152	69.4 Å²	69.4	60%	0.596	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	61	-176.7	-63.9	-75.1	0	0	0	112.3	A124 T130 R131	A124-Y128 WeakPolarHBondContact O-CD2 3.47Å; A124-Y128 PolarHBondContact O-N 3.12Å; Y128-T130 PolarHBondContact O-N 2.99Å; Y128-R131 PolarHBondContact O-N 3.21Å; Y128-R131 VanDerWaalsContact O-N 3.1Å
129	K	72.6	Confident	85.8	Confident	149 Å²	149	69.4 Å²	69.4	65%	0.648	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.4	-179.6	-160.9	167.7	-171.3	166.9	0	114.7	F127 H132	F127-K129 PolarHBondContact O-N 2.8Å; K129-H132 PolarHBondContact O-CE1 3.3Å
130	T	65.6	Low	85.9	Confident	114 Å²	114	72.8 Å²	72.8	70%	0.699	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-21.6	-179.5	58.1	0	0	0	0	113.6	Y128	Y128-T130 PolarHBondContact O-N 2.99Å
131	R	76.9	Confident	86	Confident	173 Å²	173	72.3 Å²	72.3	65%	0.653	36%	0.358	S	S	*	.			trans	-105.2	90.4	-176.6	-67.6	-68.2	-158.9	171	5.5	111.2	Y128 N133 I134	Y128-R131 PolarHBondContact O-N 3.21Å; Y128-R131 VanDerWaalsContact O-N 3.1Å; R131-N133 PolarHBondContact O-N 3.3Å; R131-N133 VanDerWaalsContact O-N 3.12Å; R131-I134 HydrophobicContact CB-CD1 3.61Å; R131-I134 HydrophobicContact CB-CG1 3.86Å; R131-I134 HydrophobicContact CG-CD1 4.36Å; R131-I134 PolarHBondContact O-N 2.83Å
132	H	74.9	Confident	86.1	Confident	59 Å²	59	71.4 Å²	71.4	27%	0.273	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.6	-177.9	-50.3	-39.8	0	0	0	114.5	K129 I134 I135 F201 L208	K129-H132 PolarHBondContact O-CE1 3.3Å; H132-I134 VanDerWaalsContact C-N 3.32Å; H132-I135 VanDerWaalsContact O-CG2 3.23Å; H132-I135 WeakPolarHBondContact O-CG2 3.49Å; H132-F201 WeakPolarHBondContact O-CD2 3.44Å; H132-F201 VanDerWaalsContact O-CE2 3.28Å; H132-F201 WeakPolarHBondContact O-CE2 3.3Å; H132-L208 WeakPolarHBondContact CD2-CD1 3.42Å; H132-L208 WeakPolarHBondContact NE2-CD1 3.44Å
133	N	83.4	Confident	86.4	Confident	121 Å²	121	72.8 Å²	72.8	65%	0.647	36%	0.361	S	S	*	.	H	α-helix	trans	-73.4	-24.4	178	-61	-10.4	0	0	0	112.5	R131 I135 L136 S137	R131-N133 PolarHBondContact O-N 3.3Å; R131-N133 VanDerWaalsContact O-N 3.12Å; N133-I135 PolarHBondContact O-N 3.25Å; N133-L136 PolarHBondContact O-N 3.33Å; N133-S137 PolarHBondContact O-N 2.94Å; N133-S137 PolarHBondContact O-OG 3.22Å
134	I	89.6	Confident	86.6	Confident	41 Å²	41	72.9 Å²	72.9	21%	0.21	36%	0.359	C	S	.	.	H	α-helix	trans	-66.5	-39.1	-174.8	-59.3	177.7	0	0	0	111.4	C121 R131 H132 L136 S137 A138	C121-I134 HydrophobicContact CB-CG2 4.4Å; C121-I134 WeakPolarHBondContact O-CG2 3.32Å; R131-I134 HydrophobicContact CB-CD1 3.61Å; R131-I134 HydrophobicContact CB-CG1 3.86Å; R131-I134 HydrophobicContact CG-CD1 4.36Å; R131-I134 PolarHBondContact O-N 2.83Å; H132-I134 VanDerWaalsContact C-N 3.32Å; I134-L136 VanDerWaalsContact C-N 3.33Å; I134-L136 PolarHBondContact O-N 3.45Å; I134-S137 WeakPolarHBondContact CA-OG 3.45Å; I134-S137 PolarHBondContact O-N 3Å; I134-S137 PolarHBondContact O-OG 3.37Å; I134-A138 WeakPolarHBondContact O-CB 3.07Å; I134-A138 PolarHBondContact O-N 3.42Å
135	I	89.4	Confident	86.9	Confident	23 Å²	23	71.3 Å²	71.3	12%	0.118	35%	0.346	C	S	.	.	H	α-helix	trans	-69.8	-32.4	178.9	-175.3	161.9	0	0	0	112.2	H132 N133 A138 G139 M200 F201	H132-I135 VanDerWaalsContact O-CG2 3.23Å; H132-I135 WeakPolarHBondContact O-CG2 3.49Å; N133-I135 PolarHBondContact O-N 3.25Å; I135-A138 PolarHBondContact O-N 3.42Å; I135-G139 PolarHBondContact O-N 3.49Å; I135-M200 HydrophobicContact CD1-CB 4.18Å; I135-M200 HydrophobicContact CD1-CE 3.27Å; I135-M200 HydrophobicContact CD1-CG 3.91Å; I135-M200 HydrophobicContact CD1-SD 4.31Å; I135-F201 HydrophobicContact CG2-CB 4.03Å; I135-F201 HydrophobicContact CG2-CD2 3.63Å; I135-F201 HydrophobicContact CG2-CG 4.29Å
136	L	89.9	Confident	87.2	Confident	69 Å²	69	70.2 Å²	70.2	36%	0.361	34%	0.339	S	S	.	.	H	α-helix	trans	-68.3	-45	174.1	175.6	137.9	0	0	0	110.6	N133 I134 A138 G139 I140 F201	N133-L136 PolarHBondContact O-N 3.33Å; I134-L136 VanDerWaalsContact C-N 3.33Å; I134-L136 PolarHBondContact O-N 3.45Å; L136-A138 VanDerWaalsContact C-N 3.29Å; L136-A138 PolarHBondContact O-N 2.89Å; L136-G139 PolarHBondContact O-N 3.28Å; L136-I140 HydrophobicContact CD2-CD1 3.53Å; L136-I140 HydrophobicContact CG-CD1 4.06Å; L136-I140 WeakPolarHBondContact O-CG1 3.46Å; L136-I140 PolarHBondContact O-N 3.46Å; L136-F201 HydrophobicContact CB-CD1 4.33Å; L136-F201 HydrophobicContact CB-CD2 3.91Å; L136-F201 HydrophobicContact CB-CE1 4.34Å; L136-F201 HydrophobicContact CB-CE2 3.88Å; L136-F201 HydrophobicContact CB-CG 4.11Å; L136-F201 HydrophobicContact CB-CZ 4.1Å; L136-F201 HydrophobicContact CD1-CD1 3.78Å; L136-F201 HydrophobicContact CD1-CE1 3.3Å; L136-F201 HydrophobicContact CD1-CE2 4.19Å; L136-F201 HydrophobicContact CD1-CG 4.41Å; L136-F201 HydrophobicContact CD1-CZ 3.52Å; L136-F201 HydrophobicContact CG-CE1 4.42Å; L136-F201 HydrophobicContact CG-CZ 4.45Å
137	S	91.6	Very high	87.7	Confident	36 Å²	36	69.6 Å²	69.6	25%	0.252	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-38.4	173.7	50.1	0	0	0	0	112.2	N133 I134 I140 F141	N133-S137 PolarHBondContact O-N 2.94Å; N133-S137 PolarHBondContact O-OG 3.22Å; I134-S137 WeakPolarHBondContact CA-OG 3.45Å; I134-S137 PolarHBondContact O-N 3Å; I134-S137 PolarHBondContact O-OG 3.37Å; S137-I140 PolarHBondContact O-N 3.01Å; S137-F141 WeakPolarHBondContact O-CD2 3.42Å; S137-F141 WeakPolarHBondContact O-CG 3.42Å; S137-F141 PolarHBondContact O-N 3.3Å
138	A	92.8	Very high	88.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-48.2	175.8	0	0	0	0	0	111.5	C121 I122 I134 I135 L136 I140 F141 F142	C121-A138 HydrophobicContact CB-CB 3.65Å; I122-A138 HydrophobicContact CG1-CB 3.97Å; I134-A138 WeakPolarHBondContact O-CB 3.07Å; I134-A138 PolarHBondContact O-N 3.42Å; I135-A138 PolarHBondContact O-N 3.42Å; L136-A138 VanDerWaalsContact C-N 3.29Å; L136-A138 PolarHBondContact O-N 2.89Å; A138-I140 PolarHBondContact O-N 3.33Å; A138-F141 PolarHBondContact O-N 2.95Å; A138-F142 WeakPolarHBondContact O-CB 3.05Å; A138-F142 PolarHBondContact O-N 3.24Å
139	G	93.1	Very high	88.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-42.2	176.8	0	0	0	0	0	112.8	I135 L136 F142 V143	I135-G139 PolarHBondContact O-N 3.49Å; L136-G139 PolarHBondContact O-N 3.28Å; G139-F142 PolarHBondContact O-N 3.32Å; G139-V143 WeakPolarHBondContact O-CG2 3.49Å; G139-V143 PolarHBondContact O-N 3.14Å
140	I	94.3	Very high	89.6	Confident	97 Å²	97	50.6 Å²	50.6	50%	0.497	26%	0.262	S	S	.	.	H	α-helix	trans	-64	-45.1	177.4	-65.6	165.6	0	0	0	111.3	L136 S137 A138 F142 V143 S144	L136-I140 HydrophobicContact CD2-CD1 3.53Å; L136-I140 HydrophobicContact CG-CD1 4.06Å; L136-I140 WeakPolarHBondContact O-CG1 3.46Å; L136-I140 PolarHBondContact O-N 3.46Å; S137-I140 PolarHBondContact O-N 3.01Å; A138-I140 PolarHBondContact O-N 3.33Å; I140-F142 PolarHBondContact O-N 3.07Å; I140-V143 PolarHBondContact O-N 3.37Å; I140-S144 WeakPolarHBondContact O-CB 3.37Å; I140-S144 PolarHBondContact O-N 3.46Å; I140-S144 PolarHBondContact O-OG 3.03Å
141	F	95.3	Very high	90.8	Very high	74 Å²	74	49 Å²	49	33%	0.325	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-34.2	176.3	-70.1	-43.4	0	0	0	112.4	L114 S137 A138 S144 A145	L114-F141 HydrophobicContact CD2-CD1 4.28Å; S137-F141 WeakPolarHBondContact O-CD2 3.42Å; S137-F141 WeakPolarHBondContact O-CG 3.42Å; S137-F141 PolarHBondContact O-N 3.3Å; A138-F141 PolarHBondContact O-N 2.95Å; F141-S144 WeakPolarHBondContact CA-OG 3.48Å; F141-S144 PolarHBondContact O-OG 2.76Å; F141-A145 VanDerWaalsContact O-CB 3.22Å; F141-A145 WeakPolarHBondContact O-CB 3.22Å; F141-A145 PolarHBondContact O-N 3.39Å
142	F	94.9	Very high	91.3	Very high	3 Å²	3	41 Å²	41	1%	0.013	22%	0.22	C	C	.	.	H	α-helix	trans	-74.8	-40.5	-178.6	-143.4	-105	0	0	0	112.4	A17 A20 L115 A138 G139 I140 A145 G146 A190 V193	A17-F142 HydrophobicContact CB-CE2 4.1Å; A17-F142 HydrophobicContact CB-CZ 4.13Å; A20-F142 HydrophobicContact CB-CZ 4.02Å; L115-F142 HydrophobicContact CD2-CD2 3.75Å; L115-F142 HydrophobicContact CD2-CE1 4.28Å; L115-F142 HydrophobicContact CD2-CE2 3.37Å; L115-F142 HydrophobicContact CD2-CG 4.32Å; L115-F142 HydrophobicContact CD2-CZ 3.66Å; A138-F142 WeakPolarHBondContact O-CB 3.05Å; A138-F142 PolarHBondContact O-N 3.24Å; G139-F142 PolarHBondContact O-N 3.32Å; I140-F142 PolarHBondContact O-N 3.07Å; F142-A145 WeakPolarHBondContact O-CB 3.29Å; F142-A145 PolarHBondContact O-N 3.12Å; F142-G146 PolarHBondContact O-N 2.91Å; F142-A190 HydrophobicContact CD1-CB 4.23Å; F142-A190 WeakPolarHBondContact CD1-O 3.32Å; F142-A190 VanDerWaalsContact CE1-C 3.48Å; F142-A190 HydrophobicContact CE1-CB 3.83Å; F142-A190 WeakPolarHBondContact CE1-O 3.29Å; F142-A190 HydrophobicContact CZ-CB 4.34Å; F142-V193 HydrophobicContact CD1-CB 4.06Å; F142-V193 HydrophobicContact CD1-CG1 3.85Å; F142-V193 HydrophobicContact CE1-CB 3.48Å; F142-V193 VanDerWaalsContact CE1-CB 3.48Å; F142-V193 HydrophobicContact CE1-CG1 3.39Å; F142-V193 HydrophobicContact CE1-CG2 4.47Å; F142-V193 HydrophobicContact CZ-CB 4.23Å; F142-V193 HydrophobicContact CZ-CG1 3.83Å
143	V	95.4	Very high	91.8	Very high	43 Å²	43	38.7 Å²	38.7	26%	0.261	21%	0.21	S	C	.	.	H	α-helix	trans	-66.2	-44	171.6	174.3	0	0	0	0	110.7	G139 I140 A145 G146 L147	G139-V143 WeakPolarHBondContact O-CG2 3.49Å; G139-V143 PolarHBondContact O-N 3.14Å; I140-V143 PolarHBondContact O-N 3.37Å; V143-A145 VanDerWaalsContact C-N 3.28Å; V143-A145 PolarHBondContact O-N 3.02Å; V143-G146 PolarHBondContact O-N 3.42Å; V143-G146 VanDerWaalsContact O-N 3.14Å; V143-L147 HydrophobicContact CG1-CD1 4.12Å; V143-L147 HydrophobicContact CG1-CG 4.4Å; V143-L147 WeakPolarHBondContact O-CG 3.49Å; V143-L147 PolarHBondContact O-N 2.96Å
144	S	94.8	Very high	92	Very high	42 Å²	42	37.5 Å²	37.5	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-65.6	-32.6	177.1	69.2	0	0	0	0	112.5	I140 F141 S148	I140-S144 WeakPolarHBondContact O-CB 3.37Å; I140-S144 PolarHBondContact O-N 3.46Å; I140-S144 PolarHBondContact O-OG 3.03Å; F141-S144 WeakPolarHBondContact CA-OG 3.48Å; F141-S144 PolarHBondContact O-OG 2.76Å; S144-S148 WeakPolarHBondContact O-CB 3.34Å; S144-S148 PolarHBondContact O-N 2.61Å; S144-S148 PolarHBondContact O-OG 3.48Å
145	A	95.2	Very high	91.7	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-44.1	170.6	0	0	0	0	0	111.9	S111 L114 L115 F141 F142 V143 S148 N149	S111-A145 WeakPolarHBondContact CB-O 3.31Å; L114-A145 HydrophobicContact CB-CB 3.59Å; L115-A145 HydrophobicContact CD2-CB 3.74Å; L115-A145 HydrophobicContact CG-CB 3.75Å; F141-A145 VanDerWaalsContact O-CB 3.22Å; F141-A145 WeakPolarHBondContact O-CB 3.22Å; F141-A145 PolarHBondContact O-N 3.39Å; F142-A145 WeakPolarHBondContact O-CB 3.29Å; F142-A145 PolarHBondContact O-N 3.12Å; V143-A145 VanDerWaalsContact C-N 3.28Å; V143-A145 PolarHBondContact O-N 3.02Å; A145-S148 WeakPolarHBondContact CA-OG 3.36Å; A145-S148 PolarHBondContact O-N 3.4Å; A145-S148 PolarHBondContact O-OG 3.01Å; A145-N149 WeakPolarHBondContact O-CB 3.42Å; A145-N149 PolarHBondContact O-N 3.42Å
146	G	94.3	Very high	91.2	Very high	1 Å²	1	36 Å²	36	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-48.8	174.4	0	0	0	0	0	112.2	F142 V143 S148 N149 I150 F187	F142-G146 PolarHBondContact O-N 2.91Å; V143-G146 PolarHBondContact O-N 3.42Å; V143-G146 VanDerWaalsContact O-N 3.14Å; G146-S148 PolarHBondContact O-N 2.59Å; G146-N149 WeakPolarHBondContact O-CB 3.47Å; G146-N149 PolarHBondContact O-N 3.45Å; G146-N149 VanDerWaalsContact O-N 3.15Å; G146-I150 PolarHBondContact O-N 3.1Å; G146-F187 WeakPolarHBondContact O-CD2 3.45Å; G146-F187 VanDerWaalsContact O-CE2 3.31Å; G146-F187 WeakPolarHBondContact O-CE2 3.25Å
147	L	93.4	Very high	90.8	Very high	93 Å²	93	35.6 Å²	35.6	49%	0.487	19%	0.193	S	C	.	.	H	α-helix	trans	-62.2	-40	178.2	-66.7	176.5	0	0	0	113.2	V143 I150 I151	V143-L147 HydrophobicContact CG1-CD1 4.12Å; V143-L147 HydrophobicContact CG1-CG 4.4Å; V143-L147 WeakPolarHBondContact O-CG 3.49Å; V143-L147 PolarHBondContact O-N 2.96Å; L147-I150 WeakPolarHBondContact O-CG2 3.45Å; L147-I151 WeakPolarHBondContact O-CD1 3.42Å; L147-I151 WeakPolarHBondContact O-CG1 3.4Å; L147-I151 PolarHBondContact O-N 3.33Å
148	S	92.9	Very high	90.1	Very high	17 Å²	17	36.3 Å²	36.3	12%	0.119	20%	0.198	C	C	.	.	H	α-helix	trans	-68.6	-34.3	174.5	52	0	0	0	0	112.4	S111 S144 A145 G146 G152	S111-S148 WeakPolarHBondContact CB-OG 3.43Å; S144-S148 WeakPolarHBondContact O-CB 3.34Å; S144-S148 PolarHBondContact O-N 2.61Å; S144-S148 PolarHBondContact O-OG 3.48Å; A145-S148 WeakPolarHBondContact CA-OG 3.36Å; A145-S148 PolarHBondContact O-N 3.4Å; A145-S148 PolarHBondContact O-OG 3.01Å; G146-S148 PolarHBondContact O-N 2.59Å; S148-G152 PolarHBondContact O-N 3.32Å
149	N	92.3	Very high	88.9	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.011	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-49.2	173.6	-174.7	24.4	0	0	0	112.2	M24 A145 G146 I151 G152 I153 G183 F187	M24-N149 HydrophobicContact CE-CB 3.54Å; M24-N149 WeakPolarHBondContact CE-ND2 3.4Å; M24-N149 WeakPolarHBondContact CE-OD1 3.4Å; A145-N149 WeakPolarHBondContact O-CB 3.42Å; A145-N149 PolarHBondContact O-N 3.42Å; G146-N149 WeakPolarHBondContact O-CB 3.47Å; G146-N149 PolarHBondContact O-N 3.45Å; G146-N149 VanDerWaalsContact O-N 3.15Å; N149-I151 VanDerWaalsContact C-N 3.28Å; N149-I151 PolarHBondContact O-N 2.85Å; N149-G152 CarbonylContact O-C 3.59Å; N149-G152 WeakPolarHBondContact O-CA 3.37Å; N149-G152 PolarHBondContact O-N 2.75Å; N149-I153 WeakPolarHBondContact O-CG1 3.24Å; N149-I153 PolarHBondContact O-N 2.67Å; N149-G183 PolarHBondContact ND2-O 2.74Å; N149-F187 WeakPolarHBondContact ND2-CB 3.47Å
150	I	92.2	Very high	87.7	Confident	53 Å²	53	38.5 Å²	38.5	27%	0.272	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-37.9	-179.1	-168.8	67.3	0	0	0	111.3	G146 L147 G152 I153 I154 F187	G146-I150 PolarHBondContact O-N 3.1Å; L147-I150 WeakPolarHBondContact O-CG2 3.45Å; I150-G152 VanDerWaalsContact C-N 3.33Å; I150-G152 PolarHBondContact O-N 2.91Å; I150-I153 PolarHBondContact O-N 2.9Å; I150-I154 HydrophobicContact CG1-CD1 4.1Å; I150-I154 VanDerWaalsContact O-CG1 3.24Å; I150-I154 WeakPolarHBondContact O-CG1 3.21Å; I150-I154 PolarHBondContact O-N 3.28Å; I150-F187 HydrophobicContact CB-CD2 4.25Å; I150-F187 HydrophobicContact CB-CE2 4Å; I150-F187 HydrophobicContact CB-CZ 4.24Å; I150-F187 HydrophobicContact CD1-CE1 4.39Å; I150-F187 HydrophobicContact CG2-CE2 4.2Å
151	I	89.9	Confident	86.1	Confident	80 Å²	80	37.8 Å²	37.8	41%	0.41	22%	0.221	S	C	.	.	H	α-helix	trans	-60.3	-45.3	171.8	-67.5	165.5	0	0	0	110.2	F107 L147 N149 I153 I154 V155	F107-I151 HydrophobicContact CD1-CG2 4.43Å; F107-I151 HydrophobicContact CD2-CG2 4.12Å; F107-I151 HydrophobicContact CE2-CG2 4.28Å; F107-I151 HydrophobicContact CG-CG2 4.2Å; L147-I151 WeakPolarHBondContact O-CD1 3.42Å; L147-I151 WeakPolarHBondContact O-CG1 3.4Å; L147-I151 PolarHBondContact O-N 3.33Å; N149-I151 VanDerWaalsContact C-N 3.28Å; N149-I151 PolarHBondContact O-N 2.85Å; I151-I153 PolarHBondContact O-N 3.13Å; I151-I154 PolarHBondContact O-N 3.39Å; I151-V155 HydrophobicContact CG2-CG2 4.41Å; I151-V155 WeakPolarHBondContact O-CG2 3.36Å; I151-V155 PolarHBondContact O-N 2.88Å
152	G	87	Confident	84	Confident	5 Å²	5	36.3 Å²	36.3	5%	0.052	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-44.5	175.3	0	0	0	0	0	113.5	S148 N149 I150 Y156	S148-G152 PolarHBondContact O-N 3.32Å; N149-G152 CarbonylContact O-C 3.59Å; N149-G152 WeakPolarHBondContact O-CA 3.37Å; N149-G152 PolarHBondContact O-N 2.75Å; I150-G152 VanDerWaalsContact C-N 3.33Å; I150-G152 PolarHBondContact O-N 2.91Å; G152-Y156 WeakPolarHBondContact O-CB 3.48Å; G152-Y156 PolarHBondContact O-N 3.46Å
153	I	86.4	Confident	81.8	Confident	11 Å²	11	40.3 Å²	40.3	6%	0.056	25%	0.248	C	C	.	.	H	α-helix	trans	-64.3	-44.5	176.9	-68.5	171	0	0	0	110.9	N149 I150 I151 Y156 I157 F180	N149-I153 WeakPolarHBondContact O-CG1 3.24Å; N149-I153 PolarHBondContact O-N 2.67Å; I150-I153 PolarHBondContact O-N 2.9Å; I151-I153 PolarHBondContact O-N 3.13Å; I153-Y156 WeakPolarHBondContact O-CB 3.38Å; I153-Y156 PolarHBondContact O-N 2.9Å; I153-I157 HydrophobicContact CG2-CD1 4.09Å; I153-I157 WeakPolarHBondContact O-CG1 3.32Å; I153-I157 PolarHBondContact O-N 2.92Å; I153-F180 HydrophobicContact CG2-CE2 3.72Å; I153-F180 HydrophobicContact CG2-CZ 3.74Å
154	I	87.4	Confident	79.3	Confident	97 Å²	97	44.3 Å²	44.3	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-45.9	179.1	-68.6	163.9	0	0	0	110.7	I150 I151 Y156 I157 S158	I150-I154 HydrophobicContact CG1-CD1 4.1Å; I150-I154 VanDerWaalsContact O-CG1 3.24Å; I150-I154 WeakPolarHBondContact O-CG1 3.21Å; I150-I154 PolarHBondContact O-N 3.28Å; I151-I154 PolarHBondContact O-N 3.39Å; I154-Y156 VanDerWaalsContact C-N 3.29Å; I154-Y156 PolarHBondContact O-N 3.43Å; I154-I157 PolarHBondContact O-N 2.81Å; I154-S158 PolarHBondContact O-N 3.42Å; I154-S158 PolarHBondContact O-OG 3.08Å
155	V	82.6	Confident	77	Confident	22 Å²	22	47.3 Å²	47.3	13%	0.133	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-36.8	177.5	175.7	0	0	0	0	111.3	L98 V101 I151 S158 A159	L98-V155 HydrophobicContact CD2-CG1 4.22Å; V101-V155 HydrophobicContact CB-CG1 4.37Å; V101-V155 HydrophobicContact CG1-CG1 3.73Å; I151-V155 HydrophobicContact CG2-CG2 4.41Å; I151-V155 WeakPolarHBondContact O-CG2 3.36Å; I151-V155 PolarHBondContact O-N 2.88Å; V155-S158 WeakPolarHBondContact CA-OG 3.34Å; V155-S158 PolarHBondContact O-OG 2.93Å; V155-S158 VanDerWaalsContact O-OG 3.13Å; V155-A159 WeakPolarHBondContact O-CB 3.18Å; V155-A159 PolarHBondContact O-N 2.75Å; V155-A159 VanDerWaalsContact O-N 3.09Å
156	Y	79.7	Confident	74.8	Confident	10 Å²	10	52 Å²	52	4%	0.039	32%	0.317	C	S	.	.	H	α-helix	trans	-62	-42.9	174.5	-178.2	-96	0	0	0	111.9	W33 L34 L63 G152 I153 I154 N160 F180	W33-Y156 HydrophobicContact CB-CE1 4.36Å; W33-Y156 VanDerWaalsContact CB-OH 3.29Å; W33-Y156 WeakPolarHBondContact CB-OH 2.92Å; W33-Y156 AromaticContact CE3-CD1 3.91Å; W33-Y156 HydrophobicContact CE3-CD1 3.91Å; W33-Y156 HydrophobicContact CE3-CD2 4.02Å; W33-Y156 AromaticContact CE3-CE1 3.82Å; W33-Y156 HydrophobicContact CE3-CE1 3.82Å; W33-Y156 AromaticContact CE3-CE2 3.93Å; W33-Y156 HydrophobicContact CE3-CE2 3.93Å; W33-Y156 HydrophobicContact CE3-CG 4.01Å; W33-Y156 AromaticContact CE3-CZ 3.83Å; W33-Y156 HydrophobicContact CZ3-CD1 4.29Å; W33-Y156 HydrophobicContact CZ3-CD2 4.3Å; W33-Y156 HydrophobicContact CZ3-CG 4.12Å; L34-Y156 WeakPolarHBondContact CB-OH 3.28Å; L34-Y156 HydrophobicContact CD1-CE1 4.1Å; L63-Y156 HydrophobicContact CD1-CD2 4.19Å; L63-Y156 HydrophobicContact CD1-CE2 4.39Å; G152-Y156 WeakPolarHBondContact O-CB 3.48Å; G152-Y156 PolarHBondContact O-N 3.46Å; I153-Y156 WeakPolarHBondContact O-CB 3.38Å; I153-Y156 PolarHBondContact O-N 2.9Å; I154-Y156 VanDerWaalsContact C-N 3.29Å; I154-Y156 PolarHBondContact O-N 3.43Å; Y156-N160 WeakPolarHBondContact CE1-ND2 3.41Å; Y156-N160 PolarHBondContact O-N 3.4Å; Y156-N160 PolarHBondContact O-ND2 2.6Å; Y156-F180 HydrophobicContact CD1-CD2 4.3Å; Y156-F180 HydrophobicContact CD1-CE2 4.18Å; Y156-F180 HydrophobicContact CE1-CD2 4.38Å
157	I	80.9	Confident	72.2	Confident	60 Å²	60	55.9 Å²	55.9	31%	0.308	34%	0.343	S	S	.	.	H	α-helix	trans	-69.7	-46.7	177.8	-61.6	165.8	0	0	0	110.9	I153 I154 A159 N160 A161 Y176 F180	I153-I157 HydrophobicContact CG2-CD1 4.09Å; I153-I157 WeakPolarHBondContact O-CG1 3.32Å; I153-I157 PolarHBondContact O-N 2.92Å; I154-I157 PolarHBondContact O-N 2.81Å; I157-A159 VanDerWaalsContact C-N 3.32Å; I157-A159 PolarHBondContact O-N 2.91Å; I157-N160 PolarHBondContact O-N 3.08Å; I157-A161 PolarHBondContact O-N 3.03Å; I157-Y176 HydrophobicContact CG1-CE1 4.46Å; I157-F180 HydrophobicContact CD1-CE2 4.46Å; I157-F180 HydrophobicContact CD1-CZ 3.98Å; I157-F180 HydrophobicContact CG1-CE2 4.27Å; I157-F180 HydrophobicContact CG1-CZ 4.21Å
158	S	76.3	Confident	70	Confident	51 Å²	51	57.5 Å²	57.5	36%	0.357	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-39.1	-175.5	66.3	0	0	0	0	112.2	I154 V155 N160 A161 G162	I154-S158 PolarHBondContact O-N 3.42Å; I154-S158 PolarHBondContact O-OG 3.08Å; V155-S158 WeakPolarHBondContact CA-OG 3.34Å; V155-S158 PolarHBondContact O-OG 2.93Å; V155-S158 VanDerWaalsContact O-OG 3.13Å; S158-N160 VanDerWaalsContact C-N 3.26Å; S158-N160 PolarHBondContact O-N 2.84Å; S158-A161 PolarHBondContact O-N 2.9Å; S158-G162 PolarHBondContact O-N 3.36Å
159	A	68.6	Low	67.6	Low	20 Å²	20	61.7 Å²	61.7	17%	0.165	38%	0.382	C	S	.	.	H	α-helix	trans	-71.9	-18.5	176.5	0	0	0	0	0	113.5	R102 V155 I157	R102-A159 HydrophobicContact CB-CB 4.44Å; R102-A159 PolarHBondContact NH1-O 3.13Å; R102-A159 VanDerWaalsContact NH1-O 3.13Å; V155-A159 WeakPolarHBondContact O-CB 3.18Å; V155-A159 PolarHBondContact O-N 2.75Å; V155-A159 VanDerWaalsContact O-N 3.09Å; I157-A159 VanDerWaalsContact C-N 3.32Å; I157-A159 PolarHBondContact O-N 2.91Å
160	N	66.9	Low	65.5	Low	26 Å²	26	66.6 Å²	66.6	14%	0.139	40%	0.403	C	S	.	.	H	α-helix	trans	-90.6	-19.6	173	-76.7	-50.3	0	0	0	112.8	R102 Y156 I157 S158 Y174	R102-N160 PolarHBondContact NH1-OD1 2.85Å; R102-N160 VanDerWaalsContact NH1-OD1 3.07Å; R102-N160 PolarHBondContact NH2-OD1 3.35Å; Y156-N160 WeakPolarHBondContact CE1-ND2 3.41Å; Y156-N160 PolarHBondContact O-N 3.4Å; Y156-N160 PolarHBondContact O-ND2 2.6Å; I157-N160 PolarHBondContact O-N 3.08Å; S158-N160 VanDerWaalsContact C-N 3.26Å; S158-N160 PolarHBondContact O-N 2.84Å; N160-Y174 HydrophobicContact CB-CE1 4.12Å
161	A	61.5	Low	63.4	Low	82 Å²	82	70.9 Å²	70.9	68%	0.678	42%	0.419	S	S	*	.	H	α-helix	trans	-83.2	-16.6	176	0	0	0	0	0	113.4	I157 S158 D163	I157-A161 PolarHBondContact O-N 3.03Å; S158-A161 PolarHBondContact O-N 2.9Å; A161-D163 PolarHBondContact O-N 3.26Å
162	G	51.7	Low	61.3	Low	44 Å²	44	74.7 Å²	74.7	45%	0.454	44%	0.441	S	S	.	.			trans	-83.4	8.5	-171.4	0	0	0	0	0	117.4	S158 P164	S158-G162 PolarHBondContact O-N 3.36Å; G162-P164 WeakPolarHBondContact O-CD 3.49Å
163	D	48.3	Very low	59.9	Low	86 Å²	86	76 Å²	76	46%	0.46	45%	0.449	S	S	.	.			trans	-92.7	95	175.1	-81.9	-21.3	0	0	0	110.9	A161 S165	A161-D163 PolarHBondContact O-N 3.26Å; D163-S165 PolarHBondContact O-N 3.19Å
164	P	43.6	Very low	59.1	Low	127 Å²	127	79.3 Å²	79.3	83%	0.825	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-8.9	179.1	28.9	-37.2	0	0	0	114.1	G162 K166	G162-P164 WeakPolarHBondContact O-CD 3.49Å; P164-K166 VanDerWaalsContact C-N 3.33Å; P164-K166 PolarHBondContact O-N 3Å
165	S	45.8	Very low	58.7	Low	106 Å²	106	78 Å²	78	74%	0.741	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.6	-177.8	72.7	0	0	0	0	114.4	D163 S167	D163-S165 PolarHBondContact O-N 3.19Å; S165-S167 PolarHBondContact O-N 3.25Å
166	K	48.2	Very low	58.8	Low	100 Å²	100	80.9 Å²	80.9	44%	0.435	47%	0.47	S	S	.	.	S	Bend	trans	-93.5	78.4	172.9	-73.6	178.9	-178.5	166.7	0	109.6	P164	P164-K166 VanDerWaalsContact C-N 3.33Å; P164-K166 PolarHBondContact O-N 3Å
167	S	40.7	Very low	59.1	Low	82 Å²	82	80.5 Å²	80.5	57%	0.573	47%	0.468	S	S	*	.			trans	-48.9	150.8	175.9	57.3	0	0	0	0	112.8	S165 S169 K170	S165-S167 PolarHBondContact O-N 3.25Å; S167-S169 PolarHBondContact O-N 2.87Å; S167-K170 PolarHBondContact O-N 3.44Å
168	D	46.3	Very low	59.5	Low	126 Å²	126	86 Å²	86	67%	0.674	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	6	-159.9	-64.1	-68.4	0	0	0	119.4	K171	D168-K171 VanDerWaalsContact OD1-CE 3.29Å; D168-K171 WeakPolarHBondContact OD1-CE 3.48Å; D168-K171 IonicContact OD1-NZ 2.88Å; D168-K171 PolarHBondContact OD1-NZ 3.3Å
169	S	44.1	Very low	60.2	Low	105 Å²	105	83.7 Å²	83.7	73%	0.734	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-19	173.7	61.6	0	0	0	0	114.4	S167	S167-S169 PolarHBondContact O-N 2.87Å
170	K	48.2	Very low	61.2	Low	106 Å²	106	83.8 Å²	83.8	46%	0.461	47%	0.466	S	S	.	.	S	Bend	trans	-110.3	6.7	-176.9	-88	-177	176.3	-177.1	0	115.6	E56 S167 N172 S173	E56-K170 WeakPolarHBondContact OE1-CE 3.44Å; E56-K170 IonicContact OE1-NZ 2.72Å; E56-K170 PolarHBondContact OE1-NZ 3.29Å; S167-K170 PolarHBondContact O-N 3.44Å; K170-N172 PolarHBondContact O-N 2.99Å; K170-S173 PolarHBondContact O-N 3.34Å; K170-S173 PolarHBondContact O-OG 2.95Å
171	K	48	Very low	62.4	Low	142 Å²	142	88.5 Å²	88.5	62%	0.617	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.1	172.4	-73.1	178.7	174.9	171.9	0	113	D168	D168-K171 VanDerWaalsContact OD1-CE 3.29Å; D168-K171 WeakPolarHBondContact OD1-CE 3.48Å; D168-K171 IonicContact OD1-NZ 2.88Å; D168-K171 PolarHBondContact OD1-NZ 3.3Å
172	N	46	Very low	63.9	Low	161 Å²	161	88.4 Å²	88.4	86%	0.861	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-0	180	-81.1	13.8	0	0	0	115.7	K170	K170-N172 PolarHBondContact O-N 2.99Å
173	S	57.8	Low	65.9	Low	31 Å²	31	86.3 Å²	86.3	22%	0.217	45%	0.446	C	S	.	.			trans	-113.7	31.2	-178	59.7	0	0	0	0	114	K170	K170-S173 PolarHBondContact O-N 3.34Å; K170-S173 PolarHBondContact O-OG 2.95Å
174	Y	68.3	Low	68	Low	81 Å²	81	83.8 Å²	83.8	32%	0.318	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.8	168.5	-125.9	-125	0	0	0	107.6	L34 S36 N160	L34-Y174 HydrophobicContact CD1-CD1 3.37Å; L34-Y174 HydrophobicContact CD1-CE1 2.97Å; L34-Y174 HydrophobicContact CD1-CG 4.48Å; L34-Y174 HydrophobicContact CD2-CD1 3.48Å; L34-Y174 VanDerWaalsContact CD2-CD1 3.48Å; L34-Y174 HydrophobicContact CD2-CD2 3.83Å; L34-Y174 HydrophobicContact CD2-CE1 3.1Å; L34-Y174 HydrophobicContact CD2-CE2 3.46Å; L34-Y174 VanDerWaalsContact CD2-CE2 3.46Å; L34-Y174 HydrophobicContact CD2-CG 3.82Å; L34-Y174 WeakPolarHBondContact CD2-OH 3.38Å; L34-Y174 HydrophobicContact CG-CD1 3.73Å; L34-Y174 HydrophobicContact CG-CE1 3.49Å; L34-Y174 VanDerWaalsContact CG-CE1 3.49Å; L34-Y174 HydrophobicContact CG-CG 4.42Å; S36-Y174 VanDerWaalsContact CB-CE2 3.47Å; S36-Y174 WeakPolarHBondContact OG-CE2 3.22Å; N160-Y174 HydrophobicContact CB-CE1 4.12Å
175	S	79.4	Confident	70.5	Confident	69 Å²	69	81.3 Å²	81.3	48%	0.483	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.5	176.7	-56.6	0	0	0	0	108.6	Y35	Y35-S175 WeakPolarHBondContact CB-O 3.24Å; Y35-S175 PolarHBondContact N-O 2.97Å; Y35-S175 PolarHBondContact O-N 3.15Å; Y35-S175 VanDerWaalsContact O-N 3.08Å
176	Y	84.6	Confident	72.8	Confident	84 Å²	84	76.3 Å²	76.3	33%	0.329	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	140.6	173.3	-64.4	-78.6	0	0	0	109.9	L34 I157 F180	L34-Y176 HydrophobicContact CD1-CD1 4.3Å; L34-Y176 HydrophobicContact CD1-CE1 4.26Å; I157-Y176 HydrophobicContact CG1-CE1 4.46Å; Y176-F180 AromaticContact CD1-CD1 3.89Å; Y176-F180 HydrophobicContact CD1-CD1 3.89Å; Y176-F180 HydrophobicContact CD1-CD2 4.16Å; Y176-F180 HydrophobicContact CD1-CE1 4.01Å; Y176-F180 HydrophobicContact CD1-CE2 4.25Å; Y176-F180 AromaticContact CD1-CG 3.97Å; Y176-F180 HydrophobicContact CD1-CG 3.97Å; Y176-F180 HydrophobicContact CD1-CZ 4.19Å; Y176-F180 HydrophobicContact CE1-CE1 4.44Å; Y176-F180 HydrophobicContact CE1-CE2 4.36Å; Y176-F180 HydrophobicContact CE1-CZ 4.26Å; Y176-F180 HydrophobicContact CG-CD1 4.02Å; Y176-F180 HydrophobicContact CG-CE1 4.22Å; Y176-F180 HydrophobicContact CG-CG 4.44Å
177	G	85.6	Confident	75	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.01	37%	0.37	C	S	.	.			trans	-89.6	170	179.8	0	0	0	0	0	113.3	Y32 W33 S179 F180 Y181	Y32-G177 CarbonylContact O-C 3.58Å; Y32-G177 VanDerWaalsContact O-C 3.23Å; Y32-G177 WeakPolarHBondContact O-CA 3.36Å; W33-G177 PolarHBondContact O-N 3.44Å; G177-S179 PolarHBondContact O-N 2.94Å; G177-F180 WeakPolarHBondContact O-CB 3.38Å; G177-F180 PolarHBondContact O-N 2.89Å; G177-F180 VanDerWaalsContact O-N 3.14Å; G177-Y181 VanDerWaalsContact O-CD2 3.3Å; G177-Y181 WeakPolarHBondContact O-CD2 3.47Å; G177-Y181 PolarHBondContact O-N 3.42Å
178	W	90	Very high	77.7	Confident	175 Å²	175	74.4 Å²	74.4	66%	0.663	37%	0.367	S	S	*	.	H	α-helix	trans	-59.7	-33.5	-176.6	-56.6	106.3	0	0	0	113	Y32 F180 Y181 F182	Y32-W178 PolarHBondContact O-N 2.92Å; W178-F180 VanDerWaalsContact C-N 3.3Å; W178-F180 PolarHBondContact O-N 3.15Å; W178-Y181 PolarHBondContact O-N 2.88Å; W178-F182 HydrophobicContact CB-CE2 4.21Å; W178-F182 VanDerWaalsContact O-CD2 3.31Å; W178-F182 WeakPolarHBondContact O-CD2 3.43Å; W178-F182 WeakPolarHBondContact O-CG 3.49Å; W178-F182 PolarHBondContact O-N 2.96Å
179	S	90.8	Very high	80	Confident	4 Å²	4	70.6 Å²	70.6	3%	0.028	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-34.8	179.1	-52.5	0	0	0	0	112.3	A27 T30 Y32 G177 F182 G183	A27-S179 VanDerWaalsContact CB-O 3.3Å; A27-S179 WeakPolarHBondContact CB-O 3.42Å; T30-S179 WeakPolarHBondContact OG1-CB 3.41Å; T30-S179 PolarHBondContact OG1-OG 3.2Å; Y32-S179 WeakPolarHBondContact CB-OG 3.48Å; Y32-S179 VanDerWaalsContact O-CB 3.26Å; Y32-S179 WeakPolarHBondContact O-CB 3.45Å; Y32-S179 PolarHBondContact O-N 2.71Å; Y32-S179 PolarHBondContact O-OG 2.83Å; G177-S179 PolarHBondContact O-N 2.94Å; S179-F182 PolarHBondContact O-N 3.28Å; S179-G183 PolarHBondContact O-N 2.92Å
180	F	89.3	Confident	82.4	Confident	21 Å²	21	65.7 Å²	65.7	9%	0.092	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-45.4	174.4	-179.6	-94.4	0	0	0	111	W33 I153 Y156 I157 Y176 G177 W178 F182 G183 A184	W33-F180 HydrophobicContact CE3-CD2 4.01Å; W33-F180 HydrophobicContact CZ3-CD2 4.31Å; I153-F180 HydrophobicContact CG2-CE2 3.72Å; I153-F180 HydrophobicContact CG2-CZ 3.74Å; Y156-F180 HydrophobicContact CD1-CD2 4.3Å; Y156-F180 HydrophobicContact CD1-CE2 4.18Å; Y156-F180 HydrophobicContact CE1-CD2 4.38Å; I157-F180 HydrophobicContact CD1-CE2 4.46Å; I157-F180 HydrophobicContact CD1-CZ 3.98Å; I157-F180 HydrophobicContact CG1-CE2 4.27Å; I157-F180 HydrophobicContact CG1-CZ 4.21Å; Y176-F180 AromaticContact CD1-CD1 3.89Å; Y176-F180 HydrophobicContact CD1-CD1 3.89Å; Y176-F180 HydrophobicContact CD1-CD2 4.16Å; Y176-F180 HydrophobicContact CD1-CE1 4.01Å; Y176-F180 HydrophobicContact CD1-CE2 4.25Å; Y176-F180 AromaticContact CD1-CG 3.97Å; Y176-F180 HydrophobicContact CD1-CG 3.97Å; Y176-F180 HydrophobicContact CD1-CZ 4.19Å; Y176-F180 HydrophobicContact CE1-CE1 4.44Å; Y176-F180 HydrophobicContact CE1-CE2 4.36Å; Y176-F180 HydrophobicContact CE1-CZ 4.26Å; Y176-F180 HydrophobicContact CG-CD1 4.02Å; Y176-F180 HydrophobicContact CG-CE1 4.22Å; Y176-F180 HydrophobicContact CG-CG 4.44Å; G177-F180 WeakPolarHBondContact O-CB 3.38Å; G177-F180 PolarHBondContact O-N 2.89Å; G177-F180 VanDerWaalsContact O-N 3.14Å; W178-F180 VanDerWaalsContact C-N 3.3Å; W178-F180 PolarHBondContact O-N 3.15Å; F180-F182 VanDerWaalsContact C-N 3.34Å; F180-F182 PolarHBondContact O-N 3.45Å; F180-G183 PolarHBondContact O-N 3.28Å; F180-A184 PolarHBondContact O-N 3.17Å
181	Y	92.7	Very high	84.7	Confident	126 Å²	126	62.5 Å²	62.5	49%	0.494	30%	0.298	S	S	.	.	H	α-helix	trans	-65	-36.7	175.2	-63.2	-63.6	0	0	0	112.5	G177 W178 G183 A184 L185	G177-Y181 VanDerWaalsContact O-CD2 3.3Å; G177-Y181 WeakPolarHBondContact O-CD2 3.47Å; G177-Y181 PolarHBondContact O-N 3.42Å; W178-Y181 PolarHBondContact O-N 2.88Å; Y181-G183 VanDerWaalsContact C-N 3.34Å; Y181-A184 PolarHBondContact O-N 3.05Å; Y181-L185 VanDerWaalsContact O-CB 3.29Å; Y181-L185 WeakPolarHBondContact O-CB 3.35Å; Y181-L185 PolarHBondContact O-N 3.18Å
182	F	93.8	Very high	86.9	Confident	79 Å²	79	61.2 Å²	61.2	35%	0.346	30%	0.296	S	S	.	.	H	α-helix	trans	-66	-35.2	173.3	-68.1	-39.4	0	0	0	112.8	L23 I26 W178 S179 F180 L185 S186	L23-F182 HydrophobicContact CD2-CB 4.34Å; L23-F182 HydrophobicContact CD2-CD1 3.83Å; L23-F182 HydrophobicContact CD2-CE1 4.39Å; L23-F182 HydrophobicContact CD2-CG 4.17Å; I26-F182 HydrophobicContact CG2-CD2 4.37Å; W178-F182 HydrophobicContact CB-CE2 4.21Å; W178-F182 VanDerWaalsContact O-CD2 3.31Å; W178-F182 WeakPolarHBondContact O-CD2 3.43Å; W178-F182 WeakPolarHBondContact O-CG 3.49Å; W178-F182 PolarHBondContact O-N 2.96Å; S179-F182 PolarHBondContact O-N 3.28Å; F180-F182 VanDerWaalsContact C-N 3.34Å; F180-F182 PolarHBondContact O-N 3.45Å; F182-L185 PolarHBondContact O-N 3.33Å; F182-S186 VanDerWaalsContact O-CB 3.28Å; F182-S186 WeakPolarHBondContact O-CB 3.42Å; F182-S186 PolarHBondContact O-N 2.79Å; F182-S186 PolarHBondContact O-OG 3.32Å
183	G	92.2	Very high	89.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-36.9	171.5	0	0	0	0	0	113.2	N149 S179 F180 Y181 S186 F187	N149-G183 PolarHBondContact ND2-O 2.74Å; S179-G183 PolarHBondContact O-N 2.92Å; F180-G183 PolarHBondContact O-N 3.28Å; Y181-G183 VanDerWaalsContact C-N 3.34Å; G183-S186 PolarHBondContact O-OG 2.88Å; G183-F187 PolarHBondContact O-N 2.95Å
184	A	93.6	Very high	90.9	Very high	32 Å²	32	52.2 Å²	52.2	26%	0.264	25%	0.245	S	C	.	.	H	α-helix	trans	-72.5	-39.7	173.9	0	0	0	0	0	112.2	F180 Y181 F187 I188	F180-A184 PolarHBondContact O-N 3.17Å; Y181-A184 PolarHBondContact O-N 3.05Å; A184-F187 WeakPolarHBondContact O-CB 3.37Å; A184-F187 PolarHBondContact O-N 3.02Å; A184-I188 WeakPolarHBondContact O-CG1 3.17Å; A184-I188 PolarHBondContact O-N 3.02Å; A184-I188 VanDerWaalsContact O-N 3.13Å
185	L	94.8	Very high	92.1	Very high	76 Å²	76	52.5 Å²	52.5	40%	0.398	26%	0.255	S	S	.	.	H	α-helix	trans	-66.3	-39.7	176.1	-176.1	65.3	0	0	0	111.2	L23 Y181 F182 F187 I188 I189	L23-L185 HydrophobicContact CD1-CD2 3.97Å; L23-L185 HydrophobicContact CD1-CG 4.17Å; Y181-L185 VanDerWaalsContact O-CB 3.29Å; Y181-L185 WeakPolarHBondContact O-CB 3.35Å; Y181-L185 PolarHBondContact O-N 3.18Å; F182-L185 PolarHBondContact O-N 3.33Å; L185-F187 VanDerWaalsContact C-N 3.29Å; L185-F187 PolarHBondContact O-N 2.82Å; L185-I188 PolarHBondContact O-N 2.81Å; L185-I189 HydrophobicContact CD1-CD1 4.38Å; L185-I189 HydrophobicContact CG-CD1 4.05Å; L185-I189 WeakPolarHBondContact O-CG1 3.29Å; L185-I189 PolarHBondContact O-N 3.29Å
186	S	95.3	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-37.1	175.3	72.7	0	0	0	0	111.4	A20 F182 G183 A190	A20-S186 WeakPolarHBondContact O-CB 3.39Å; F182-S186 VanDerWaalsContact O-CB 3.28Å; F182-S186 WeakPolarHBondContact O-CB 3.42Å; F182-S186 PolarHBondContact O-N 2.79Å; F182-S186 PolarHBondContact O-OG 3.32Å; G183-S186 PolarHBondContact O-OG 2.88Å; S186-A190 WeakPolarHBondContact O-CA 3.39Å; S186-A190 WeakPolarHBondContact O-CB 3.29Å; S186-A190 PolarHBondContact O-N 3.47Å
187	F	94.8	Very high	93.1	Very high	47 Å²	47	47.4 Å²	47.4	21%	0.206	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-48.3	171.1	166.5	-107.1	0	0	0	112.4	G146 N149 I150 G183 A184 L185 A190 E191	G146-F187 WeakPolarHBondContact O-CD2 3.45Å; G146-F187 VanDerWaalsContact O-CE2 3.31Å; G146-F187 WeakPolarHBondContact O-CE2 3.25Å; N149-F187 WeakPolarHBondContact ND2-CB 3.47Å; I150-F187 HydrophobicContact CB-CD2 4.25Å; I150-F187 HydrophobicContact CB-CE2 4Å; I150-F187 HydrophobicContact CB-CZ 4.24Å; I150-F187 HydrophobicContact CD1-CE1 4.39Å; I150-F187 HydrophobicContact CG2-CE2 4.2Å; G183-F187 PolarHBondContact O-N 2.95Å; A184-F187 WeakPolarHBondContact O-CB 3.37Å; A184-F187 PolarHBondContact O-N 3.02Å; L185-F187 VanDerWaalsContact C-N 3.29Å; L185-F187 PolarHBondContact O-N 2.82Å; F187-A190 WeakPolarHBondContact O-CA 3.46Å; F187-A190 VanDerWaalsContact O-CB 3.31Å; F187-A190 WeakPolarHBondContact O-CB 3.32Å; F187-A190 PolarHBondContact O-N 2.71Å; F187-A190 VanDerWaalsContact O-N 3.11Å; F187-E191 HydrophobicContact CD2-CG 4.05Å; F187-E191 HydrophobicContact CE1-CG 4.4Å; F187-E191 HydrophobicContact CE2-CG 3.5Å; F187-E191 VanDerWaalsContact CE2-CG 3.5Å; F187-E191 WeakPolarHBondContact CE2-OE1 3.26Å; F187-E191 HydrophobicContact CZ-CG 3.71Å; F187-E191 PolarHBondContact O-N 3.33Å
188	I	95.9	Very high	93.3	Very high	96 Å²	96	50 Å²	50	49%	0.492	24%	0.244	S	C	.	.	H	α-helix	trans	-63.5	-48.7	-178.6	-63.9	165.8	0	0	0	110.3	A184 L185 A190 E191 M192	A184-I188 WeakPolarHBondContact O-CG1 3.17Å; A184-I188 PolarHBondContact O-N 3.02Å; A184-I188 VanDerWaalsContact O-N 3.13Å; L185-I188 PolarHBondContact O-N 2.81Å; I188-A190 PolarHBondContact O-N 3.41Å; I188-E191 PolarHBondContact O-N 3.1Å; I188-M192 HydrophobicContact CG2-CG 4.45Å; I188-M192 VanDerWaalsContact O-CG 3.24Å; I188-M192 WeakPolarHBondContact O-CG 3.05Å; I188-M192 PolarHBondContact O-N 3.2Å
189	I	95.8	Very high	93.3	Very high	45 Å²	45	46.2 Å²	46.2	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-35.8	176.1	-62.8	174.9	0	0	0	109.8	G16 A20 L23 L185 M192 V193	G16-I189 WeakPolarHBondContact O-CG2 3.37Å; A20-I189 HydrophobicContact CB-CB 4.33Å; A20-I189 HydrophobicContact CB-CG2 4.01Å; L23-I189 HydrophobicContact CD1-CD1 3.88Å; L185-I189 HydrophobicContact CD1-CD1 4.38Å; L185-I189 HydrophobicContact CG-CD1 4.05Å; L185-I189 WeakPolarHBondContact O-CG1 3.29Å; L185-I189 PolarHBondContact O-N 3.29Å; I189-M192 PolarHBondContact O-N 3.06Å; I189-V193 HydrophobicContact CG2-CG2 4.36Å; I189-V193 WeakPolarHBondContact O-CB 3.13Å; I189-V193 WeakPolarHBondContact O-CG2 3.36Å; I189-V193 PolarHBondContact O-N 2.96Å
190	A	95	Very high	93.2	Very high	2 Å²	2	46.6 Å²	46.6	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-60.1	176.9	0	0	0	0	0	110.6	A20 L115 F142 S186 F187 I188 M192 V193 G194	A20-A190 HydrophobicContact CB-CB 4.45Å; L115-A190 HydrophobicContact CD2-CB 4.07Å; F142-A190 HydrophobicContact CD1-CB 4.23Å; F142-A190 WeakPolarHBondContact CD1-O 3.32Å; F142-A190 VanDerWaalsContact CE1-C 3.48Å; F142-A190 HydrophobicContact CE1-CB 3.83Å; F142-A190 WeakPolarHBondContact CE1-O 3.29Å; F142-A190 HydrophobicContact CZ-CB 4.34Å; S186-A190 WeakPolarHBondContact O-CA 3.39Å; S186-A190 WeakPolarHBondContact O-CB 3.29Å; S186-A190 PolarHBondContact O-N 3.47Å; F187-A190 WeakPolarHBondContact O-CA 3.46Å; F187-A190 VanDerWaalsContact O-CB 3.31Å; F187-A190 WeakPolarHBondContact O-CB 3.32Å; F187-A190 PolarHBondContact O-N 2.71Å; F187-A190 VanDerWaalsContact O-N 3.11Å; I188-A190 PolarHBondContact O-N 3.41Å; A190-M192 VanDerWaalsContact C-N 3.3Å; A190-M192 PolarHBondContact O-N 2.81Å; A190-V193 PolarHBondContact O-N 2.87Å; A190-G194 PolarHBondContact O-N 3.44Å
191	E	94.8	Very high	93.2	Very high	40 Å²	40	47.1 Å²	47.1	19%	0.187	24%	0.237	C	C	.	.	H	α-helix	trans	-56.9	-41.8	179.5	-69.5	-63.7	158.9	0	0	112.6	F187 I188 V193 G194 V195	F187-E191 HydrophobicContact CD2-CG 4.05Å; F187-E191 HydrophobicContact CE1-CG 4.4Å; F187-E191 HydrophobicContact CE2-CG 3.5Å; F187-E191 VanDerWaalsContact CE2-CG 3.5Å; F187-E191 WeakPolarHBondContact CE2-OE1 3.26Å; F187-E191 HydrophobicContact CZ-CG 3.71Å; F187-E191 PolarHBondContact O-N 3.33Å; I188-E191 PolarHBondContact O-N 3.1Å; E191-V193 PolarHBondContact O-N 3.49Å; E191-G194 PolarHBondContact O-N 3.33Å; E191-V195 WeakPolarHBondContact O-CG2 3.32Å; E191-V195 PolarHBondContact O-N 3.04Å
192	M	94.1	Very high	93.1	Very high	114 Å²	114	44.6 Å²	44.6	56%	0.562	23%	0.232	S	C	*	.	H	α-helix	trans	-61.2	-44.3	178.7	-69.8	-54.5	-62.1	0	0	112.5	I188 I189 A190 V195 L196	I188-M192 HydrophobicContact CG2-CG 4.45Å; I188-M192 VanDerWaalsContact O-CG 3.24Å; I188-M192 WeakPolarHBondContact O-CG 3.05Å; I188-M192 PolarHBondContact O-N 3.2Å; I189-M192 PolarHBondContact O-N 3.06Å; A190-M192 VanDerWaalsContact C-N 3.3Å; A190-M192 PolarHBondContact O-N 2.81Å; M192-V195 PolarHBondContact O-N 3.08Å; M192-L196 WeakPolarHBondContact O-CB 3.46Å; M192-L196 VanDerWaalsContact O-CG 3.22Å; M192-L196 WeakPolarHBondContact O-CG 3.4Å; M192-L196 PolarHBondContact O-N 3.25Å
193	V	94.9	Very high	92.8	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-70.6	-33.7	176.6	162.1	0	0	0	0	111.2	T13 A17 F142 I189 A190 E191 L196 A197	T13-V193 HydrophobicContact CG2-CG1 3.74Å; A17-V193 HydrophobicContact CB-CG1 4.28Å; F142-V193 HydrophobicContact CD1-CB 4.06Å; F142-V193 HydrophobicContact CD1-CG1 3.85Å; F142-V193 HydrophobicContact CE1-CB 3.48Å; F142-V193 VanDerWaalsContact CE1-CB 3.48Å; F142-V193 HydrophobicContact CE1-CG1 3.39Å; F142-V193 HydrophobicContact CE1-CG2 4.47Å; F142-V193 HydrophobicContact CZ-CB 4.23Å; F142-V193 HydrophobicContact CZ-CG1 3.83Å; I189-V193 HydrophobicContact CG2-CG2 4.36Å; I189-V193 WeakPolarHBondContact O-CB 3.13Å; I189-V193 WeakPolarHBondContact O-CG2 3.36Å; I189-V193 PolarHBondContact O-N 2.96Å; A190-V193 PolarHBondContact O-N 2.87Å; E191-V193 PolarHBondContact O-N 3.49Å; V193-L196 PolarHBondContact O-N 3.13Å; V193-A197 WeakPolarHBondContact O-CB 3.35Å; V193-A197 PolarHBondContact O-N 3.43Å
194	G	94.3	Very high	92.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-47.9	172.3	0	0	0	0	0	112	A190 E191 A197 V198	A190-G194 PolarHBondContact O-N 3.44Å; E191-G194 PolarHBondContact O-N 3.33Å; G194-A197 PolarHBondContact O-N 2.95Å; G194-V198 WeakPolarHBondContact O-CG2 3.12Å; G194-V198 PolarHBondContact O-N 2.73Å
195	V	93.8	Very high	92	Very high	87 Å²	87	47.9 Å²	47.9	53%	0.527	24%	0.241	S	C	.	.	H	α-helix	trans	-62.2	-43.3	174.9	173.1	0	0	0	0	111.1	E191 M192 A197 V198 H199	E191-V195 WeakPolarHBondContact O-CG2 3.32Å; E191-V195 PolarHBondContact O-N 3.04Å; M192-V195 PolarHBondContact O-N 3.08Å; V195-A197 VanDerWaalsContact C-N 3.34Å; V195-A197 PolarHBondContact O-N 3.49Å; V195-V198 PolarHBondContact O-N 3.07Å; V195-H199 WeakPolarHBondContact O-CB 3.03Å; V195-H199 PolarHBondContact O-N 2.78Å
196	L	91.9	Very high	91.6	Very high	43 Å²	43	50.4 Å²	50.4	23%	0.225	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-39.3	175.8	-73.8	169.7	0	0	0	112.3	Q9 L12 M192 V193 H199 M200	Q9-L196 HydrophobicContact CG-CD2 4.38Å; L12-L196 HydrophobicContact CD2-CD1 3.45Å; L12-L196 VanDerWaalsContact CD2-CD1 3.45Å; M192-L196 WeakPolarHBondContact O-CB 3.46Å; M192-L196 VanDerWaalsContact O-CG 3.22Å; M192-L196 WeakPolarHBondContact O-CG 3.4Å; M192-L196 PolarHBondContact O-N 3.25Å; V193-L196 PolarHBondContact O-N 3.13Å; L196-H199 PolarHBondContact O-N 3.22Å; L196-M200 WeakPolarHBondContact O-CB 3.49Å; L196-M200 PolarHBondContact O-N 3.45Å
197	A	91.4	Very high	91.1	Very high	3 Å²	3	54.1 Å²	54.1	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-44	176.7	0	0	0	0	0	111.7	T13 V193 G194 V195 M200 F201	T13-A197 HydrophobicContact CG2-CB 4.48Å; V193-A197 WeakPolarHBondContact O-CB 3.35Å; V193-A197 PolarHBondContact O-N 3.43Å; G194-A197 PolarHBondContact O-N 2.95Å; V195-A197 VanDerWaalsContact C-N 3.34Å; V195-A197 PolarHBondContact O-N 3.49Å; A197-M200 PolarHBondContact O-N 3.02Å; A197-F201 PolarHBondContact O-N 3.31Å
198	V	91.1	Very high	90.5	Very high	56 Å²	56	55 Å²	55	34%	0.339	27%	0.272	S	S	.	.	H	α-helix	trans	-65.5	-41.7	175.3	175.2	0	0	0	0	111.1	G194 V195 M200 F201 I202	G194-V198 WeakPolarHBondContact O-CG2 3.12Å; G194-V198 PolarHBondContact O-N 2.73Å; V195-V198 PolarHBondContact O-N 3.07Å; V198-M200 PolarHBondContact O-N 3.38Å; V198-F201 WeakPolarHBondContact O-CB 3.27Å; V198-F201 PolarHBondContact O-N 3.29Å; V198-I202 HydrophobicContact CG1-CD1 3.98Å; V198-I202 HydrophobicContact CG1-CG1 4.47Å; V198-I202 WeakPolarHBondContact O-CG1 3.38Å; V198-I202 PolarHBondContact O-N 3.42Å
199	H	90.4	Very high	90	Very high	95 Å²	95	57.1 Å²	57.1	44%	0.44	27%	0.274	S	S	.	.	H	α-helix	trans	-60.1	-47.4	175.5	-171.9	-80.6	0	0	0	111.3	V195 L196 F201 I202 D203	V195-H199 WeakPolarHBondContact O-CB 3.03Å; V195-H199 PolarHBondContact O-N 2.78Å; L196-H199 PolarHBondContact O-N 3.22Å; H199-F201 VanDerWaalsContact C-N 3.26Å; H199-F201 PolarHBondContact O-N 3.34Å; H199-I202 PolarHBondContact O-N 3.26Å; H199-D203 IonicContact CE1-OD1 3.96Å; H199-D203 IonicContact CE1-OD2 2.71Å; H199-D203 PolarHBondContact CE1-OD2 3.2Å; H199-D203 IonicContact ND1-OD2 3.58Å; H199-D203 PolarHBondContact ND1-OD2 2.66Å; H199-D203 IonicContact NE2-OD2 3.41Å; H199-D203 PolarHBondContact O-N 3Å
200	M	88.4	Confident	89.5	Confident	11 Å²	11	57.8 Å²	57.8	5%	0.054	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-35.6	176.3	-177.4	159.9	66.1	0	0	112.1	M10 I135 L196 A197 V198 R204	M10-M200 HydrophobicContact CB-CE 4.37Å; M10-M200 HydrophobicContact CB-SD 4.26Å; M10-M200 HydrophobicContact CG-CE 4.16Å; I135-M200 HydrophobicContact CD1-CB 4.18Å; I135-M200 HydrophobicContact CD1-CE 3.27Å; I135-M200 HydrophobicContact CD1-CG 3.91Å; I135-M200 HydrophobicContact CD1-SD 4.31Å; L196-M200 WeakPolarHBondContact O-CB 3.49Å; L196-M200 PolarHBondContact O-N 3.45Å; A197-M200 PolarHBondContact O-N 3.02Å; V198-M200 PolarHBondContact O-N 3.38Å; M200-R204 VanDerWaalsContact O-CB 3.29Å; M200-R204 WeakPolarHBondContact O-CB 3.44Å; M200-R204 PolarHBondContact O-N 3.03Å
201	F	88.8	Confident	88.8	Confident	32 Å²	32	61.6 Å²	61.6	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-64.8	-48	172.5	172.4	-101	0	0	0	112.2	H132 I135 L136 A197 V198 H199 D203 R204 H205	H132-F201 WeakPolarHBondContact O-CD2 3.44Å; H132-F201 VanDerWaalsContact O-CE2 3.28Å; H132-F201 WeakPolarHBondContact O-CE2 3.3Å; I135-F201 HydrophobicContact CG2-CB 4.03Å; I135-F201 HydrophobicContact CG2-CD2 3.63Å; I135-F201 HydrophobicContact CG2-CG 4.29Å; L136-F201 HydrophobicContact CB-CD1 4.33Å; L136-F201 HydrophobicContact CB-CD2 3.91Å; L136-F201 HydrophobicContact CB-CE1 4.34Å; L136-F201 HydrophobicContact CB-CE2 3.88Å; L136-F201 HydrophobicContact CB-CG 4.11Å; L136-F201 HydrophobicContact CB-CZ 4.1Å; L136-F201 HydrophobicContact CD1-CD1 3.78Å; L136-F201 HydrophobicContact CD1-CE1 3.3Å; L136-F201 HydrophobicContact CD1-CE2 4.19Å; L136-F201 HydrophobicContact CD1-CG 4.41Å; L136-F201 HydrophobicContact CD1-CZ 3.52Å; L136-F201 HydrophobicContact CG-CE1 4.42Å; L136-F201 HydrophobicContact CG-CZ 4.45Å; A197-F201 PolarHBondContact O-N 3.31Å; V198-F201 WeakPolarHBondContact O-CB 3.27Å; V198-F201 PolarHBondContact O-N 3.29Å; H199-F201 VanDerWaalsContact C-N 3.26Å; H199-F201 PolarHBondContact O-N 3.34Å; F201-D203 PolarHBondContact O-N 3.35Å; F201-R204 PolarHBondContact O-N 3.04Å; F201-H205 WeakPolarHBondContact O-CB 3.27Å; F201-H205 PolarHBondContact O-N 3.37Å
202	I	90.3	Very high	88.2	Confident	74 Å²	74	62 Å²	62	38%	0.379	32%	0.319	S	S	.	.	H	α-helix	trans	-60.8	-46.9	179.5	-68.6	166.4	0	0	0	110.5	V198 H199 R204 H205 K206	V198-I202 HydrophobicContact CG1-CD1 3.98Å; V198-I202 HydrophobicContact CG1-CG1 4.47Å; V198-I202 WeakPolarHBondContact O-CG1 3.38Å; V198-I202 PolarHBondContact O-N 3.42Å; H199-I202 PolarHBondContact O-N 3.26Å; I202-R204 VanDerWaalsContact C-N 3.29Å; I202-R204 PolarHBondContact O-N 3.33Å; I202-H205 CarbonylContact O-C 3.6Å; I202-H205 PolarHBondContact O-N 3.09Å; I202-H205 VanDerWaalsContact O-N 3.12Å; I202-K206 HydrophobicContact CG2-CD 4.15Å; I202-K206 HydrophobicContact CG2-CG 4.38Å; I202-K206 WeakPolarHBondContact O-CG 3.27Å; I202-K206 PolarHBondContact O-N 3.13Å
203	D	87.1	Confident	87.5	Confident	48 Å²	48	63.6 Å²	63.6	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-38.7	179.4	-74.3	-20	0	0	0	111.8	H199 F201 H205 K206 Q207	H199-D203 IonicContact CE1-OD1 3.96Å; H199-D203 IonicContact CE1-OD2 2.71Å; H199-D203 PolarHBondContact CE1-OD2 3.2Å; H199-D203 IonicContact ND1-OD2 3.58Å; H199-D203 PolarHBondContact ND1-OD2 2.66Å; H199-D203 IonicContact NE2-OD2 3.41Å; H199-D203 PolarHBondContact O-N 3Å; F201-D203 PolarHBondContact O-N 3.35Å; D203-H205 VanDerWaalsContact C-N 3.34Å; D203-K206 PolarHBondContact O-N 2.89Å; D203-Q207 VanDerWaalsContact O-CG 3.32Å; D203-Q207 WeakPolarHBondContact O-CG 3.18Å; D203-Q207 PolarHBondContact O-N 2.96Å
204	R	83.5	Confident	86.6	Confident	65 Å²	65	65.7 Å²	65.7	25%	0.245	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-42.5	172.9	-171.7	43.6	155.6	-159.7	7.4	111.5	M200 F201 I202 Q207 L208	M200-R204 VanDerWaalsContact O-CB 3.29Å; M200-R204 WeakPolarHBondContact O-CB 3.44Å; M200-R204 PolarHBondContact O-N 3.03Å; F201-R204 PolarHBondContact O-N 3.04Å; I202-R204 VanDerWaalsContact C-N 3.29Å; I202-R204 PolarHBondContact O-N 3.33Å; R204-Q207 PolarHBondContact O-N 3.47Å; R204-L208 HydrophobicContact CG-CD1 4.36Å; R204-L208 WeakPolarHBondContact O-CG 3.38Å; R204-L208 PolarHBondContact O-N 3.09Å
205	H	85.5	Confident	85.6	Confident	68 Å²	68	69 Å²	69	32%	0.315	36%	0.357	S	S	.	.	H	α-helix	trans	-67.6	-36.6	178.4	-162.1	-49	0	0	0	112.1	F201 I202 D203 L208 R209	F201-H205 WeakPolarHBondContact O-CB 3.27Å; F201-H205 PolarHBondContact O-N 3.37Å; I202-H205 CarbonylContact O-C 3.6Å; I202-H205 PolarHBondContact O-N 3.09Å; I202-H205 VanDerWaalsContact O-N 3.12Å; D203-H205 VanDerWaalsContact C-N 3.34Å; H205-L208 PolarHBondContact O-N 2.85Å; H205-R209 VanDerWaalsContact CE1-CZ 3.49Å; H205-R209 PolarHBondContact CE1-NE 3.3Å; H205-R209 PolarHBondContact CE1-NH2 2.67Å; H205-R209 PolarHBondContact ND1-NE 2.04Å; H205-R209 WeakPolarHBondContact O-CG 3.24Å; H205-R209 PolarHBondContact O-N 3.29Å
206	K	87.1	Confident	84.6	Confident	128 Å²	128	69.6 Å²	69.6	56%	0.557	36%	0.357	S	S	*	.	H	α-helix	trans	-62.3	-44.6	172.7	-75	175.2	-178.7	169.3	0	111.1	I202 D203 R209 A210	I202-K206 HydrophobicContact CG2-CD 4.15Å; I202-K206 HydrophobicContact CG2-CG 4.38Å; I202-K206 WeakPolarHBondContact O-CG 3.27Å; I202-K206 PolarHBondContact O-N 3.13Å; D203-K206 PolarHBondContact O-N 2.89Å; K206-R209 PolarHBondContact O-N 3.01Å; K206-A210 WeakPolarHBondContact O-CB 3.33Å; K206-A210 PolarHBondContact O-N 3.15Å
207	Q	83.8	Confident	83.2	Confident	79 Å²	79	75.7 Å²	75.7	37%	0.369	38%	0.378	S	S	.	.	H	α-helix	trans	-59.9	-48.5	175.4	-73.9	174.2	-3.2	0	0	111.5	D203 R204 R209 A210 T211	D203-Q207 VanDerWaalsContact O-CG 3.32Å; D203-Q207 WeakPolarHBondContact O-CG 3.18Å; D203-Q207 PolarHBondContact O-N 2.96Å; R204-Q207 PolarHBondContact O-N 3.47Å; Q207-R209 VanDerWaalsContact C-N 3.31Å; Q207-R209 PolarHBondContact O-N 2.03Å; Q207-A210 WeakPolarHBondContact O-CB 3.26Å; Q207-A210 PolarHBondContact O-N 3.26Å; Q207-T211 PolarHBondContact O-N 3.29Å; Q207-T211 PolarHBondContact O-OG1 2.93Å
208	L	83.1	Confident	82.1	Confident	64 Å²	64	81.1 Å²	81.1	34%	0.335	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-41.8	178.4	-68.5	166.3	0	0	0	112.2	H132 R204 H205 A210 T211 A212	H132-L208 WeakPolarHBondContact CD2-CD1 3.42Å; H132-L208 WeakPolarHBondContact NE2-CD1 3.44Å; R204-L208 HydrophobicContact CG-CD1 4.36Å; R204-L208 WeakPolarHBondContact O-CG 3.38Å; R204-L208 PolarHBondContact O-N 3.09Å; H205-L208 PolarHBondContact O-N 2.85Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-A210 PolarHBondContact O-N 2.91Å; L208-T211 PolarHBondContact O-N 3.15Å; L208-A212 WeakPolarHBondContact O-CB 3.17Å; L208-A212 PolarHBondContact O-N 3.25Å
209	R	84.3	Confident	80.9	Confident	142 Å²	142	84.3 Å²	84.3	54%	0.536	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-36	174.3	-74.2	-177.7	-176.8	159.8	10.2	112.5	H205 K206 Q207 R213	H205-R209 VanDerWaalsContact CE1-CZ 3.49Å; H205-R209 PolarHBondContact CE1-NE 3.3Å; H205-R209 PolarHBondContact CE1-NH2 2.67Å; H205-R209 PolarHBondContact ND1-NE 2.04Å; H205-R209 WeakPolarHBondContact O-CG 3.24Å; H205-R209 PolarHBondContact O-N 3.29Å; K206-R209 PolarHBondContact O-N 3.01Å; Q207-R209 VanDerWaalsContact C-N 3.31Å; Q207-R209 PolarHBondContact O-N 2.03Å; R209-R213 WeakPolarHBondContact O-CG 3.25Å; R209-R213 PolarHBondContact O-N 2.88Å; R209-R213 VanDerWaalsContact O-N 3.16Å
210	A	85.7	Confident	79.4	Confident	58 Å²	58	82.3 Å²	82.3	48%	0.479	42%	0.418	S	S	.	.	H	α-helix	trans	-68.8	-43.3	176.5	0	0	0	0	0	111.6	K206 Q207 L208 R213 A214	K206-A210 WeakPolarHBondContact O-CB 3.33Å; K206-A210 PolarHBondContact O-N 3.15Å; Q207-A210 WeakPolarHBondContact O-CB 3.26Å; Q207-A210 PolarHBondContact O-N 3.26Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-A210 PolarHBondContact O-N 2.91Å; A210-R213 PolarHBondContact O-N 3.34Å; A210-A214 WeakPolarHBondContact O-CB 3.43Å; A210-A214 PolarHBondContact O-N 3.02Å
211	T	81	Confident	77.9	Confident	83 Å²	83	83.7 Å²	83.7	51%	0.509	43%	0.429	S	S	.	.	H	α-helix	trans	-66.1	-40.6	176.9	-33.7	0	0	0	0	111.7	Q207 L208 A214 T215	Q207-T211 PolarHBondContact O-N 3.29Å; Q207-T211 PolarHBondContact O-OG1 2.93Å; L208-T211 PolarHBondContact O-N 3.15Å; T211-A214 WeakPolarHBondContact O-CB 3.21Å; T211-A214 PolarHBondContact O-N 3.36Å; T211-T215 WeakPolarHBondContact O-CG2 3.3Å; T211-T215 PolarHBondContact O-N 3.05Å; T211-T215 PolarHBondContact O-OG1 3.28Å
212	A	81.9	Confident	76.4	Confident	47 Å²	47	84.9 Å²	84.9	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-60.7	-45.1	175.9	0	0	0	0	0	112	L208 A214 T215 D216	L208-A212 WeakPolarHBondContact O-CB 3.17Å; L208-A212 PolarHBondContact O-N 3.25Å; A212-A214 VanDerWaalsContact C-N 3.33Å; A212-A214 PolarHBondContact O-N 3.46Å; A212-T215 WeakPolarHBondContact CA-OG1 3.35Å; A212-T215 PolarHBondContact O-N 3.33Å; A212-T215 PolarHBondContact O-OG1 3.13Å; A212-D216 VanDerWaalsContact O-CG 3.26Å; A212-D216 PolarHBondContact O-N 3.13Å
213	R	78.9	Confident	74.9	Confident	149 Å²	149	86.6 Å²	86.6	56%	0.562	45%	0.453	S	S	*	.	H	α-helix	trans	-61.5	-42.8	173.3	-71.7	-175.9	-170.8	110.4	-5.7	111.6	R209 A210 T215 D216 Y217	R209-R213 WeakPolarHBondContact O-CG 3.25Å; R209-R213 PolarHBondContact O-N 2.88Å; R209-R213 VanDerWaalsContact O-N 3.16Å; A210-R213 PolarHBondContact O-N 3.34Å; R213-T215 VanDerWaalsContact C-N 3.34Å; R213-T215 PolarHBondContact O-N 3.1Å; R213-D216 PolarHBondContact O-N 2.84Å; R213-Y217 HydrophobicContact CB-CE2 4.19Å; R213-Y217 WeakPolarHBondContact O-CD2 3.33Å; R213-Y217 PolarHBondContact O-N 3.45Å
214	A	75.3	Confident	73.4	Confident	47 Å²	47	89.9 Å²	89.9	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-38.3	177.1	0	0	0	0	0	112.6	A210 T211 A212 Y217 L218	A210-A214 WeakPolarHBondContact O-CB 3.43Å; A210-A214 PolarHBondContact O-N 3.02Å; T211-A214 WeakPolarHBondContact O-CB 3.21Å; T211-A214 PolarHBondContact O-N 3.36Å; A212-A214 VanDerWaalsContact C-N 3.33Å; A212-A214 PolarHBondContact O-N 3.46Å; A214-Y217 PolarHBondContact O-N 3.23Å; A214-L218 WeakPolarHBondContact O-CB 3.41Å; A214-L218 WeakPolarHBondContact O-CG 2.93Å; A214-L218 PolarHBondContact O-N 2.73Å
215	T	74.8	Confident	72	Confident	69 Å²	69	96.3 Å²	96.3	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-68.3	-37.1	174.1	50.4	0	0	0	0	112	T211 A212 R213 L218 Q219	T211-T215 WeakPolarHBondContact O-CG2 3.3Å; T211-T215 PolarHBondContact O-N 3.05Å; T211-T215 PolarHBondContact O-OG1 3.28Å; A212-T215 WeakPolarHBondContact CA-OG1 3.35Å; A212-T215 PolarHBondContact O-N 3.33Å; A212-T215 PolarHBondContact O-OG1 3.13Å; R213-T215 VanDerWaalsContact C-N 3.34Å; R213-T215 PolarHBondContact O-N 3.1Å; T215-L218 PolarHBondContact O-N 2.93Å; T215-Q219 VanDerWaalsContact O-CB 3.24Å; T215-Q219 WeakPolarHBondContact O-CB 3.27Å; T215-Q219 PolarHBondContact O-N 2.91Å
216	D	71.7	Confident	70.5	Confident	100 Å²	100	99 Å²	99	54%	0.535	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-41.6	174.6	-67.4	-21.8	0	0	0	111.3	A212 R213 Q219 A220	A212-D216 VanDerWaalsContact O-CG 3.26Å; A212-D216 PolarHBondContact O-N 3.13Å; R213-D216 PolarHBondContact O-N 2.84Å; D216-Q219 PolarHBondContact O-N 3.26Å; D216-A220 WeakPolarHBondContact O-CB 3.07Å; D216-A220 PolarHBondContact O-N 2.88Å
217	Y	64.1	Low	68.6	Low	171 Å²	171	97.5 Å²	97.5	67%	0.671	52%	0.518	S	S	*	.	H	α-helix	trans	-63.8	-42	173	-71.8	-63.6	0	0	0	112.1	R213 A214 S221	R213-Y217 HydrophobicContact CB-CE2 4.19Å; R213-Y217 WeakPolarHBondContact O-CD2 3.33Å; R213-Y217 PolarHBondContact O-N 3.45Å; A214-Y217 PolarHBondContact O-N 3.23Å; Y217-S221 VanDerWaalsContact O-CB 3.28Å; Y217-S221 WeakPolarHBondContact O-CB 3.45Å; Y217-S221 PolarHBondContact O-N 3.06Å; Y217-S221 PolarHBondContact O-OG 3.4Å
218	L	66.3	Low	67.2	Low	118 Å²	118	99.7 Å²	99.7	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-67.5	-40.3	177.1	-77.1	172.1	0	0	0	111.9	A214 T215 S221 A222	A214-L218 WeakPolarHBondContact O-CB 3.41Å; A214-L218 WeakPolarHBondContact O-CG 2.93Å; A214-L218 PolarHBondContact O-N 2.73Å; T215-L218 PolarHBondContact O-N 2.93Å; L218-S221 WeakPolarHBondContact CA-OG 3.34Å; L218-S221 CarbonylContact O-C 3.56Å; L218-S221 PolarHBondContact O-N 3.38Å; L218-S221 PolarHBondContact O-OG 2.9Å; L218-A222 VanDerWaalsContact O-CB 3.3Å; L218-A222 WeakPolarHBondContact O-CB 3.3Å; L218-A222 PolarHBondContact O-N 3.4Å
219	Q	66.4	Low	65.6	Low	122 Å²	122	105.8 Å²	105.8	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-70.1	-40.2	177.6	-172.4	167.8	-14.4	0	0	111.6	T215 D216 S221 A222 I223	T215-Q219 VanDerWaalsContact O-CB 3.24Å; T215-Q219 WeakPolarHBondContact O-CB 3.27Å; T215-Q219 PolarHBondContact O-N 2.91Å; D216-Q219 PolarHBondContact O-N 3.26Å; Q219-S221 VanDerWaalsContact C-N 3.33Å; Q219-S221 PolarHBondContact O-N 2.74Å; Q219-A222 PolarHBondContact O-N 2.94Å; Q219-I223 HydrophobicContact CG-CD1 4.15Å; Q219-I223 VanDerWaalsContact O-CG1 3.24Å; Q219-I223 WeakPolarHBondContact O-CG1 3.35Å; Q219-I223 PolarHBondContact O-N 2.75Å
220	A	58.3	Low	63.9	Low	54 Å²	54	110.5 Å²	110.5	45%	0.446	58%	0.58	S	S	.	*	H	α-helix	trans	-60.6	-43.1	170.2	0	0	0	0	0	111.3	D216 A222 I223 T224	D216-A220 WeakPolarHBondContact O-CB 3.07Å; D216-A220 PolarHBondContact O-N 2.88Å; A220-A222 PolarHBondContact O-N 3.39Å; A220-I223 PolarHBondContact O-N 2.83Å; A220-T224 WeakPolarHBondContact O-CG2 3.35Å; A220-T224 PolarHBondContact O-N 2.71Å; A220-T224 PolarHBondContact O-OG1 2.9Å
221	S	58.9	Low	62.1	Low	40 Å²	40	119 Å²	119	28%	0.28	60%	0.601	S	S	.	*	H	α-helix	trans	-67.7	-33.2	176.4	77.4	0	0	0	0	113	Y217 L218 Q219 T224 R225	Y217-S221 VanDerWaalsContact O-CB 3.28Å; Y217-S221 WeakPolarHBondContact O-CB 3.45Å; Y217-S221 PolarHBondContact O-N 3.06Å; Y217-S221 PolarHBondContact O-OG 3.4Å; L218-S221 WeakPolarHBondContact CA-OG 3.34Å; L218-S221 CarbonylContact O-C 3.56Å; L218-S221 PolarHBondContact O-N 3.38Å; L218-S221 PolarHBondContact O-OG 2.9Å; Q219-S221 VanDerWaalsContact C-N 3.33Å; Q219-S221 PolarHBondContact O-N 2.74Å; S221-T224 WeakPolarHBondContact CA-OG1 3.34Å; S221-T224 PolarHBondContact O-N 3.4Å; S221-T224 PolarHBondContact O-OG1 2.94Å; S221-R225 WeakPolarHBondContact O-CB 3.27Å; S221-R225 WeakPolarHBondContact O-CG 3.23Å; S221-R225 PolarHBondContact O-N 3.45Å; S221-R225 VanDerWaalsContact O-N 3.11Å
222	A	56.6	Low	60.5	Low	56 Å²	56	125.8 Å²	125.8	46%	0.463	62%	0.617	S	S	.	*	H	α-helix	trans	-71.5	-36.5	175.7	0	0	0	0	0	111.9	L218 Q219 A220 R225 I226	L218-A222 VanDerWaalsContact O-CB 3.3Å; L218-A222 WeakPolarHBondContact O-CB 3.3Å; L218-A222 PolarHBondContact O-N 3.4Å; Q219-A222 PolarHBondContact O-N 2.94Å; A220-A222 PolarHBondContact O-N 3.39Å; A222-R225 PolarHBondContact O-N 2.72Å; A222-R225 VanDerWaalsContact O-N 3.14Å; A222-I226 PolarHBondContact O-N 3.07Å
223	I	57.9	Low	58.6	Low	110 Å²	110	134.2 Å²	134.2	56%	0.564	64%	0.64	S	S	*	*	H	α-helix	trans	-68.1	-35.3	174.2	-67.5	165.2	0	0	0	110.7	Q219 A220 R225	Q219-I223 HydrophobicContact CG-CD1 4.15Å; Q219-I223 VanDerWaalsContact O-CG1 3.24Å; Q219-I223 WeakPolarHBondContact O-CG1 3.35Å; Q219-I223 PolarHBondContact O-N 2.75Å; A220-I223 PolarHBondContact O-N 2.83Å; I223-R225 VanDerWaalsContact C-N 3.26Å; I223-R225 PolarHBondContact O-N 3.27Å
224	T	56.5	Low	57	Low	117 Å²	117	136.3 Å²	136.3	72%	0.718	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-12.7	171.3	59.5	0	0	0	0	114.4	A220 S221	A220-T224 WeakPolarHBondContact O-CG2 3.35Å; A220-T224 PolarHBondContact O-N 2.71Å; A220-T224 PolarHBondContact O-OG1 2.9Å; S221-T224 WeakPolarHBondContact CA-OG1 3.34Å; S221-T224 PolarHBondContact O-N 3.4Å; S221-T224 PolarHBondContact O-OG1 2.94Å
225	R	54	Low	55.3	Low	201 Å²	201	145.8 Å²	145.8	76%	0.758	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	5.8	177.6	-86.2	-172	-170.5	172.2	4.8	113.8	S221 A222 I223 P227	S221-R225 WeakPolarHBondContact O-CB 3.27Å; S221-R225 WeakPolarHBondContact O-CG 3.23Å; S221-R225 PolarHBondContact O-N 3.45Å; S221-R225 VanDerWaalsContact O-N 3.11Å; A222-R225 PolarHBondContact O-N 2.72Å; A222-R225 VanDerWaalsContact O-N 3.14Å; I223-R225 VanDerWaalsContact C-N 3.26Å; I223-R225 PolarHBondContact O-N 3.27Å; R225-P227 WeakPolarHBondContact O-CD 3.07Å; R225-P227 VanDerWaalsContact O-N 3.16Å
226	I	54	Low	53.8	Low	124 Å²	124	154 Å²	154	64%	0.636	71%	0.705	S	S	*	*	S	Bend	trans	-68.8	110.2	166	-58.1	173.1	0	0	0	106.4	A222 S228	A222-I226 PolarHBondContact O-N 3.07Å; I226-S228 PolarHBondContact O-N 3.4Å; I226-S228 VanDerWaalsContact O-N 3.16Å
227	P	47.9	Very low	52.1	Low	97 Å²	97	154.7 Å²	154.7	63%	0.63	72%	0.718	S	S	*	*			trans	-68.3	121.2	175.8	-5.7	23.5	0	0	0	106.4	R225 Y229	R225-P227 WeakPolarHBondContact O-CD 3.07Å; R225-P227 VanDerWaalsContact O-N 3.16Å; P227-Y229 HydrophobicContact CB-CD2 4.35Å; P227-Y229 PolarHBondContact O-N 2.88Å
228	S	52.5	Low	50.8	Low	124 Å²	124	158.9 Å²	158.9	87%	0.867	73%	0.733	S	S	*	*			trans	-65.9	52.5	168.3	41.1	0	0	0	0	111.5	I226	I226-S228 PolarHBondContact O-N 3.4Å; I226-S228 VanDerWaalsContact O-N 3.16Å
229	Y	49.9	Very low	49.4	Very low	193 Å²	193	158.8 Å²	158.8	76%	0.757	74%	0.742	S	S	*	*			trans	-100.5	1.1	179.9	-108.2	-87.3	0	0	0	113.9	P227 Y231	P227-Y229 HydrophobicContact CB-CD2 4.35Å; P227-Y229 PolarHBondContact O-N 2.88Å; Y229-Y231 VanDerWaalsContact C-N 3.35Å; Y229-Y231 PolarHBondContact O-N 3.47Å
230	R	49.3	Very low	47.9	Very low	241 Å²	241	158.4 Å²	158.4	91%	0.909	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	12.6	-175.2	-144.8	178.8	-177.2	152.9	1.5	115.7
231	Y	46.8	Very low	46.8	Very low	236 Å²	236	160.6 Å²	160.6	93%	0.925	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	15.6	-178.2	-99.5	-77.5	0	0	0	116.4	Y229	Y229-Y231 VanDerWaalsContact C-N 3.35Å; Y229-Y231 PolarHBondContact O-N 3.47Å
232	R	48.6	Very low	45.5	Very low	225 Å²	225	170.3 Å²	170.3	85%	0.849	80%	0.796	S	S	*	*	S	Bend	trans	-124.2	22	-174.5	-140.6	-176.9	-149.4	167.9	7.7	117.6
233	Y	40.8	Very low	44.4	Very low	224 Å²	224	173.4 Å²	173.4	88%	0.878	81%	0.814	S	S	*	*	S	Bend	trans	-129.7	13.7	-177.6	-100.5	-80.1	0	0	0	117
234	Q	45.7	Very low	43.2	Very low	194 Å²	194	174.1 Å²	174.1	91%	0.907	82%	0.823	S	S	*	*	S	Bend	trans	-116.7	21	-175.5	-148.4	160.8	6.8	0	0	116.4
235	R	41.3	Very low	42.2	Very low	246 Å²	246	176.8 Å²	176.8	93%	0.928	83%	0.828	S	S	*	*	S	Bend	trans	-149.8	68.3	167.7	-77.7	-164.9	-167	174.6	4.5	113
236	R	43.3	Very low	41.6	Very low	240 Å²	240	172.6 Å²	172.6	91%	0.906	83%	0.827	S	S	*	*			trans	-156.4	134.6	149.8	-132.7	168.2	-177.4	171.2	-0.3	110.2
237	S	35	Very low	40.6	Very low	115 Å²	115	172.7 Å²	172.7	80%	0.804	84%	0.839	S	S	*	*			trans	96.6	92.7	169.8	-46.1	0	0	0	0	116.6
238	R	36.2	Very low	39.8	Very low	259 Å²	259	176.6 Å²	176.6	98%	0.977	85%	0.848	S	S	*	*				-164.5	114.2	120.4	-109.3	174.5	178.1	172.4	-0.7	110.9
239	S	36.9	Very low	39	Very low	117 Å²	117	176.1 Å²	176.1	82%	0.818	85%	0.845	S	S	*	*			trans	-104.2	161.9	168.8	29.5	0	0	0	0	109.6
240	S	35.3	Very low	38.4	Very low	114 Å²	114	177.1 Å²	177.1	80%	0.797	85%	0.847	S	S	*	*			trans	86.7	129.9	173.5	176.8	0	0	0	0	115.5
241	S	34.3	Very low	37.6	Very low	99 Å²	99	172.2 Å²	172.2	69%	0.692	84%	0.839	S	S	*	*			cis	-169.2	156.3	0.2	-86.3	0	0	0	0	110.1
242	R	32.4	Very low	36.9	Very low	244 Å²	244	165.7 Å²	165.7	92%	0.921	83%	0.834	S	S	*	*			trans	67.4	114.6	154	-75.5	179.3	172.6	-171.4	-2.6	120.7
243	S	33	Very low	36.3	Very low	122 Å²	122	160.2 Å²	160.2	85%	0.853	83%	0.83	S	S	*	*				-164.6	153	116.5	60.2	0	0	0	0	111.2
244	T	34	Very low	36.5	Very low	124 Å²	124	155 Å²	155	76%	0.761	82%	0.824	S	S	*	*			trans	-79.8	159.5	-168.4	40.4	0	0	0	0	114.8
245	E	33.9	Very low	35.8	Very low	173 Å²	173	152.5 Å²	152.5	81%	0.808	82%	0.821	S	S	*	*			trans	135.4	131.3	137.3	-141.8	70.4	-155.9	0	0	112.9
246	P	42.7	Very low	35.3	Very low	114 Å²	114	143.9 Å²	143.9	74%	0.74	81%	0.809	S	S	*	*			trans	-102.1	147.3	-173.4	36.8	-28.5	0	0	0	112.7
247	S	32.3	Very low	34.9	Very low	126 Å²	126	138.9 Å²	138.9	88%	0.881	81%	0.805	S	S	*	*			trans	-155.2	132.6	157.1	51.9	0	0	0	0	114.7
248	H	31.2	Very low	34.7	Very low	179 Å²	179	143.2 Å²	143.2	83%	0.829	81%	0.809	S	S	*	*			trans	-44.2	144.9	171.7	-96.3	-108.8	0	0	0	117.5
249	S	36.4	Very low	34.5	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	80%	0.797	S	S	*	*				169.8	107.6	124.7	41.5	0	0	0	0	108.9
250	R	37.7	Very low	34.2	Very low	213 Å²	213	137.7 Å²	137.7	80%	0.804	80%	0.798	S	S	*	*				72.5	114.5	88.7	-89.2	-168.8	138.8	136.8	2.6	115.9
251	D	31.8	Very low	33.9	Very low	139 Å²	139	137.9 Å²	137.9	74%	0.743	79%	0.79	S	S	*	*			trans	68.4	142	138.3	-50.8	-28.8	0	0	0	117.5
252	A	31.8	Very low	33.9	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	80%	0.798	S	S	*	*			cis	-159.4	154.3	8.7	0	0	0	0	0	109.3
253	S	35.3	Very low	34.2	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	79%	0.792	S	S	*	*			trans	-86.9	158.8	157.3	-134.9	0	0	0	0	108.5
254	P	45	Very low	34.7	Very low	115 Å²	115	134.9 Å²	134.9	75%	0.747	79%	0.785	S	S	*	*				-154.6	151.2	84.8	36	-14.9	0	0	0	117.9
255	V	32.9	Very low	34.5	Very low	140 Å²	140	134.7 Å²	134.7	85%	0.848	79%	0.789	S	S	*	*				38.4	127	127.4	-170	0	0	0	0	120
256	G	29	Very low	34.4	Very low	66 Å²	66	132 Å²	132	68%	0.68	78%	0.784	S	S	*	*			trans	175.9	85.7	158	0	0	0	0	0	119.3
257	V	35.7	Very low	33.9	Very low	135 Å²	135	134.5 Å²	134.5	82%	0.818	79%	0.786	S	S	*	*			trans	58.4	105.9	134.1	-165.5	0	0	0	0	121.5
258	K	31.6	Very low	34.1	Very low	206 Å²	206	135.2 Å²	135.2	90%	0.896	78%	0.779	S	S	*	*				36.4	122.9	116.8	-145.9	176.3	-174	179.5	0	120.1
259	G	31.7	Very low	34.1	Very low	70 Å²	70	130.8 Å²	130.8	72%	0.722	77%	0.768	S	S	*	*			trans	138.9	93.2	151.8	0	0	0	0	0	114.1
260	F	30.5	Very low	33.9	Very low	190 Å²	190	134 Å²	134	83%	0.833	77%	0.773	S	S	*	*				78.4	119.9	94.8	-121.9	-100.6	0	0	0	116.5
261	N	29.3	Very low	33.6	Very low	117 Å²	117	133.9 Å²	133.9	63%	0.626	77%	0.774	S	S	*	*			trans	72.1	125	160.9	-63.1	-8	0	0	0	118.8
262	T	34.3	Very low	33.9	Very low	141 Å²	141	133.7 Å²	133.7	87%	0.865	78%	0.778	S	S	*	*				-148	148.4	58.4	45.1	0	0	0	0	115
263	L	37.6	Very low	34	Very low	153 Å²	153	137.3 Å²	137.3	80%	0.801	78%	0.783	S	S	*	*			trans	-73.1	-170.3	-175.7	-76	105.1	0	0	0	115.6
264	P	43.1	Very low	33.6	Very low	108 Å²	108	138.1 Å²	138.1	70%	0.701	79%	0.788	S	S	*	*				-136.2	165.1	-61	39.3	-22.4	0	0	0	113
265	S	31.3	Very low	33.1	Very low	121 Å²	121	144.2 Å²	144.2	85%	0.846	80%	0.796	S	S	*	*			trans	-152.3	95.3	155.4	67.7	0	0	0	0	111.5
266	T	30.9	Very low	33.1	Very low	115 Å²	115	144.9 Å²	144.9	71%	0.706	80%	0.795	S	S	*	*			trans	-116.3	115.3	167.7	41.6	0	0	0	0	106.6
267	E	32.1	Very low	33.5	Very low	167 Å²	167	147 Å²	147	78%	0.78	80%	0.797	S	S	*	*				77.8	149.4	87.6	-76.4	-161.4	156.1	0	0	114.2
268	I	37	Very low	33.2	Very low	141 Å²	141	148 Å²	148	72%	0.723	80%	0.797	S	S	*	*			trans	90.9	100	162.4	-54	133.5	0	0	0	114.1
269	S	32	Very low	33.1	Very low	87 Å²	87	147.3 Å²	147.3	61%	0.608	79%	0.794	S	S	*	*				71.5	127.7	78.6	-179.7	0	0	0	0	114.1
270	M	32.2	Very low	32.9	Very low	182 Å²	182	148.5 Å²	148.5	90%	0.897	80%	0.797	S	S	*	*				-174.5	149.5	125	-105.6	-174.9	-73.3	0	0	114.6
271	Y	30.3	Very low	32.7	Very low	209 Å²	209	143.8 Å²	143.8	82%	0.82	79%	0.793	S	S	*	*			trans	-80.7	168.9	-179.7	-80.3	-107	0	0	0	114
272	T	38.4	Very low	32.7	Very low	136 Å²	136	144.6 Å²	144.6	83%	0.834	80%	0.802	S	S	*	*			trans	93.3	124.1	149	72.5	0	0	0	0	119.3
273	L	34.1	Very low	32.5	Very low	175 Å²	175	143.8 Å²	143.8	92%	0.916	80%	0.797	S	S	*	*			trans	-84	140.2	163	-85.6	167.6	0	0	0	110.3
274	S	27.2	Very low	32.6	Very low	127 Å²	127	141.8 Å²	141.8	89%	0.888	79%	0.793	S	S	*	*			trans	-156.4	157.3	152	-132.8	0	0	0	0	112.1
275	R	34.6	Very low	31.9	Very low	242 Å²	242	144.1 Å²	144.1	91%	0.913	80%	0.799	S	S	*	*			trans	-63	153.2	-155.9	-77.1	172.2	153.5	136.6	-7.5	120.6
276	D	31.4	Very low	31.9	Very low	155 Å²	155	143.2 Å²	143.2	83%	0.829	80%	0.798	S	S	*	*			trans	-15.7	159.6	148.8	-83.4	-35.4	0	0	0	119.6
277	P	38.9	Very low	31.8	Very low	111 Å²	111	143.1 Å²	143.1	72%	0.721	80%	0.798	S	S	*	*			cis	-157.2	172.4	49.1	39.4	-15.4	0	0	0	121.4
278	L	29.5	Very low	31.6	Very low	156 Å²	156	146 Å²	146	82%	0.817	80%	0.803	S	S	*	*			trans	55.3	121.5	152.3	-94.8	87.7	0	0	0	122
279	K	28.6	Very low	31.2	Very low	191 Å²	191	146.4 Å²	146.4	83%	0.83	81%	0.806	S	S	*	*				159.7	126.9	94.5	-132.8	174.1	-174.2	178.2	0	113.3
280	A	27.1	Very low	31	Very low	94 Å²	94	146.8 Å²	146.8	78%	0.777	81%	0.809	S	S	*	*			trans	58.3	120.2	142.1	0	0	0	0	0	123.5
281	A	26.9	Very low	30.8	Very low	91 Å²	91	144.8 Å²	144.8	75%	0.752	80%	0.802	S	S	*	*				109.3	129.3	122.9	0	0	0	0	0	120.4
282	T	29.9	Very low	30.8	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	81%	0.806	S	S	*	*			trans	94.4	106.5	142.7	-8.9	0	0	0	0	119.8
283	T	29.6	Very low	30.5	Very low	124 Å²	124	146.3 Å²	146.3	76%	0.761	80%	0.802	S	S	*	*			trans	-58.2	155.8	151.3	45.7	0	0	0	0	111.7
284	P	40.4	Very low	30.5	Very low	111 Å²	111	145.6 Å²	145.6	72%	0.721	80%	0.799	S	S	*	*				-150.9	153.2	82.2	34.3	-12.6	0	0	0	117.7
285	I	27.6	Very low	30.9	Very low	158 Å²	158	144.9 Å²	144.9	81%	0.81	79%	0.794	S	S	*	*			trans	44.5	117.3	136.3	-52.4	168.6	0	0	0	119.2
286	A	30.7	Very low	30.8	Very low	101 Å²	101	142.3 Å²	142.3	84%	0.835	79%	0.789	S	S	*	*			trans	-152.8	110	138.8	0	0	0	0	0	111
287	T	28.8	Very low	31.3	Very low	114 Å²	114	142.7 Å²	142.7	70%	0.699	79%	0.791	S	S	*	*			trans	-48.4	144.2	158.2	36.7	0	0	0	0	113.3
288	Y	27.3	Very low	31.2	Very low	228 Å²	228	146.4 Å²	146.4	89%	0.894	80%	0.798	S	S	*	*				-178.7	136.3	117.5	-115.8	-95	0	0	0	112
289	N	28.7	Very low	31.4	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	80%	0.797	S	S	*	*			trans	-89	151.9	173.4	-99.6	-36.6	0	0	0	111.4
290	S	29	Very low	31.6	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	79%	0.793	S	S	*	*			trans	58.2	142.9	148.7	91.6	0	0	0	0	123.7
291	D	27.6	Very low	31.9	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	80%	0.796	S	S	*	*			trans	79.1	98.8	151.9	-54	-43.6	0	0	0	120.3
292	R	31.5	Very low	31.9	Very low	238 Å²	238	147.6 Å²	147.6	90%	0.898	80%	0.795	S	S	*	*				-178.6	141.3	105.5	-110.2	155.3	70.6	161.6	-1.5	114.3
293	D	30.4	Very low	32.1	Very low	139 Å²	139	148.2 Å²	148.2	74%	0.743	79%	0.792	S	S	*	*			trans	-47.4	153.7	174.7	-57.1	-70.5	0	0	0	115.5
294	N	34.8	Very low	32	Very low	160 Å²	160	151.5 Å²	151.5	86%	0.856	80%	0.799	S	S	*	*				-157.6	100.4	124.7	-90.4	-30.9	0	0	0	111.1	F296	N294-F296 PolarHBondContact O-N 2.8Å
295	S	36.1	Very low	31.5	Very low	111 Å²	111	154.8 Å²	154.8	78%	0.776	80%	0.801	S	S	*	*			trans	-26.7	109.6	146.2	157.3	0	0	0	0	112.5
296	F	31.3	Very low	31.7	Very low	188 Å²	188	154 Å²	154	83%	0.825	80%	0.799	S	S	*	*			trans	-143.2	128.4	157.2	-129.4	-98.6	0	0	0	109.2	N294	N294-F296 PolarHBondContact O-N 2.8Å
297	L	41.7	Very low	31.5	Very low	164 Å²	164	155.5 Å²	155.5	86%	0.859	80%	0.803	S	S	*	*			trans	94.5	70.1	174	-49.7	179.8	0	0	0	117.1
298	Q	38.8	Very low	31.6	Very low	189 Å²	189	158.3 Å²	158.3	88%	0.883	81%	0.806	S	S	*	*			trans	-117.9	106	150.3	-171.1	-176.2	33.7	0	0	109.2
299	V	32.2	Very low	31.7	Very low	130 Å²	130	153.4 Å²	153.4	79%	0.788	80%	0.795	S	S	*	*			trans	-159	120.1	160.1	-169.1	0	0	0	0	105.3
300	H	32.6	Very low	31.6	Very low	163 Å²	163	151.6 Å²	151.6	76%	0.755	79%	0.794	S	S	*	*				-156.5	124.3	55.6	-130	-78.7	0	0	0	109.6
301	N	33.2	Very low	31.7	Very low	156 Å²	156	153.9 Å²	153.9	83%	0.834	80%	0.798	S	S	*	*			trans	-123	120.4	162.6	-158	13.2	0	0	0	106.3
302	C	28.1	Very low	32	Very low	108 Å²	108	155.7 Å²	155.7	73%	0.73	80%	0.802	S	S	*	*			trans	-92.7	116	-179.1	-83.4	0	0	0	0	110.1
303	I	33.1	Very low	31.9	Very low	147 Å²	147	148.7 Å²	148.7	75%	0.754	80%	0.795	S	S	*	*			trans	-95.9	145.9	166.7	-72.4	177.6	0	0	0	109
304	Q	28	Very low	32.2	Very low	193 Å²	193	149.9 Å²	149.9	90%	0.902	80%	0.801	S	S	*	*			trans	-154	138.5	139	-166.2	170.7	-2.8	0	0	108.9
305	K	30.5	Very low	32.2	Very low	179 Å²	179	148.7 Å²	148.7	78%	0.778	80%	0.8	S	S	*	*			cis	-170.3	140.4	-34.1	179.7	174	-180	177.3	0	103.3
306	D	32.3	Very low	32.2	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	80%	0.798	S	S	*	*			trans	-51.5	162	178.7	-59.9	-70.1	0	0	0	116.1
307	S	25.8	Very low	32.5	Very low	133 Å²	133	146.8 Å²	146.8	93%	0.93	80%	0.802	S	S	*	*			trans	-149.9	146.2	133.9	-78	0	0	0	0	111.3
308	K	30.4	Very low	32.4	Very low	172 Å²	172	148.9 Å²	148.9	75%	0.748	80%	0.798	S	S	*	*			trans	-124.6	150.4	-141.9	167.5	175.3	178.9	171.8	0	110.3
309	D	29.2	Very low	32.5	Very low	125 Å²	125	149.2 Å²	149.2	67%	0.668	79%	0.792	S	S	*	*			trans	53.9	128.5	155.8	-59.6	-16.3	0	0	0	121.4
310	S	27.3	Very low	33.1	Very low	110 Å²	110	148.4 Å²	148.4	77%	0.769	79%	0.787	S	S	*	*				146.6	132.4	106.4	60.3	0	0	0	0	115
311	L	32	Very low	33.3	Very low	144 Å²	144	146.9 Å²	146.9	75%	0.754	79%	0.789	S	S	*	*			trans	26	140.7	149.8	-81.5	80.7	0	0	0	123.1
312	H	32.6	Very low	34.3	Very low	178 Å²	178	145 Å²	145	82%	0.824	79%	0.786	S	S	*	*			trans	71.2	108.6	150.7	-71.5	-53.2	0	0	0	119.1
313	A	29.6	Very low	34.8	Very low	92 Å²	92	150 Å²	150	76%	0.76	81%	0.813	S	S	*	*				-173.4	127.9	119.9	0	0	0	0	0	111.6
314	N	37.6	Very low	34.9	Very low	164 Å²	164	150.2 Å²	150.2	88%	0.877	82%	0.816	S	S	*	*			trans	-50.9	135.5	163.6	-69.1	-57.9	0	0	0	111.6
315	T	33.4	Very low	35.3	Very low	134 Å²	134	147.9 Å²	147.9	82%	0.822	81%	0.811	S	S	*	*			trans	-152.8	111	151.8	-35.9	0	0	0	0	113.1
316	A	37	Very low	35.6	Very low	89 Å²	89	146.2 Å²	146.2	74%	0.736	81%	0.813	S	S	*	*			trans	72.3	97.7	140.2	0	0	0	0	0	121.7
317	N	37.3	Very low	35.8	Very low	171 Å²	171	146.4 Å²	146.4	91%	0.914	82%	0.816	S	S	*	*			trans	-40.4	133.7	134.8	-107.4	-8.7	0	0	0	114
318	R	40.5	Very low	36.4	Very low	207 Å²	207	147.3 Å²	147.3	78%	0.781	81%	0.809	S	S	*	*			trans	-165.4	133.7	155.6	-109	-174.4	178.3	-172.1	1.9	106
319	R	40.5	Very low	36.8	Very low	196 Å²	196	145.6 Å²	145.6	74%	0.74	81%	0.813	S	S	*	*			cis	-171.2	123.6	5.2	-134.4	-179.3	-162	165.2	1.7	107.1
320	T	43.5	Very low	37.3	Very low	113 Å²	113	147.1 Å²	147.1	69%	0.693	82%	0.823	S	S	*	*			trans	22.1	124.7	136.8	55	0	0	0	0	122.5
321	T	37.2	Very low	38.1	Very low	131 Å²	131	149.9 Å²	149.9	80%	0.804	83%	0.827	S	S	*	*				40.8	166.8	113.7	63.6	0	0	0	0	120.2
322	P	53.6	Low	38.6	Very low	118 Å²	118	150.4 Å²	150.4	77%	0.766	83%	0.834	S	S	*	*			cis	-136.7	-179.4	28.8	37.9	-13.5	0	0	0	114.3
323	V	40.4	Very low	39.1	Very low	212 Å²	212	147.9 Å²	147.9	100%	1.285	83%	0.834	S	S	*	*			cis	-144	0	30	171.1	0	0	0	0	108.6

Retrieved 323 of 323 residues in 547.1 ms (Link to these results)

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