A0A060Z6X8_ONCMY Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A060Z6X8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ttc32, Length 136 aa.

						>A0A060Z6X8_ONCMY|A0A060Z6X8|ttc32
MEQDRCQTLERANVEFKKRNFKQAEELYTKFLESCWKTRNCDASDLATAHNNRGQIKYFRVDFREAMEDYTSAIEANCQFEVSFYNRGLIRYRLGFFQDAEMDFKRALELNPDFEDAKVSLQQTLLDQEHKINRGY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.3	Low	78.9	Confident	195 Å²	195	94.5 Å²	94.5	96%	0.961	45%	0.448	S	S	*	.				0	145	0	-70.1	177.1	-76.4	0	0	107.4	Q3 D4	M1-Q3 PolarHBondContact O-N 3.18Å; M1-Q3 VanDerWaalsContact O-N 3.12Å; M1-D4 WeakPolarHBondContact O-CB 3.49Å; M1-D4 PolarHBondContact O-N 3.47Å
2	E	59.9	Low	80.4	Confident	110 Å²	110	86.7 Å²	86.7	51%	0.514	41%	0.411	S	S	.	.	H	α-helix	trans	-49.3	-36.3	-175.3	-177.2	156.4	-124	0	0	114.7	D4 R5 C6 N40	E2-D4 VanDerWaalsContact C-N 3.28Å; E2-D4 PolarHBondContact O-N 3.34Å; E2-R5 PolarHBondContact O-N 2.97Å; E2-R5 VanDerWaalsContact O-N 3.09Å; E2-R5 IonicContact OE1-NH2 3.22Å; E2-R5 PolarHBondContact OE1-NH2 3.3Å; E2-C6 PolarHBondContact O-N 2.93Å; E2-N40 PolarHBondContact OE1-ND2 2.85Å
3	Q	62.2	Low	81.7	Confident	146 Å²	146	83.3 Å²	83.3	68%	0.682	40%	0.397	S	S	*	.	H	α-helix	trans	-54.6	-35.7	173.7	-119.8	166.3	-2.4	0	0	114.7	M1 R5 Q7	M1-Q3 PolarHBondContact O-N 3.18Å; M1-Q3 VanDerWaalsContact O-N 3.12Å; Q3-R5 VanDerWaalsContact C-N 3.32Å; Q3-R5 PolarHBondContact O-N 3.43Å; Q3-Q7 WeakPolarHBondContact O-CB 3.4Å; Q3-Q7 WeakPolarHBondContact O-CG 3.38Å; Q3-Q7 PolarHBondContact O-N 3.48Å
4	D	73.4	Confident	82.8	Confident	92 Å²	92	82.3 Å²	82.3	49%	0.492	40%	0.398	S	S	.	.	H	α-helix	trans	-73.2	-26.6	-179.1	-170.8	53.5	0	0	0	111.8	M1 E2 T8	M1-D4 WeakPolarHBondContact O-CB 3.49Å; M1-D4 PolarHBondContact O-N 3.47Å; E2-D4 VanDerWaalsContact C-N 3.28Å; E2-D4 PolarHBondContact O-N 3.34Å; D4-T8 WeakPolarHBondContact O-CB 3.47Å; D4-T8 PolarHBondContact O-N 3.26Å; D4-T8 VanDerWaalsContact O-N 3.08Å; D4-T8 PolarHBondContact O-OG1 3.32Å
5	R	80.1	Confident	83.8	Confident	28 Å²	28	78.4 Å²	78.4	11%	0.106	38%	0.379	C	S	.	.	H	α-helix	trans	-76.5	-50.2	178.7	-63.8	-171.2	-61.6	-102	-1.1	111.7	E2 Q3 Q7 T8 L9 F31 S34 T38 N40	E2-R5 PolarHBondContact O-N 2.97Å; E2-R5 VanDerWaalsContact O-N 3.09Å; E2-R5 IonicContact OE1-NH2 3.22Å; E2-R5 PolarHBondContact OE1-NH2 3.3Å; Q3-R5 VanDerWaalsContact C-N 3.32Å; Q3-R5 PolarHBondContact O-N 3.43Å; R5-Q7 PolarHBondContact O-N 3.4Å; R5-T8 WeakPolarHBondContact O-CA 2.79Å; R5-T8 WeakPolarHBondContact O-CB 3.45Å; R5-T8 PolarHBondContact O-N 3.04Å; R5-L9 PolarHBondContact O-N 2.96Å; R5-F31 HydrophobicContact CB-CD2 4.33Å; R5-F31 HydrophobicContact CB-CE2 4.14Å; R5-F31 WeakPolarHBondContact O-CD2 3.34Å; R5-S34 WeakPolarHBondContact CD-OG 3.37Å; R5-T38 PolarHBondContact NH1-OG1 2.95Å; R5-N40 PolarHBondContact NH2-ND2 3.09Å; R5-N40 PolarHBondContact NH2-O 3.17Å
6	C	74.1	Confident	84.7	Confident	55 Å²	55	75.6 Å²	75.6	37%	0.372	37%	0.365	S	S	.	.	H	α-helix	trans	-56.6	-43	175.1	-64.4	0	0	0	0	110.5	E2 T8 L9 E10	E2-C6 PolarHBondContact O-N 2.93Å; C6-T8 VanDerWaalsContact C-N 3.31Å; C6-T8 PolarHBondContact O-N 3Å; C6-L9 PolarHBondContact O-N 3.42Å; C6-E10 WeakPolarHBondContact O-CG 3.37Å; C6-E10 PolarHBondContact O-N 3.29Å
7	Q	85.1	Confident	85.4	Confident	97 Å²	97	81.6 Å²	81.6	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-61.9	-35.8	174.3	-74.6	176.9	10	0	0	113.3	Q3 R5 R11	Q3-Q7 WeakPolarHBondContact O-CB 3.4Å; Q3-Q7 WeakPolarHBondContact O-CG 3.38Å; Q3-Q7 PolarHBondContact O-N 3.48Å; R5-Q7 PolarHBondContact O-N 3.4Å; Q7-R11 WeakPolarHBondContact O-CB 3.3Å; Q7-R11 VanDerWaalsContact O-CG 3.23Å; Q7-R11 WeakPolarHBondContact O-CG 3.48Å; Q7-R11 PolarHBondContact O-N 2.88Å
8	T	91.9	Very high	86.1	Confident	13 Å²	13	83.9 Å²	83.9	8%	0.08	40%	0.397	C	S	.	.	H	α-helix	trans	-66.3	-44.1	176.6	-61.1	0	0	0	0	111.2	D4 R5 C6 R11 A12 L27 K30 F31	D4-T8 WeakPolarHBondContact O-CB 3.47Å; D4-T8 PolarHBondContact O-N 3.26Å; D4-T8 VanDerWaalsContact O-N 3.08Å; D4-T8 PolarHBondContact O-OG1 3.32Å; R5-T8 WeakPolarHBondContact O-CA 2.79Å; R5-T8 WeakPolarHBondContact O-CB 3.45Å; R5-T8 PolarHBondContact O-N 3.04Å; C6-T8 VanDerWaalsContact C-N 3.31Å; C6-T8 PolarHBondContact O-N 3Å; T8-R11 PolarHBondContact O-N 2.95Å; T8-A12 WeakPolarHBondContact O-CB 3.21Å; T8-A12 PolarHBondContact O-N 3.33Å; T8-L27 HydrophobicContact CG2-CD2 4.28Å; T8-K30 HydrophobicContact CG2-CD 4.48Å; T8-F31 HydrophobicContact CG2-CB 4.07Å
9	L	93.3	Very high	86.6	Confident	8 Å²	8	89.9 Å²	89.9	4%	0.042	42%	0.416	C	S	.	.	H	α-helix	trans	-65.1	-45.1	177.3	-178.4	60.6	0	0	0	111.9	R5 C6 R11 A12 N13 Y28 F31 D45 A49	R5-L9 PolarHBondContact O-N 2.96Å; C6-L9 PolarHBondContact O-N 3.42Å; L9-R11 VanDerWaalsContact C-N 3.33Å; L9-R11 PolarHBondContact O-N 2.52Å; L9-A12 WeakPolarHBondContact O-CB 3.46Å; L9-A12 PolarHBondContact O-N 2.71Å; L9-N13 VanDerWaalsContact O-CG 3.29Å; L9-N13 PolarHBondContact O-N 2.97Å; L9-N13 PolarHBondContact O-ND2 2.69Å; L9-Y28 HydrophobicContact CD1-CD1 4.03Å; L9-Y28 HydrophobicContact CD1-CE1 3.79Å; L9-F31 HydrophobicContact CB-CD2 3.85Å; L9-F31 HydrophobicContact CB-CE2 3.86Å; L9-F31 HydrophobicContact CB-CG 4.28Å; L9-F31 HydrophobicContact CB-CZ 4.3Å; L9-F31 HydrophobicContact CD1-CD1 4.28Å; L9-F31 HydrophobicContact CD1-CE1 4.36Å; L9-F31 HydrophobicContact CD2-CE1 4.28Å; L9-F31 HydrophobicContact CD2-CE2 4.29Å; L9-F31 HydrophobicContact CD2-CZ 3.95Å; L9-D45 HydrophobicContact CD2-CB 3.68Å; L9-A49 HydrophobicContact CD1-CB 3.91Å
10	E	94.3	Very high	87.1	Confident	124 Å²	124	89.4 Å²	89.4	58%	0.579	42%	0.416	S	S	*	.	H	α-helix	trans	-58.1	-45.9	175.8	-75.3	176	-176.3	0	0	111.6	C6 A12 N13 V14	C6-E10 WeakPolarHBondContact O-CG 3.37Å; C6-E10 PolarHBondContact O-N 3.29Å; E10-A12 PolarHBondContact O-N 3.32Å; E10-N13 PolarHBondContact O-N 3.48Å; E10-V14 WeakPolarHBondContact O-CG2 3.25Å; E10-V14 PolarHBondContact O-N 2.92Å
11	R	96	Very high	87.6	Confident	172 Å²	172	88 Å²	88	65%	0.649	41%	0.409	S	S	*	.	H	α-helix	trans	-60.8	-43.6	175.2	-78.3	174.4	148.2	-169.2	-6.3	112.1	Q7 T8 L9 N13 V14 E15 L27	Q7-R11 WeakPolarHBondContact O-CB 3.3Å; Q7-R11 VanDerWaalsContact O-CG 3.23Å; Q7-R11 WeakPolarHBondContact O-CG 3.48Å; Q7-R11 PolarHBondContact O-N 2.88Å; T8-R11 PolarHBondContact O-N 2.95Å; L9-R11 VanDerWaalsContact C-N 3.33Å; L9-R11 PolarHBondContact O-N 2.52Å; R11-N13 VanDerWaalsContact C-N 3.31Å; R11-N13 PolarHBondContact O-N 3.47Å; R11-V14 PolarHBondContact O-N 3.2Å; R11-E15 WeakPolarHBondContact O-CG 3.32Å; R11-E15 PolarHBondContact O-N 3.46Å; R11-L27 HydrophobicContact CB-CD1 4.11Å
12	A	97.1	Very high	89.4	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-58.1	-46.2	176.2	0	0	0	0	0	111	T8 L9 E10 V14 E15 F16 L27 Y28	T8-A12 WeakPolarHBondContact O-CB 3.21Å; T8-A12 PolarHBondContact O-N 3.33Å; L9-A12 WeakPolarHBondContact O-CB 3.46Å; L9-A12 PolarHBondContact O-N 2.71Å; E10-A12 PolarHBondContact O-N 3.32Å; A12-V14 VanDerWaalsContact C-N 3.34Å; A12-V14 PolarHBondContact O-N 3.45Å; A12-E15 PolarHBondContact O-N 3.45Å; A12-F16 WeakPolarHBondContact O-CB 3.29Å; A12-F16 PolarHBondContact O-N 2.98Å; A12-L27 HydrophobicContact CB-CB 3.59Å; A12-L27 HydrophobicContact CB-CD1 4.44Å; A12-Y28 HydrophobicContact CB-CD1 3.57Å; A12-Y28 HydrophobicContact CB-CD2 4.23Å; A12-Y28 HydrophobicContact CB-CE1 3.42Å; A12-Y28 VanDerWaalsContact CB-CE1 3.42Å; A12-Y28 HydrophobicContact CB-CE2 4.11Å; A12-Y28 HydrophobicContact CB-CG 3.96Å
13	N	96.4	Very high	91.2	Very high	43 Å²	43	85.6 Å²	85.6	23%	0.23	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-38.4	177.5	-68.7	-23.6	0	0	0	112.5	L9 E10 R11 K17 Y28 N52	L9-N13 VanDerWaalsContact O-CG 3.29Å; L9-N13 PolarHBondContact O-N 2.97Å; L9-N13 PolarHBondContact O-ND2 2.69Å; E10-N13 PolarHBondContact O-N 3.48Å; R11-N13 VanDerWaalsContact C-N 3.31Å; R11-N13 PolarHBondContact O-N 3.47Å; N13-K17 WeakPolarHBondContact O-CG 3.23Å; N13-K17 PolarHBondContact O-N 3.41Å; N13-Y28 WeakPolarHBondContact CA-OH 3.3Å; N13-Y28 WeakPolarHBondContact OD1-CE1 3.27Å; N13-Y28 PolarHBondContact OD1-OH 3.41Å; N13-N52 PolarHBondContact OD1-ND2 2.92Å
14	V	97.7	Very high	92.9	Very high	69 Å²	69	78.7 Å²	78.7	42%	0.418	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-47.6	175.3	168.6	0	0	0	0	111	E10 R11 A12 F16 K17 K18	E10-V14 WeakPolarHBondContact O-CG2 3.25Å; E10-V14 PolarHBondContact O-N 2.92Å; R11-V14 PolarHBondContact O-N 3.2Å; A12-V14 VanDerWaalsContact C-N 3.34Å; A12-V14 PolarHBondContact O-N 3.45Å; V14-F16 VanDerWaalsContact C-N 3.32Å; V14-F16 PolarHBondContact O-N 2.91Å; V14-K17 PolarHBondContact O-N 3.35Å; V14-K18 HydrophobicContact CG1-CD 4.29Å; V14-K18 WeakPolarHBondContact O-CG 3.37Å; V14-K18 PolarHBondContact O-N 2.86Å
15	E	97.9	Very high	94.1	Very high	24 Å²	24	75.8 Å²	75.8	11%	0.112	34%	0.344	C	S	.	.	H	α-helix	trans	-66.9	-35.5	179.3	-66.2	-49.9	132.4	0	0	112	R11 A12 K17 K18 R19 N20 Q23 A24 L27	R11-E15 WeakPolarHBondContact O-CG 3.32Å; R11-E15 PolarHBondContact O-N 3.46Å; A12-E15 PolarHBondContact O-N 3.45Å; E15-K17 PolarHBondContact O-N 3.24Å; E15-K18 CarbonylContact O-C 3.59Å; E15-K18 PolarHBondContact O-N 3.26Å; E15-K18 IonicContact OE1-NZ 2.61Å; E15-K18 PolarHBondContact OE1-NZ 3.2Å; E15-R19 PolarHBondContact O-N 3.16Å; E15-N20 HydrophobicContact CB-CB 4.16Å; E15-N20 PolarHBondContact O-N 2.92Å; E15-N20 WeakPolarHBondContact OE2-CB 3.45Å; E15-N20 PolarHBondContact OE2-ND2 3.43Å; E15-Q23 HydrophobicContact CG-CG 4.24Å; E15-Q23 PolarHBondContact OE2-OE1 3.03Å; E15-A24 HydrophobicContact CB-CB 4.12Å; E15-L27 HydrophobicContact CG-CD1 4.23Å
16	F	97.6	Very high	94.9	Very high	34 Å²	34	80 Å²	80	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-59	-47.8	172.2	-174.9	-89.1	0	0	0	111.4	A12 V14 K18 R19 F21 A24 Y28 N52 Q55 I56 F59	A12-F16 WeakPolarHBondContact O-CB 3.29Å; A12-F16 PolarHBondContact O-N 2.98Å; V14-F16 VanDerWaalsContact C-N 3.32Å; V14-F16 PolarHBondContact O-N 2.91Å; F16-K18 VanDerWaalsContact C-N 3.27Å; F16-K18 PolarHBondContact O-N 2.99Å; F16-R19 WeakPolarHBondContact O-CA 3.31Å; F16-R19 PolarHBondContact O-N 3.5Å; F16-F21 HydrophobicContact CD2-CD1 4.12Å; F16-F21 HydrophobicContact CD2-CE1 4.19Å; F16-F21 HydrophobicContact CE2-CD1 4.18Å; F16-F21 AromaticContact CE2-CE1 3.99Å; F16-F21 HydrophobicContact CE2-CE1 3.99Å; F16-F21 HydrophobicContact CZ-CE1 4.34Å; F16-A24 HydrophobicContact CB-CB 4.06Å; F16-Y28 HydrophobicContact CB-CE2 4.38Å; F16-Y28 HydrophobicContact CD2-CE2 4.3Å; F16-N52 HydrophobicContact CD2-CB 4.49Å; F16-Q55 HydrophobicContact CE2-CB 4.36Å; F16-Q55 HydrophobicContact CZ-CB 4.32Å; F16-Q55 HydrophobicContact CZ-CG 4.14Å; F16-I56 HydrophobicContact CD2-CD1 3.96Å; F16-I56 HydrophobicContact CD2-CG1 3.77Å; F16-I56 HydrophobicContact CE2-CD1 4.36Å; F16-I56 HydrophobicContact CE2-CG1 3.69Å; F16-F59 HydrophobicContact CE2-CE2 4.47Å; F16-F59 HydrophobicContact CZ-CE2 4.19Å
17	K	96.9	Very high	96	Very high	178 Å²	178	78.9 Å²	78.9	77%	0.774	36%	0.355	S	S	*	.	H	α-helix	trans	-62.3	-33	177	-73.6	176.1	-178	-178	0	112.9	N13 V14 E15 R19	N13-K17 WeakPolarHBondContact O-CG 3.23Å; N13-K17 PolarHBondContact O-N 3.41Å; V14-K17 PolarHBondContact O-N 3.35Å; E15-K17 PolarHBondContact O-N 3.24Å; K17-R19 PolarHBondContact O-N 2.88Å
18	K	97.3	Very high	96.6	Very high	123 Å²	123	74.2 Å²	74.2	54%	0.535	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.6	174	-68.1	175.2	-172.3	166.5	0	113.8	V14 E15 F16 N20	V14-K18 HydrophobicContact CG1-CD 4.29Å; V14-K18 WeakPolarHBondContact O-CG 3.37Å; V14-K18 PolarHBondContact O-N 2.86Å; E15-K18 CarbonylContact O-C 3.59Å; E15-K18 PolarHBondContact O-N 3.26Å; E15-K18 IonicContact OE1-NZ 2.61Å; E15-K18 PolarHBondContact OE1-NZ 3.2Å; F16-K18 VanDerWaalsContact C-N 3.27Å; F16-K18 PolarHBondContact O-N 2.99Å; K18-N20 PolarHBondContact O-N 3.22Å
19	R	95.3	Very high	96.9	Very high	198 Å²	198	75.6 Å²	75.6	75%	0.747	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	20.1	-172.2	-53.9	-177.8	170.5	-153	-3	114.2	E15 F16 K17 F21	E15-R19 PolarHBondContact O-N 3.16Å; F16-R19 WeakPolarHBondContact O-CA 3.31Å; F16-R19 PolarHBondContact O-N 3.5Å; K17-R19 PolarHBondContact O-N 2.88Å; R19-F21 HydrophobicContact CB-CE1 4.4Å; R19-F21 HydrophobicContact CB-CE2 4.02Å; R19-F21 HydrophobicContact CB-CZ 3.89Å; R19-F21 HydrophobicContact CG-CZ 4.02Å; R19-F21 PolarHBondContact O-N 3.11Å
20	N	97.3	Very high	96.9	Very high	78 Å²	78	80.7 Å²	80.7	42%	0.417	36%	0.363	S	S	.	.			trans	-81.5	62.3	172.5	-72.7	-18.7	0	0	0	109.9	E15 K18 K22 Q23 A24	E15-N20 HydrophobicContact CB-CB 4.16Å; E15-N20 PolarHBondContact O-N 2.92Å; E15-N20 WeakPolarHBondContact OE2-CB 3.45Å; E15-N20 PolarHBondContact OE2-ND2 3.43Å; K18-N20 PolarHBondContact O-N 3.22Å; N20-K22 VanDerWaalsContact C-N 3.33Å; N20-K22 PolarHBondContact O-N 3.08Å; N20-Q23 PolarHBondContact O-N 3.43Å; N20-A24 PolarHBondContact O-N 3.46Å
21	F	97.3	Very high	96.9	Very high	61 Å²	61	75 Å²	75	27%	0.268	34%	0.336	S	S	.	.	H	α-helix	trans	-60.9	-37.4	-167.3	-61.9	-50.3	0	0	0	113.8	F16 R19 Q23 A24 E25 I56 F59	F16-F21 HydrophobicContact CD2-CD1 4.12Å; F16-F21 HydrophobicContact CD2-CE1 4.19Å; F16-F21 HydrophobicContact CE2-CD1 4.18Å; F16-F21 AromaticContact CE2-CE1 3.99Å; F16-F21 HydrophobicContact CE2-CE1 3.99Å; F16-F21 HydrophobicContact CZ-CE1 4.34Å; R19-F21 HydrophobicContact CB-CE1 4.4Å; R19-F21 HydrophobicContact CB-CE2 4.02Å; R19-F21 HydrophobicContact CB-CZ 3.89Å; R19-F21 HydrophobicContact CG-CZ 4.02Å; R19-F21 PolarHBondContact O-N 3.11Å; F21-Q23 PolarHBondContact O-N 3.18Å; F21-A24 PolarHBondContact O-N 3.02Å; F21-E25 WeakPolarHBondContact O-CB 3.25Å; F21-E25 PolarHBondContact O-N 3.09Å; F21-I56 HydrophobicContact CB-CG1 4.23Å; F21-I56 HydrophobicContact CB-CG2 3.84Å; F21-I56 HydrophobicContact CD1-CG1 3.96Å; F21-I56 HydrophobicContact CG-CG1 4.44Å; F21-F59 HydrophobicContact CD1-CD2 4.49Å; F21-F59 AromaticContact CE1-CD2 3.98Å; F21-F59 HydrophobicContact CE1-CD2 3.98Å; F21-F59 AromaticContact CE1-CE2 3.92Å; F21-F59 HydrophobicContact CE1-CE2 3.92Å; F21-F59 HydrophobicContact CE2-CD2 4.09Å; F21-F59 AromaticContact CZ-CD2 3.76Å; F21-F59 HydrophobicContact CZ-CD2 3.76Å; F21-F59 AromaticContact CZ-CE2 3.8Å; F21-F59 HydrophobicContact CZ-CE2 3.8Å
22	K	97.1	Very high	96.8	Very high	161 Å²	161	67.6 Å²	67.6	70%	0.7	31%	0.31	S	S	*	.	H	α-helix	trans	-59.1	-48.7	177.1	-175.2	179	177.9	-177.6	0	111.8	N20 E25 E26	N20-K22 VanDerWaalsContact C-N 3.33Å; N20-K22 PolarHBondContact O-N 3.08Å; K22-E25 PolarHBondContact O-N 2.61Å; K22-E26 WeakPolarHBondContact O-CG 3.46Å; K22-E26 PolarHBondContact O-N 2.95Å
23	Q	97.4	Very high	96.6	Very high	94 Å²	94	72.5 Å²	72.5	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-69.5	-38.9	180	-170.3	175.4	11	0	0	111.5	E15 N20 F21 E25 E26 L27	E15-Q23 HydrophobicContact CG-CG 4.24Å; E15-Q23 PolarHBondContact OE2-OE1 3.03Å; N20-Q23 PolarHBondContact O-N 3.43Å; F21-Q23 PolarHBondContact O-N 3.18Å; Q23-E25 PolarHBondContact O-N 3.04Å; Q23-E26 PolarHBondContact O-N 3.26Å; Q23-L27 HydrophobicContact CG-CD1 4.13Å; Q23-L27 WeakPolarHBondContact O-CB 3.36Å; Q23-L27 VanDerWaalsContact O-CG 3.24Å; Q23-L27 WeakPolarHBondContact O-CG 3.23Å; Q23-L27 PolarHBondContact O-N 2.89Å
24	A	98.1	Very high	96.4	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-44.3	176.4	0	0	0	0	0	111.8	E15 F16 N20 F21 L27 Y28 I56	E15-A24 HydrophobicContact CB-CB 4.12Å; F16-A24 HydrophobicContact CB-CB 4.06Å; N20-A24 PolarHBondContact O-N 3.46Å; F21-A24 PolarHBondContact O-N 3.02Å; A24-L27 PolarHBondContact O-N 3.1Å; A24-Y28 HydrophobicContact CB-CD2 4.44Å; A24-Y28 HydrophobicContact CB-CE2 4.11Å; A24-Y28 WeakPolarHBondContact O-CD2 3.36Å; A24-Y28 PolarHBondContact O-N 3.42Å; A24-I56 HydrophobicContact CB-CD1 3.79Å
25	E	98	Very high	95.9	Very high	32 Å²	32	69.5 Å²	69.5	15%	0.15	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-43	178.7	-175.8	178.2	177.3	0	0	112.9	F21 K22 Q23 L27 Y28 T29 R53 I56 R60	F21-E25 WeakPolarHBondContact O-CB 3.25Å; F21-E25 PolarHBondContact O-N 3.09Å; K22-E25 PolarHBondContact O-N 2.61Å; Q23-E25 PolarHBondContact O-N 3.04Å; E25-L27 VanDerWaalsContact C-N 3.33Å; E25-Y28 PolarHBondContact O-N 3.5Å; E25-T29 WeakPolarHBondContact O-CB 3.47Å; E25-T29 PolarHBondContact O-N 2.8Å; E25-T29 PolarHBondContact O-OG1 3.08Å; E25-R53 HydrophobicContact CG-CG 4.14Å; E25-I56 HydrophobicContact CB-CD1 3.86Å; E25-I56 HydrophobicContact CB-CG2 4.19Å; E25-I56 WeakPolarHBondContact OE2-CG2 3.37Å; E25-R60 IonicContact OE1-CZ 3.76Å; E25-R60 IonicContact OE1-NH1 2.91Å; E25-R60 PolarHBondContact OE1-NH1 3.5Å; E25-R60 IonicContact OE1-NH2 3.95Å; E25-R60 IonicContact OE2-CZ 3.52Å; E25-R60 IonicContact OE2-NH1 3.6Å; E25-R60 PolarHBondContact OE2-NH1 3.12Å
26	E	97.6	Very high	95.2	Very high	117 Å²	117	78.4 Å²	78.4	55%	0.547	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-43.6	174.2	-72.3	171.9	-167.7	0	0	110.9	K22 Q23 T29 K30	K22-E26 WeakPolarHBondContact O-CG 3.46Å; K22-E26 PolarHBondContact O-N 2.95Å; Q23-E26 PolarHBondContact O-N 3.26Å; E26-T29 PolarHBondContact O-N 2.84Å; E26-K30 WeakPolarHBondContact O-CB 3.44Å; E26-K30 PolarHBondContact O-N 3.38Å
27	L	97.5	Very high	94.6	Very high	30 Å²	30	83.9 Å²	83.9	16%	0.157	37%	0.374	C	S	.	.	H	α-helix	trans	-68	-42.1	178.7	-69.5	169.3	0	0	0	112.5	T8 R11 A12 E15 Q23 A24 E25 T29 K30 F31	T8-L27 HydrophobicContact CG2-CD2 4.28Å; R11-L27 HydrophobicContact CB-CD1 4.11Å; A12-L27 HydrophobicContact CB-CB 3.59Å; A12-L27 HydrophobicContact CB-CD1 4.44Å; E15-L27 HydrophobicContact CG-CD1 4.23Å; Q23-L27 HydrophobicContact CG-CD1 4.13Å; Q23-L27 WeakPolarHBondContact O-CB 3.36Å; Q23-L27 VanDerWaalsContact O-CG 3.24Å; Q23-L27 WeakPolarHBondContact O-CG 3.23Å; Q23-L27 PolarHBondContact O-N 2.89Å; A24-L27 PolarHBondContact O-N 3.1Å; E25-L27 VanDerWaalsContact C-N 3.33Å; L27-T29 VanDerWaalsContact C-N 3.34Å; L27-K30 PolarHBondContact O-N 3.13Å; L27-F31 WeakPolarHBondContact O-CB 3.37Å; L27-F31 PolarHBondContact O-N 2.95Å
28	Y	97.6	Very high	93.9	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-43.5	174	-72.6	-54.5	0	0	0	111.2	L9 A12 N13 F16 A24 E25 K30 F31 L32 A49 N52 R53 I56	L9-Y28 HydrophobicContact CD1-CD1 4.03Å; L9-Y28 HydrophobicContact CD1-CE1 3.79Å; A12-Y28 HydrophobicContact CB-CD1 3.57Å; A12-Y28 HydrophobicContact CB-CD2 4.23Å; A12-Y28 HydrophobicContact CB-CE1 3.42Å; A12-Y28 VanDerWaalsContact CB-CE1 3.42Å; A12-Y28 HydrophobicContact CB-CE2 4.11Å; A12-Y28 HydrophobicContact CB-CG 3.96Å; N13-Y28 WeakPolarHBondContact CA-OH 3.3Å; N13-Y28 WeakPolarHBondContact OD1-CE1 3.27Å; N13-Y28 PolarHBondContact OD1-OH 3.41Å; F16-Y28 HydrophobicContact CB-CE2 4.38Å; F16-Y28 HydrophobicContact CD2-CE2 4.3Å; A24-Y28 HydrophobicContact CB-CD2 4.44Å; A24-Y28 HydrophobicContact CB-CE2 4.11Å; A24-Y28 WeakPolarHBondContact O-CD2 3.36Å; A24-Y28 PolarHBondContact O-N 3.42Å; E25-Y28 PolarHBondContact O-N 3.5Å; Y28-K30 PolarHBondContact O-N 3.14Å; Y28-F31 WeakPolarHBondContact O-CB 3.44Å; Y28-F31 PolarHBondContact O-N 3.19Å; Y28-L32 WeakPolarHBondContact O-CB 3.49Å; Y28-L32 VanDerWaalsContact O-CG 3.24Å; Y28-L32 WeakPolarHBondContact O-CG 3.48Å; Y28-L32 PolarHBondContact O-N 3.4Å; Y28-A49 HydrophobicContact CD1-CB 3.91Å; Y28-N52 HydrophobicContact CD2-CB 4.4Å; Y28-N52 HydrophobicContact CE1-CB 4.06Å; Y28-N52 HydrophobicContact CE2-CB 3.61Å; Y28-N52 VanDerWaalsContact CZ-CB 3.41Å; Y28-N52 WeakPolarHBondContact OH-CB 3.38Å; Y28-N52 PolarHBondContact OH-ND2 3.2Å; Y28-N52 VanDerWaalsContact OH-ND2 3.14Å; Y28-R53 HydrophobicContact CD2-CB 4.29Å; Y28-R53 HydrophobicContact CG-CB 4.36Å; Y28-I56 HydrophobicContact CD2-CD1 4.04Å; Y28-I56 HydrophobicContact CE2-CD1 4.1Å
29	T	96.6	Very high	93	Very high	41 Å²	41	83.9 Å²	83.9	25%	0.252	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-45.9	177.1	-61	0	0	0	0	111.2	E25 E26 L27 F31 L32 E33 R53	E25-T29 WeakPolarHBondContact O-CB 3.47Å; E25-T29 PolarHBondContact O-N 2.8Å; E25-T29 PolarHBondContact O-OG1 3.08Å; E26-T29 PolarHBondContact O-N 2.84Å; L27-T29 VanDerWaalsContact C-N 3.34Å; T29-F31 VanDerWaalsContact C-N 3.33Å; T29-F31 PolarHBondContact O-N 3.28Å; T29-L32 PolarHBondContact O-N 2.84Å; T29-E33 WeakPolarHBondContact O-CG 3.33Å; T29-E33 PolarHBondContact O-N 3.4Å; T29-R53 WeakPolarHBondContact OG1-CD 3.39Å; T29-R53 PolarHBondContact OG1-NH1 3.24Å
30	K	94.9	Very high	92.1	Very high	115 Å²	115	78.1 Å²	78.1	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-59.5	-42.1	175.4	-174	-176.6	178.1	-170.8	0	112.3	T8 E26 L27 Y28 S34	T8-K30 HydrophobicContact CG2-CD 4.48Å; E26-K30 WeakPolarHBondContact O-CB 3.44Å; E26-K30 PolarHBondContact O-N 3.38Å; L27-K30 PolarHBondContact O-N 3.13Å; Y28-K30 PolarHBondContact O-N 3.14Å; K30-S34 WeakPolarHBondContact O-CB 3.35Å; K30-S34 PolarHBondContact O-N 3.05Å
31	F	94.4	Very high	91.4	Very high	5 Å²	5	76 Å²	76	2%	0.022	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-50	176.4	174.1	-99.4	0	0	0	111.3	R5 T8 L9 L27 Y28 T29 E33 S34 C35 D45 A49	R5-F31 HydrophobicContact CB-CD2 4.33Å; R5-F31 HydrophobicContact CB-CE2 4.14Å; R5-F31 WeakPolarHBondContact O-CD2 3.34Å; T8-F31 HydrophobicContact CG2-CB 4.07Å; L9-F31 HydrophobicContact CB-CD2 3.85Å; L9-F31 HydrophobicContact CB-CE2 3.86Å; L9-F31 HydrophobicContact CB-CG 4.28Å; L9-F31 HydrophobicContact CB-CZ 4.3Å; L9-F31 HydrophobicContact CD1-CD1 4.28Å; L9-F31 HydrophobicContact CD1-CE1 4.36Å; L9-F31 HydrophobicContact CD2-CE1 4.28Å; L9-F31 HydrophobicContact CD2-CE2 4.29Å; L9-F31 HydrophobicContact CD2-CZ 3.95Å; L27-F31 WeakPolarHBondContact O-CB 3.37Å; L27-F31 PolarHBondContact O-N 2.95Å; Y28-F31 WeakPolarHBondContact O-CB 3.44Å; Y28-F31 PolarHBondContact O-N 3.19Å; T29-F31 VanDerWaalsContact C-N 3.33Å; T29-F31 PolarHBondContact O-N 3.28Å; F31-E33 PolarHBondContact O-N 3.49Å; F31-S34 WeakPolarHBondContact O-CB 3.35Å; F31-S34 PolarHBondContact O-N 3.39Å; F31-C35 WeakPolarHBondContact O-CB 3.29Å; F31-C35 PolarHBondContact O-N 2.9Å; F31-D45 HydrophobicContact CE1-CB 4.44Å; F31-D45 HydrophobicContact CZ-CB 4.01Å; F31-A49 HydrophobicContact CD1-CB 3.68Å; F31-A49 HydrophobicContact CE1-CB 3.91Å
32	L	93.9	Very high	91.1	Very high	16 Å²	16	78.4 Å²	78.4	8%	0.084	36%	0.364	C	S	.	.	H	α-helix	trans	-62.3	-41.8	-179.9	-67.9	170.6	0	0	0	112.2	Y28 T29 C35 W36 L46 A49 H50	Y28-L32 WeakPolarHBondContact O-CB 3.49Å; Y28-L32 VanDerWaalsContact O-CG 3.24Å; Y28-L32 WeakPolarHBondContact O-CG 3.48Å; Y28-L32 PolarHBondContact O-N 3.4Å; T29-L32 PolarHBondContact O-N 2.84Å; L32-C35 WeakPolarHBondContact O-CB 3.47Å; L32-C35 PolarHBondContact O-N 3.2Å; L32-W36 PolarHBondContact O-N 3.42Å; L32-L46 HydrophobicContact CD2-CD2 3.68Å; L32-A49 HydrophobicContact CD2-CB 3.92Å; L32-A49 HydrophobicContact CG-CB 4.26Å; L32-H50 WeakPolarHBondContact CD2-NE2 3.13Å
33	E	92.4	Very high	90.8	Very high	104 Å²	104	73.1 Å²	73.1	49%	0.486	35%	0.35	S	S	.	.	H	α-helix	trans	-63.7	-42.4	175	-74.9	178.8	-173.7	0	0	112.6	T29 F31 C35 W36 K37	T29-E33 WeakPolarHBondContact O-CG 3.33Å; T29-E33 PolarHBondContact O-N 3.4Å; F31-E33 PolarHBondContact O-N 3.49Å; E33-C35 VanDerWaalsContact C-N 3.27Å; E33-C35 PolarHBondContact O-N 3.3Å; E33-W36 PolarHBondContact O-N 2.88Å; E33-K37 WeakPolarHBondContact O-CG 3.5Å; E33-K37 PolarHBondContact O-N 3.47Å
34	S	91	Very high	90.6	Very high	40 Å²	40	71.8 Å²	71.8	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-43.1	175.3	-174.9	0	0	0	0	110.5	R5 K30 F31 K37 T38	R5-S34 WeakPolarHBondContact CD-OG 3.37Å; K30-S34 WeakPolarHBondContact O-CB 3.35Å; K30-S34 PolarHBondContact O-N 3.05Å; F31-S34 WeakPolarHBondContact O-CB 3.35Å; F31-S34 PolarHBondContact O-N 3.39Å; S34-K37 PolarHBondContact O-N 3.03Å; S34-T38 PolarHBondContact O-N 3.44Å; S34-T38 VanDerWaalsContact O-N 3.1Å; S34-T38 PolarHBondContact O-OG1 3.29Å; S34-T38 VanDerWaalsContact O-OG1 3.1Å
35	C	87.6	Confident	90.4	Very high	8 Å²	8	74 Å²	74	5%	0.054	36%	0.363	C	S	.	.	H	α-helix	trans	-59.8	-48.1	178.4	-167.8	0	0	0	0	112.5	F31 L32 E33 K37 T38 R39 C41 L46	F31-C35 WeakPolarHBondContact O-CB 3.29Å; F31-C35 PolarHBondContact O-N 2.9Å; L32-C35 WeakPolarHBondContact O-CB 3.47Å; L32-C35 PolarHBondContact O-N 3.2Å; E33-C35 VanDerWaalsContact C-N 3.27Å; E33-C35 PolarHBondContact O-N 3.3Å; C35-K37 VanDerWaalsContact C-N 3.29Å; C35-K37 PolarHBondContact O-N 3.34Å; C35-T38 PolarHBondContact O-N 3.29Å; C35-R39 PolarHBondContact O-N 3.13Å; C35-C41 WeakPolarHBondContact CA-SG 3.42Å; C35-C41 HydrophobicContact CB-CB 4.27Å; C35-C41 WeakPolarHBondContact CB-SG 3.42Å; C35-C41 WeakPolarHBondContact SG-CB 3.44Å; C35-C41 CovalentContact SG-SG 2Å; C35-C41 PolarHBondContact SG-SG 3.46Å; C35-L46 HydrophobicContact CB-CD2 4.1Å; C35-L46 VanDerWaalsContact SG-CD2 3.5Å
36	W	83.6	Confident	90.3	Very high	212 Å²	212	74.3 Å²	74.3	80%	0.803	37%	0.366	S	S	*	.	H	α-helix	trans	-58.8	-40.2	178	-179.7	82.5	0	0	0	112.2	L32 E33	L32-W36 PolarHBondContact O-N 3.42Å; E33-W36 PolarHBondContact O-N 2.88Å
37	K	85.2	Confident	90.2	Very high	148 Å²	148	68.7 Å²	68.7	64%	0.643	34%	0.34	S	S	*	.	H	α-helix	trans	-68.1	-39.4	178.8	-70.8	175.8	-173.7	173.9	0	112.9	E33 S34 C35	E33-K37 WeakPolarHBondContact O-CG 3.5Å; E33-K37 PolarHBondContact O-N 3.47Å; S34-K37 PolarHBondContact O-N 3.03Å; C35-K37 VanDerWaalsContact C-N 3.29Å; C35-K37 PolarHBondContact O-N 3.34Å
38	T	80.9	Confident	90.2	Very high	67 Å²	67	68.8 Å²	68.8	41%	0.411	34%	0.341	S	S	.	.	H	α-helix	trans	-96.6	-10.2	-173.5	57.6	0	0	0	0	114.4	R5 S34 C35 N40	R5-T38 PolarHBondContact NH1-OG1 2.95Å; S34-T38 PolarHBondContact O-N 3.44Å; S34-T38 VanDerWaalsContact O-N 3.1Å; S34-T38 PolarHBondContact O-OG1 3.29Å; S34-T38 VanDerWaalsContact O-OG1 3.1Å; C35-T38 PolarHBondContact O-N 3.29Å; T38-N40 PolarHBondContact O-N 3.41Å
39	R	79.1	Confident	90.1	Very high	235 Å²	235	68.8 Å²	68.8	89%	0.887	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	30.1	-176.2	-62.5	-173.4	176	-168.1	-1.1	114	C35	C35-R39 PolarHBondContact O-N 3.13Å
40	N	77	Confident	90.2	Very high	77 Å²	77	68.2 Å²	68.2	41%	0.412	34%	0.336	S	S	.	.			trans	-137.2	88.4	-175.7	-178.6	25.6	0	0	0	109.7	E2 R5 T38	E2-N40 PolarHBondContact OE1-ND2 2.85Å; R5-N40 PolarHBondContact NH2-ND2 3.09Å; R5-N40 PolarHBondContact NH2-O 3.17Å; T38-N40 PolarHBondContact O-N 3.41Å
41	C	81.6	Confident	90.4	Very high	33 Å²	33	62.9 Å²	62.9	22%	0.223	31%	0.313	C	S	.	.			trans	-150	153.2	170.4	-52.4	0	0	0	0	110.1	C35 L46	C35-C41 WeakPolarHBondContact CA-SG 3.42Å; C35-C41 HydrophobicContact CB-CB 4.27Å; C35-C41 WeakPolarHBondContact CB-SG 3.42Å; C35-C41 WeakPolarHBondContact SG-CB 3.44Å; C35-C41 CovalentContact SG-SG 2Å; C35-C41 PolarHBondContact SG-SG 3.46Å; C41-L46 HydrophobicContact CB-CD1 4.19Å; C41-L46 HydrophobicContact CB-CG 4.01Å
42	D	90.8	Very high	90.6	Very high	111 Å²	111	63.7 Å²	63.7	59%	0.594	32%	0.317	S	S	*	.			trans	-71.5	141.3	172.8	-67.2	-46.3	0	0	0	111.4	S44 D45 L46	D42-S44 PolarHBondContact O-N 3.27Å; D42-D45 HydrophobicContact CB-CB 4.34Å; D42-D45 PolarHBondContact O-N 2.86Å; D42-L46 PolarHBondContact O-N 2.91Å
43	A	91.9	Very high	90.8	Very high	50 Å²	50	64.9 Å²	64.9	41%	0.413	32%	0.321	S	S	.	.	H	α-helix	trans	-55.1	-38.5	175.9	0	0	0	0	0	112	A47 A76	A43-A47 VanDerWaalsContact O-CB 3.32Å; A43-A47 WeakPolarHBondContact O-CB 3.43Å; A43-A47 PolarHBondContact O-N 3.45Å; A43-A76 WeakPolarHBondContact CB-O 3.39Å
44	S	93.4	Very high	91.1	Very high	67 Å²	67	59.9 Å²	59.9	47%	0.469	30%	0.297	S	S	.	.	H	α-helix	trans	-66.2	-42.1	178.5	-171	0	0	0	0	112.5	D42 A47 T48	D42-S44 PolarHBondContact O-N 3.27Å; S44-A47 PolarHBondContact O-N 2.99Å; S44-T48 WeakPolarHBondContact O-CB 3.41Å; S44-T48 PolarHBondContact O-N 3.13Å; S44-T48 PolarHBondContact O-OG1 3.07Å
45	D	94.1	Very high	91.5	Very high	45 Å²	45	60.3 Å²	60.3	24%	0.241	30%	0.295	C	S	.	.	H	α-helix	trans	-67.2	-43	178.6	-80.7	-3.8	0	0	0	111.6	L9 F31 D42 T48 A49	L9-D45 HydrophobicContact CD2-CB 3.68Å; F31-D45 HydrophobicContact CE1-CB 4.44Å; F31-D45 HydrophobicContact CZ-CB 4.01Å; D42-D45 HydrophobicContact CB-CB 4.34Å; D42-D45 PolarHBondContact O-N 2.86Å; D45-T48 PolarHBondContact O-N 2.78Å; D45-A49 WeakPolarHBondContact O-CB 3.33Å; D45-A49 PolarHBondContact O-N 3.22Å
46	L	94.7	Very high	92	Very high	39 Å²	39	60 Å²	60	20%	0.204	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-48.3	174.3	-84	173.3	0	0	0	111.5	L32 C35 C41 D42 T48 A49 H50 A76	L32-L46 HydrophobicContact CD2-CD2 3.68Å; C35-L46 HydrophobicContact CB-CD2 4.1Å; C35-L46 VanDerWaalsContact SG-CD2 3.5Å; C41-L46 HydrophobicContact CB-CD1 4.19Å; C41-L46 HydrophobicContact CB-CG 4.01Å; D42-L46 PolarHBondContact O-N 2.91Å; L46-T48 VanDerWaalsContact C-N 3.34Å; L46-T48 PolarHBondContact O-N 3.39Å; L46-A49 PolarHBondContact O-N 3.33Å; L46-H50 WeakPolarHBondContact O-CB 3.3Å; L46-H50 PolarHBondContact O-CD2 2.95Å; L46-H50 PolarHBondContact O-N 3.37Å; L46-A76 HydrophobicContact CB-CB 3.79Å
47	A	96.9	Very high	92.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-41.7	179.5	0	0	0	0	0	111.8	A43 S44 N51 A73 A76 N77 F80	A43-A47 VanDerWaalsContact O-CB 3.32Å; A43-A47 WeakPolarHBondContact O-CB 3.43Å; A43-A47 PolarHBondContact O-N 3.45Å; S44-A47 PolarHBondContact O-N 2.99Å; A47-N51 WeakPolarHBondContact O-CB 3.33Å; A47-N51 PolarHBondContact O-N 3.5Å; A47-A73 HydrophobicContact CB-CB 4.45Å; A47-A73 WeakPolarHBondContact CB-O 3.25Å; A47-A73 WeakPolarHBondContact O-CB 3.49Å; A47-A76 HydrophobicContact CB-CB 4.26Å; A47-N77 HydrophobicContact CB-CB 3.53Å; A47-F80 HydrophobicContact CB-CB 4.39Å; A47-F80 HydrophobicContact CB-CD1 3.75Å; A47-F80 HydrophobicContact CB-CE1 4.46Å; A47-F80 HydrophobicContact CB-CG 4.44Å
48	T	96.1	Very high	93.3	Very high	31 Å²	31	45.3 Å²	45.3	19%	0.19	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-46.7	175.6	-60.4	0	0	0	0	111.7	S44 D45 L46 N51 N52	S44-T48 WeakPolarHBondContact O-CB 3.41Å; S44-T48 PolarHBondContact O-N 3.13Å; S44-T48 PolarHBondContact O-OG1 3.07Å; D45-T48 PolarHBondContact O-N 2.78Å; L46-T48 VanDerWaalsContact C-N 3.34Å; L46-T48 PolarHBondContact O-N 3.39Å; T48-N51 PolarHBondContact O-N 3.28Å; T48-N52 WeakPolarHBondContact O-CB 3.19Å; T48-N52 VanDerWaalsContact O-CG 3.25Å; T48-N52 PolarHBondContact O-N 3.1Å
49	A	97.1	Very high	94.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-47.1	-179.4	0	0	0	0	0	112	L9 Y28 F31 L32 D45 L46 R53	L9-A49 HydrophobicContact CD1-CB 3.91Å; Y28-A49 HydrophobicContact CD1-CB 3.91Å; F31-A49 HydrophobicContact CD1-CB 3.68Å; F31-A49 HydrophobicContact CE1-CB 3.91Å; L32-A49 HydrophobicContact CD2-CB 3.92Å; L32-A49 HydrophobicContact CG-CB 4.26Å; D45-A49 WeakPolarHBondContact O-CB 3.33Å; D45-A49 PolarHBondContact O-N 3.22Å; L46-A49 PolarHBondContact O-N 3.33Å; A49-R53 VanDerWaalsContact O-CB 3.31Å; A49-R53 WeakPolarHBondContact O-CB 3.47Å; A49-R53 PolarHBondContact O-N 3.28Å
50	H	98.4	Very high	94.9	Very high	29 Å²	29	41.1 Å²	41.1	13%	0.134	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-47.6	175.3	-85.2	-64.5	0	0	0	111.8	L32 L46 N52 R53 G54 D69 A73	L32-H50 WeakPolarHBondContact CD2-NE2 3.13Å; L46-H50 WeakPolarHBondContact O-CB 3.3Å; L46-H50 PolarHBondContact O-CD2 2.95Å; L46-H50 PolarHBondContact O-N 3.37Å; H50-N52 PolarHBondContact O-N 2.99Å; H50-R53 PolarHBondContact O-N 3.27Å; H50-G54 PolarHBondContact O-N 3.19Å; H50-D69 WeakPolarHBondContact CB-O 3.46Å; H50-D69 IonicContact CE1-OD1 3.26Å; H50-D69 IonicContact CG-OD1 3.97Å; H50-D69 IonicContact ND1-OD1 3.36Å; H50-D69 PolarHBondContact ND1-OD1 3.22Å; H50-D69 WeakPolarHBondContact O-CB 3.48Å; H50-A73 HydrophobicContact CB-CB 3.7Å
51	N	98.6	Very high	95.9	Very high	3 Å²	3	42 Å²	42	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-48.1	179	177.7	79.3	0	0	0	112.1	A47 T48 R53 G54 Q55 Y70 A73 F80 N86	A47-N51 WeakPolarHBondContact O-CB 3.33Å; A47-N51 PolarHBondContact O-N 3.5Å; T48-N51 PolarHBondContact O-N 3.28Å; N51-R53 PolarHBondContact O-N 3.44Å; N51-G54 PolarHBondContact O-N 3.24Å; N51-Q55 WeakPolarHBondContact O-CB 3.38Å; N51-Q55 PolarHBondContact O-N 2.83Å; N51-Y70 WeakPolarHBondContact O-CE1 3.5Å; N51-A73 HydrophobicContact CB-CB 4.25Å; N51-F80 HydrophobicContact CB-CD1 4.46Å; N51-F80 HydrophobicContact CB-CE1 3.66Å; N51-F80 HydrophobicContact CB-CZ 4.48Å; N51-N86 PolarHBondContact OD1-ND2 3.05Å
52	N	98.4	Very high	96.6	Very high	23 Å²	23	43 Å²	43	12%	0.123	22%	0.224	C	C	.	.	H	α-helix	trans	-70.2	-35.4	-177.2	-66.2	-8.6	0	0	0	111.6	N13 F16 Y28 T48 H50 Q55 I56	N13-N52 PolarHBondContact OD1-ND2 2.92Å; F16-N52 HydrophobicContact CD2-CB 4.49Å; Y28-N52 HydrophobicContact CD2-CB 4.4Å; Y28-N52 HydrophobicContact CE1-CB 4.06Å; Y28-N52 HydrophobicContact CE2-CB 3.61Å; Y28-N52 VanDerWaalsContact CZ-CB 3.41Å; Y28-N52 WeakPolarHBondContact OH-CB 3.38Å; Y28-N52 PolarHBondContact OH-ND2 3.2Å; Y28-N52 VanDerWaalsContact OH-ND2 3.14Å; T48-N52 WeakPolarHBondContact O-CB 3.19Å; T48-N52 VanDerWaalsContact O-CG 3.25Å; T48-N52 PolarHBondContact O-N 3.1Å; H50-N52 PolarHBondContact O-N 2.99Å; N52-Q55 PolarHBondContact O-N 3.47Å; N52-I56 WeakPolarHBondContact O-CG1 3.07Å; N52-I56 PolarHBondContact O-N 2.94Å; N52-I56 VanDerWaalsContact O-N 3.1Å
53	R	98.6	Very high	97	Very high	40 Å²	40	40 Å²	40	15%	0.151	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-43.4	170.8	-168.2	176.8	71.9	173.8	-2.9	111.6	E25 Y28 T29 A49 H50 N51 Q55 I56 K57 D69	E25-R53 HydrophobicContact CG-CG 4.14Å; Y28-R53 HydrophobicContact CD2-CB 4.29Å; Y28-R53 HydrophobicContact CG-CB 4.36Å; T29-R53 WeakPolarHBondContact OG1-CD 3.39Å; T29-R53 PolarHBondContact OG1-NH1 3.24Å; A49-R53 VanDerWaalsContact O-CB 3.31Å; A49-R53 WeakPolarHBondContact O-CB 3.47Å; A49-R53 PolarHBondContact O-N 3.28Å; H50-R53 PolarHBondContact O-N 3.27Å; N51-R53 PolarHBondContact O-N 3.44Å; R53-Q55 VanDerWaalsContact C-N 3.28Å; R53-Q55 PolarHBondContact O-N 3.34Å; R53-I56 WeakPolarHBondContact O-CB 3.49Å; R53-I56 PolarHBondContact O-N 3.39Å; R53-K57 PolarHBondContact O-N 3.46Å; R53-K57 VanDerWaalsContact O-N 3.12Å; R53-D69 IonicContact CZ-OD1 3.98Å; R53-D69 VanDerWaalsContact CZ-OD1 3.26Å; R53-D69 IonicContact CZ-OD2 3.26Å; R53-D69 IonicContact NE-OD1 2.73Å; R53-D69 PolarHBondContact NE-OD1 3.35Å; R53-D69 IonicContact NE-OD2 3.44Å; R53-D69 PolarHBondContact NE-OD2 2.98Å; R53-D69 IonicContact NH2-OD1 3.88Å; R53-D69 PolarHBondContact NH2-OD1 3.08Å; R53-D69 IonicContact NH2-OD2 2.66Å
54	G	98.6	Very high	97.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-38.7	173.6	0	0	0	0	0	112.2	H50 N51 K57 Y58 A66 Y70	H50-G54 PolarHBondContact O-N 3.19Å; N51-G54 PolarHBondContact O-N 3.24Å; G54-K57 PolarHBondContact O-N 3.08Å; G54-Y58 WeakPolarHBondContact O-CB 3.48Å; G54-Y58 PolarHBondContact O-N 2.9Å; G54-A66 VanDerWaalsContact O-CB 3.31Å; G54-A66 WeakPolarHBondContact O-CB 3.36Å; G54-Y70 PolarHBondContact O-OH 2.9Å
55	Q	98.6	Very high	97.5	Very high	48 Å²	48	47.5 Å²	47.5	22%	0.224	22%	0.217	C	C	.	.	H	α-helix	trans	-65.9	-38.5	177	-165.4	173.5	23.7	0	0	112.8	F16 N51 N52 R53 Y58 F59 Y70	F16-Q55 HydrophobicContact CE2-CB 4.36Å; F16-Q55 HydrophobicContact CZ-CB 4.32Å; F16-Q55 HydrophobicContact CZ-CG 4.14Å; N51-Q55 WeakPolarHBondContact O-CB 3.38Å; N51-Q55 PolarHBondContact O-N 2.83Å; N52-Q55 PolarHBondContact O-N 3.47Å; R53-Q55 VanDerWaalsContact C-N 3.28Å; R53-Q55 PolarHBondContact O-N 3.34Å; Q55-Y58 WeakPolarHBondContact O-CB 3.5Å; Q55-Y58 PolarHBondContact O-N 3.23Å; Q55-F59 HydrophobicContact CG-CE1 4.17Å; Q55-F59 HydrophobicContact CG-CE2 3.82Å; Q55-F59 HydrophobicContact CG-CZ 3.62Å; Q55-F59 WeakPolarHBondContact O-CD2 3.47Å; Q55-F59 VanDerWaalsContact O-CG 3.3Å; Q55-F59 WeakPolarHBondContact O-CG 3.39Å; Q55-F59 PolarHBondContact O-N 3.47Å; Q55-Y70 WeakPolarHBondContact CA-OH 3.19Å; Q55-Y70 PolarHBondContact N-OH 3.15Å
56	I	98.6	Very high	97.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-50.2	172.1	-65.1	166.3	0	0	0	110.4	F16 F21 A24 E25 Y28 N52 R53 Y58 F59 R60	F16-I56 HydrophobicContact CD2-CD1 3.96Å; F16-I56 HydrophobicContact CD2-CG1 3.77Å; F16-I56 HydrophobicContact CE2-CD1 4.36Å; F16-I56 HydrophobicContact CE2-CG1 3.69Å; F21-I56 HydrophobicContact CB-CG1 4.23Å; F21-I56 HydrophobicContact CB-CG2 3.84Å; F21-I56 HydrophobicContact CD1-CG1 3.96Å; F21-I56 HydrophobicContact CG-CG1 4.44Å; A24-I56 HydrophobicContact CB-CD1 3.79Å; E25-I56 HydrophobicContact CB-CD1 3.86Å; E25-I56 HydrophobicContact CB-CG2 4.19Å; E25-I56 WeakPolarHBondContact OE2-CG2 3.37Å; Y28-I56 HydrophobicContact CD2-CD1 4.04Å; Y28-I56 HydrophobicContact CE2-CD1 4.1Å; N52-I56 WeakPolarHBondContact O-CG1 3.07Å; N52-I56 PolarHBondContact O-N 2.94Å; N52-I56 VanDerWaalsContact O-N 3.1Å; R53-I56 WeakPolarHBondContact O-CB 3.49Å; R53-I56 PolarHBondContact O-N 3.39Å; I56-Y58 VanDerWaalsContact C-N 3.3Å; I56-Y58 PolarHBondContact O-N 3.2Å; I56-F59 WeakPolarHBondContact O-CB 3.46Å; I56-F59 PolarHBondContact O-N 2.91Å; I56-F59 VanDerWaalsContact O-N 3.1Å; I56-R60 PolarHBondContact O-N 3.36Å
57	K	98.6	Very high	97.9	Very high	17 Å²	17	45.3 Å²	45.3	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-39.5	178.6	-72	168.1	166.7	-175.7	0	112	R53 G54 F59 R60 V61 D62 E65 A66 D69	R53-K57 PolarHBondContact O-N 3.46Å; R53-K57 VanDerWaalsContact O-N 3.12Å; G54-K57 PolarHBondContact O-N 3.08Å; K57-F59 PolarHBondContact O-N 2.73Å; K57-R60 CarbonylContact O-C 3.47Å; K57-R60 WeakPolarHBondContact O-CA 3.36Å; K57-R60 PolarHBondContact O-N 2.69Å; K57-R60 VanDerWaalsContact O-N 3.08Å; K57-V61 PolarHBondContact O-N 3.37Å; K57-V61 VanDerWaalsContact O-N 3.15Å; K57-D62 HydrophobicContact CB-CB 4.2Å; K57-D62 PolarHBondContact O-N 3.31Å; K57-E65 HydrophobicContact CD-CB 3.71Å; K57-E65 VanDerWaalsContact CE-OE2 3.3Å; K57-E65 WeakPolarHBondContact CE-OE2 3.47Å; K57-E65 IonicContact NZ-OE2 3.44Å; K57-E65 PolarHBondContact NZ-OE2 3.25Å; K57-A66 HydrophobicContact CB-CB 3.96Å; K57-D69 WeakPolarHBondContact CD-OD2 3.24Å; K57-D69 WeakPolarHBondContact CE-OD2 3.33Å; K57-D69 IonicContact NZ-OD2 3.6Å; K57-D69 PolarHBondContact NZ-OD2 3.08Å
58	Y	98.3	Very high	98	Very high	36 Å²	36	50 Å²	50	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-42.9	172.9	170.1	-93.4	0	0	0	112.2	G54 Q55 I56 R60 V61 F63 I90 R93	G54-Y58 WeakPolarHBondContact O-CB 3.48Å; G54-Y58 PolarHBondContact O-N 2.9Å; Q55-Y58 WeakPolarHBondContact O-CB 3.5Å; Q55-Y58 PolarHBondContact O-N 3.23Å; I56-Y58 VanDerWaalsContact C-N 3.3Å; I56-Y58 PolarHBondContact O-N 3.2Å; Y58-R60 PolarHBondContact O-N 3.43Å; Y58-V61 WeakPolarHBondContact O-CA 3.4Å; Y58-V61 PolarHBondContact O-N 3.22Å; Y58-F63 AromaticContact CD2-CD1 3.92Å; Y58-F63 HydrophobicContact CD2-CD1 3.92Å; Y58-F63 AromaticContact CD2-CE1 3.64Å; Y58-F63 HydrophobicContact CD2-CE1 3.64Å; Y58-F63 HydrophobicContact CE2-CD1 4.35Å; Y58-F63 AromaticContact CE2-CE1 3.72Å; Y58-F63 HydrophobicContact CE2-CE1 3.72Å; Y58-I90 HydrophobicContact CD2-CD1 3.92Å; Y58-I90 HydrophobicContact CD2-CG1 3.58Å; Y58-I90 HydrophobicContact CE2-CG1 3.92Å; Y58-R93 VanDerWaalsContact OH-CZ 3.24Å; Y58-R93 PolarHBondContact OH-NE 3.25Å; Y58-R93 PolarHBondContact OH-NH2 3.35Å
59	F	96.8	Very high	98.1	Very high	99 Å²	99	48.7 Å²	48.7	43%	0.434	22%	0.218	S	C	.	.	H	α-helix	trans	-63.7	-25.5	175.1	-63.2	-33.3	0	0	0	113.1	F16 F21 Q55 I56 K57 V61	F16-F59 HydrophobicContact CE2-CE2 4.47Å; F16-F59 HydrophobicContact CZ-CE2 4.19Å; F21-F59 HydrophobicContact CD1-CD2 4.49Å; F21-F59 AromaticContact CE1-CD2 3.98Å; F21-F59 HydrophobicContact CE1-CD2 3.98Å; F21-F59 AromaticContact CE1-CE2 3.92Å; F21-F59 HydrophobicContact CE1-CE2 3.92Å; F21-F59 HydrophobicContact CE2-CD2 4.09Å; F21-F59 AromaticContact CZ-CD2 3.76Å; F21-F59 HydrophobicContact CZ-CD2 3.76Å; F21-F59 AromaticContact CZ-CE2 3.8Å; F21-F59 HydrophobicContact CZ-CE2 3.8Å; Q55-F59 HydrophobicContact CG-CE1 4.17Å; Q55-F59 HydrophobicContact CG-CE2 3.82Å; Q55-F59 HydrophobicContact CG-CZ 3.62Å; Q55-F59 WeakPolarHBondContact O-CD2 3.47Å; Q55-F59 VanDerWaalsContact O-CG 3.3Å; Q55-F59 WeakPolarHBondContact O-CG 3.39Å; Q55-F59 PolarHBondContact O-N 3.47Å; I56-F59 WeakPolarHBondContact O-CB 3.46Å; I56-F59 PolarHBondContact O-N 2.91Å; I56-F59 VanDerWaalsContact O-N 3.1Å; K57-F59 PolarHBondContact O-N 2.73Å; F59-V61 VanDerWaalsContact C-N 3.32Å
60	R	96.8	Very high	98.2	Very high	115 Å²	115	48.8 Å²	48.8	43%	0.434	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	0.6	171.4	-57.1	-170.4	-38.6	-152.5	2.9	113.9	E25 I56 K57 Y58 D62	E25-R60 IonicContact OE1-CZ 3.76Å; E25-R60 IonicContact OE1-NH1 2.91Å; E25-R60 PolarHBondContact OE1-NH1 3.5Å; E25-R60 IonicContact OE1-NH2 3.95Å; E25-R60 IonicContact OE2-CZ 3.52Å; E25-R60 IonicContact OE2-NH1 3.6Å; E25-R60 PolarHBondContact OE2-NH1 3.12Å; I56-R60 PolarHBondContact O-N 3.36Å; K57-R60 CarbonylContact O-C 3.47Å; K57-R60 WeakPolarHBondContact O-CA 3.36Å; K57-R60 PolarHBondContact O-N 2.69Å; K57-R60 VanDerWaalsContact O-N 3.08Å; Y58-R60 PolarHBondContact O-N 3.43Å; R60-D62 WeakPolarHBondContact CB-OD2 3.44Å; R60-D62 IonicContact CZ-OD2 2.78Å; R60-D62 IonicContact NE-OD2 3.7Å; R60-D62 PolarHBondContact NE-OD2 2.87Å; R60-D62 IonicContact NH2-OD2 3.73Å; R60-D62 PolarHBondContact NH2-OD2 2.99Å; R60-D62 PolarHBondContact O-N 3.22Å
61	V	96.6	Very high	98.2	Very high	95 Å²	95	49.4 Å²	49.4	58%	0.576	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.8	18.9	-176.9	-158.1	0	0	0	0	113	K57 Y58 F59 F63	K57-V61 PolarHBondContact O-N 3.37Å; K57-V61 VanDerWaalsContact O-N 3.15Å; Y58-V61 WeakPolarHBondContact O-CA 3.4Å; Y58-V61 PolarHBondContact O-N 3.22Å; F59-V61 VanDerWaalsContact C-N 3.32Å; V61-F63 HydrophobicContact CG1-CD2 4.2Å; V61-F63 HydrophobicContact CG1-CE1 4.18Å; V61-F63 HydrophobicContact CG1-CE2 3.61Å; V61-F63 HydrophobicContact CG1-CZ 3.6Å; V61-F63 PolarHBondContact O-N 3.2Å
62	D	97.9	Very high	98.2	Very high	54 Å²	54	51.1 Å²	51.1	29%	0.289	24%	0.237	S	C	.	.			trans	-81.6	62	175.3	-60.6	-39.5	0	0	0	110.4	K57 R60 R64 E65 A66	K57-D62 HydrophobicContact CB-CB 4.2Å; K57-D62 PolarHBondContact O-N 3.31Å; R60-D62 WeakPolarHBondContact CB-OD2 3.44Å; R60-D62 IonicContact CZ-OD2 2.78Å; R60-D62 IonicContact NE-OD2 3.7Å; R60-D62 PolarHBondContact NE-OD2 2.87Å; R60-D62 IonicContact NH2-OD2 3.73Å; R60-D62 PolarHBondContact NH2-OD2 2.99Å; R60-D62 PolarHBondContact O-N 3.22Å; D62-R64 VanDerWaalsContact C-N 3.28Å; D62-R64 PolarHBondContact O-N 3.35Å; D62-E65 PolarHBondContact O-N 3.17Å; D62-A66 WeakPolarHBondContact O-CB 3.31Å; D62-A66 PolarHBondContact O-N 2.73Å
63	F	97.6	Very high	98.2	Very high	48 Å²	48	50 Å²	50	21%	0.211	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-36.1	-168.3	-68.3	-36.3	0	0	0	114.1	Y58 V61 M67 I90 L94	Y58-F63 AromaticContact CD2-CD1 3.92Å; Y58-F63 HydrophobicContact CD2-CD1 3.92Å; Y58-F63 AromaticContact CD2-CE1 3.64Å; Y58-F63 HydrophobicContact CD2-CE1 3.64Å; Y58-F63 HydrophobicContact CE2-CD1 4.35Å; Y58-F63 AromaticContact CE2-CE1 3.72Å; Y58-F63 HydrophobicContact CE2-CE1 3.72Å; V61-F63 HydrophobicContact CG1-CD2 4.2Å; V61-F63 HydrophobicContact CG1-CE1 4.18Å; V61-F63 HydrophobicContact CG1-CE2 3.61Å; V61-F63 HydrophobicContact CG1-CZ 3.6Å; V61-F63 PolarHBondContact O-N 3.2Å; F63-M67 WeakPolarHBondContact O-CB 3.37Å; F63-M67 WeakPolarHBondContact O-CG 3.36Å; F63-M67 PolarHBondContact O-N 2.94Å; F63-I90 HydrophobicContact CB-CG2 3.79Å; F63-I90 HydrophobicContact CD1-CD1 4.13Å; F63-I90 HydrophobicContact CD1-CG1 3.97Å; F63-I90 HydrophobicContact CD1-CG2 4.14Å; F63-I90 HydrophobicContact CG-CG2 4.02Å; F63-L94 HydrophobicContact CD2-CD2 4.09Å
64	R	98.1	Very high	98.2	Very high	194 Å²	194	49.1 Å²	49.1	73%	0.732	23%	0.229	S	C	*	.	H	α-helix	trans	-62.2	-51.6	177.6	178.5	-179	169.5	170.1	0.6	111.3	D62 A66 M67 E68	D62-R64 VanDerWaalsContact C-N 3.28Å; D62-R64 PolarHBondContact O-N 3.35Å; R64-A66 VanDerWaalsContact C-N 3.32Å; R64-A66 PolarHBondContact O-N 3.41Å; R64-M67 WeakPolarHBondContact O-CB 3.48Å; R64-M67 PolarHBondContact O-N 2.96Å; R64-E68 IonicContact NE-OE1 2.69Å; R64-E68 PolarHBondContact NE-OE1 2.91Å; R64-E68 IonicContact NH2-OE1 3.48Å; R64-E68 WeakPolarHBondContact O-CG 3.37Å; R64-E68 PolarHBondContact O-N 3.18Å; R64-E68 VanDerWaalsContact O-N 3.07Å
65	E	98.2	Very high	98.1	Very high	81 Å²	81	56.3 Å²	56.3	38%	0.379	26%	0.263	S	S	.	.	H	α-helix	trans	-69.1	-33.7	-178.3	-63.2	-175.6	-140.8	0	0	111.9	K57 D62 E68 D69	K57-E65 HydrophobicContact CD-CB 3.71Å; K57-E65 VanDerWaalsContact CE-OE2 3.3Å; K57-E65 WeakPolarHBondContact CE-OE2 3.47Å; K57-E65 IonicContact NZ-OE2 3.44Å; K57-E65 PolarHBondContact NZ-OE2 3.25Å; D62-E65 PolarHBondContact O-N 3.17Å; E65-E68 PolarHBondContact O-N 2.86Å; E65-D69 PolarHBondContact O-N 3.18Å
66	A	98.7	Very high	98	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-41.9	173.5	0	0	0	0	0	111.8	G54 K57 D62 R64 E68 D69 Y70 I90	G54-A66 VanDerWaalsContact O-CB 3.31Å; G54-A66 WeakPolarHBondContact O-CB 3.36Å; K57-A66 HydrophobicContact CB-CB 3.96Å; D62-A66 WeakPolarHBondContact O-CB 3.31Å; D62-A66 PolarHBondContact O-N 2.73Å; R64-A66 VanDerWaalsContact C-N 3.32Å; R64-A66 PolarHBondContact O-N 3.41Å; A66-E68 VanDerWaalsContact C-N 3.35Å; A66-E68 PolarHBondContact O-N 2.94Å; A66-D69 PolarHBondContact O-N 3.29Å; A66-Y70 HydrophobicContact CB-CE2 4.13Å; A66-Y70 WeakPolarHBondContact O-CD2 3.33Å; A66-Y70 VanDerWaalsContact O-CG 3.28Å; A66-Y70 PolarHBondContact O-N 3.4Å; A66-I90 HydrophobicContact CB-CD1 3.54Å
67	M	98.5	Very high	97.9	Very high	37 Å²	37	57.1 Å²	57.1	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-40.4	174.7	-76.1	-72.8	-60.3	0	0	112.6	F63 R64 T71 R87 I90 R91	F63-M67 WeakPolarHBondContact O-CB 3.37Å; F63-M67 WeakPolarHBondContact O-CG 3.36Å; F63-M67 PolarHBondContact O-N 2.94Å; R64-M67 WeakPolarHBondContact O-CB 3.48Å; R64-M67 PolarHBondContact O-N 2.96Å; M67-T71 WeakPolarHBondContact O-CB 3.36Å; M67-T71 PolarHBondContact O-N 3.48Å; M67-T71 PolarHBondContact O-OG1 2.98Å; M67-R87 HydrophobicContact CE-CG 3.39Å; M67-R87 HydrophobicContact SD-CB 4.39Å; M67-R87 HydrophobicContact SD-CG 3.35Å; M67-R87 WeakPolarHBondContact SD-CG 3.12Å; M67-I90 HydrophobicContact CG-CB 4.14Å; M67-I90 HydrophobicContact CG-CD1 3.95Å; M67-I90 HydrophobicContact CG-CG2 3.63Å; M67-I90 HydrophobicContact SD-CB 3.68Å; M67-I90 HydrophobicContact SD-CD1 4.19Å; M67-I90 HydrophobicContact SD-CG1 4.49Å; M67-I90 HydrophobicContact SD-CG2 3.69Å; M67-R91 HydrophobicContact CE-CG 3.89Å; M67-R91 HydrophobicContact SD-CG 4.26Å
68	E	98.6	Very high	97.9	Very high	100 Å²	100	59.8 Å²	59.8	47%	0.467	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-47.5	174.6	-71.5	170	-171.3	0	0	110	R64 E65 A66 T71 S72	R64-E68 IonicContact NE-OE1 2.69Å; R64-E68 PolarHBondContact NE-OE1 2.91Å; R64-E68 IonicContact NH2-OE1 3.48Å; R64-E68 WeakPolarHBondContact O-CG 3.37Å; R64-E68 PolarHBondContact O-N 3.18Å; R64-E68 VanDerWaalsContact O-N 3.07Å; E65-E68 PolarHBondContact O-N 2.86Å; A66-E68 VanDerWaalsContact C-N 3.35Å; A66-E68 PolarHBondContact O-N 2.94Å; E68-T71 PolarHBondContact O-N 3.43Å; E68-S72 PolarHBondContact O-N 3.44Å; E68-S72 PolarHBondContact O-OG 3.14Å
69	D	98.7	Very high	97.8	Very high	3 Å²	3	64.9 Å²	64.9	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-45.6	177.3	-94.3	-40.6	0	0	0	113.3	H50 R53 K57 E65 A66 T71 S72 A73	H50-D69 WeakPolarHBondContact CB-O 3.46Å; H50-D69 IonicContact CE1-OD1 3.26Å; H50-D69 IonicContact CG-OD1 3.97Å; H50-D69 IonicContact ND1-OD1 3.36Å; H50-D69 PolarHBondContact ND1-OD1 3.22Å; H50-D69 WeakPolarHBondContact O-CB 3.48Å; R53-D69 IonicContact CZ-OD1 3.98Å; R53-D69 VanDerWaalsContact CZ-OD1 3.26Å; R53-D69 IonicContact CZ-OD2 3.26Å; R53-D69 IonicContact NE-OD1 2.73Å; R53-D69 PolarHBondContact NE-OD1 3.35Å; R53-D69 IonicContact NE-OD2 3.44Å; R53-D69 PolarHBondContact NE-OD2 2.98Å; R53-D69 IonicContact NH2-OD1 3.88Å; R53-D69 PolarHBondContact NH2-OD1 3.08Å; R53-D69 IonicContact NH2-OD2 2.66Å; K57-D69 WeakPolarHBondContact CD-OD2 3.24Å; K57-D69 WeakPolarHBondContact CE-OD2 3.33Å; K57-D69 IonicContact NZ-OD2 3.6Å; K57-D69 PolarHBondContact NZ-OD2 3.08Å; E65-D69 PolarHBondContact O-N 3.18Å; A66-D69 PolarHBondContact O-N 3.29Å; D69-T71 VanDerWaalsContact C-N 3.26Å; D69-T71 PolarHBondContact O-N 3.22Å; D69-S72 PolarHBondContact O-N 3.26Å; D69-A73 PolarHBondContact O-N 2.61Å
70	Y	98.8	Very high	97.8	Very high	1 Å²	1	62 Å²	62	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-33.2	176.1	-60.7	-41.6	0	0	0	112.5	N51 G54 Q55 A66 A73 I74 N86 R87 I90	N51-Y70 WeakPolarHBondContact O-CE1 3.5Å; G54-Y70 PolarHBondContact O-OH 2.9Å; Q55-Y70 WeakPolarHBondContact CA-OH 3.19Å; Q55-Y70 PolarHBondContact N-OH 3.15Å; A66-Y70 HydrophobicContact CB-CE2 4.13Å; A66-Y70 WeakPolarHBondContact O-CD2 3.33Å; A66-Y70 VanDerWaalsContact O-CG 3.28Å; A66-Y70 PolarHBondContact O-N 3.4Å; Y70-A73 PolarHBondContact O-N 2.93Å; Y70-I74 WeakPolarHBondContact O-CD1 3.4Å; Y70-I74 VanDerWaalsContact O-CG1 3.3Å; Y70-I74 WeakPolarHBondContact O-CG1 3.43Å; Y70-I74 PolarHBondContact O-N 3Å; Y70-N86 HydrophobicContact CD1-CB 3.88Å; Y70-N86 HydrophobicContact CD2-CB 4.05Å; Y70-N86 HydrophobicContact CE1-CB 3.51Å; Y70-N86 HydrophobicContact CE2-CB 3.67Å; Y70-N86 HydrophobicContact CG-CB 4.16Å; Y70-N86 VanDerWaalsContact CZ-CB 3.41Å; Y70-R87 HydrophobicContact CD2-CB 4.27Å; Y70-R87 HydrophobicContact CG-CB 4.46Å; Y70-I90 HydrophobicContact CD2-CD1 4.02Å; Y70-I90 HydrophobicContact CE2-CD1 3.6Å; Y70-I90 HydrophobicContact CE2-CG1 4.39Å
71	T	98.7	Very high	97.9	Very high	42 Å²	42	58.8 Å²	58.8	26%	0.258	30%	0.295	S	S	.	.	H	α-helix	trans	-67.9	-45.7	175.3	-59.2	0	0	0	0	110.8	M67 E68 D69 A73 I74 E75	M67-T71 WeakPolarHBondContact O-CB 3.36Å; M67-T71 PolarHBondContact O-N 3.48Å; M67-T71 PolarHBondContact O-OG1 2.98Å; E68-T71 PolarHBondContact O-N 3.43Å; D69-T71 VanDerWaalsContact C-N 3.26Å; D69-T71 PolarHBondContact O-N 3.22Å; T71-A73 VanDerWaalsContact C-N 3.26Å; T71-A73 PolarHBondContact O-N 3.1Å; T71-I74 PolarHBondContact O-N 3.49Å; T71-I74 VanDerWaalsContact O-N 3.15Å; T71-E75 WeakPolarHBondContact O-CG 3.48Å; T71-E75 PolarHBondContact O-N 2.93Å
72	S	98.3	Very high	98	Very high	40 Å²	40	56 Å²	56	28%	0.28	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-34.4	173.2	-62.5	0	0	0	0	112.6	E68 D69 E75 A76	E68-S72 PolarHBondContact O-N 3.44Å; E68-S72 PolarHBondContact O-OG 3.14Å; D69-S72 PolarHBondContact O-N 3.26Å; S72-E75 PolarHBondContact O-N 2.93Å; S72-A76 WeakPolarHBondContact O-CB 3.13Å; S72-A76 PolarHBondContact O-N 3.48Å
73	A	98.4	Very high	98	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-42.5	174.3	0	0	0	0	0	112.4	A47 H50 N51 D69 Y70 T71 A76 N77 S83	A47-A73 HydrophobicContact CB-CB 4.45Å; A47-A73 WeakPolarHBondContact CB-O 3.25Å; A47-A73 WeakPolarHBondContact O-CB 3.49Å; H50-A73 HydrophobicContact CB-CB 3.7Å; N51-A73 HydrophobicContact CB-CB 4.25Å; D69-A73 PolarHBondContact O-N 2.61Å; Y70-A73 PolarHBondContact O-N 2.93Å; T71-A73 VanDerWaalsContact C-N 3.26Å; T71-A73 PolarHBondContact O-N 3.1Å; A73-A76 PolarHBondContact O-N 3.24Å; A73-N77 PolarHBondContact O-N 3.3Å; A73-S83 VanDerWaalsContact CB-OG 3.23Å; A73-S83 WeakPolarHBondContact CB-OG 3.4Å
74	I	98.4	Very high	98	Very high	21 Å²	21	51.9 Å²	51.9	11%	0.108	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-40.8	175.9	-69.7	162.2	0	0	0	111.4	Y70 T71 A76 N77 C78 F84	Y70-I74 WeakPolarHBondContact O-CD1 3.4Å; Y70-I74 VanDerWaalsContact O-CG1 3.3Å; Y70-I74 WeakPolarHBondContact O-CG1 3.43Å; Y70-I74 PolarHBondContact O-N 3Å; T71-I74 PolarHBondContact O-N 3.49Å; T71-I74 VanDerWaalsContact O-N 3.15Å; I74-A76 VanDerWaalsContact C-N 3.34Å; I74-N77 CarbonylContact O-C 3.2Å; I74-N77 PolarHBondContact O-N 3.37Å; I74-C78 WeakPolarHBondContact O-CA 3.33Å; I74-C78 PolarHBondContact O-N 3.37Å; I74-C78 VanDerWaalsContact O-N 3.13Å; I74-F84 HydrophobicContact CB-CZ 4.32Å; I74-F84 HydrophobicContact CD1-CD1 3.69Å; I74-F84 HydrophobicContact CD1-CE1 3.79Å; I74-F84 HydrophobicContact CD1-CG 4.07Å; I74-F84 HydrophobicContact CD1-CZ 4.28Å; I74-F84 HydrophobicContact CG1-CD1 4.18Å; I74-F84 HydrophobicContact CG1-CD2 4.2Å; I74-F84 HydrophobicContact CG1-CE1 4.03Å; I74-F84 HydrophobicContact CG1-CE2 4.07Å; I74-F84 HydrophobicContact CG1-CG 4.26Å; I74-F84 HydrophobicContact CG1-CZ 3.99Å; I74-F84 HydrophobicContact CG2-CE1 3.75Å; I74-F84 HydrophobicContact CG2-CE2 4.14Å; I74-F84 HydrophobicContact CG2-CZ 3.43Å; I74-F84 VanDerWaalsContact CG2-CZ 3.43Å
75	E	97.7	Very high	98.1	Very high	151 Å²	151	44.1 Å²	44.1	71%	0.706	23%	0.229	S	C	*	.	H	α-helix	trans	-65.7	-37.9	176.5	-72	174.2	170.4	0	0	111.9	T71 S72	T71-E75 WeakPolarHBondContact O-CG 3.48Å; T71-E75 PolarHBondContact O-N 2.93Å; S72-E75 PolarHBondContact O-N 2.93Å
76	A	96.1	Very high	98.1	Very high	31 Å²	31	40.8 Å²	40.8	26%	0.256	21%	0.214	S	C	.	.	H	α-helix	trans	-68.8	-44.6	175.6	0	0	0	0	0	111.9	A43 L46 A47 S72 A73 I74	A43-A76 WeakPolarHBondContact CB-O 3.39Å; L46-A76 HydrophobicContact CB-CB 3.79Å; A47-A76 HydrophobicContact CB-CB 4.26Å; S72-A76 WeakPolarHBondContact O-CB 3.13Å; S72-A76 PolarHBondContact O-N 3.48Å; A73-A76 PolarHBondContact O-N 3.24Å; I74-A76 VanDerWaalsContact C-N 3.34Å
77	N	97.2	Very high	98.1	Very high	34 Å²	34	42.3 Å²	42.3	18%	0.182	22%	0.22	C	C	.	.			trans	-143.8	103.1	176.9	-175.3	2.9	0	0	0	111.9	A47 A73 I74 Q79 F80	A47-N77 HydrophobicContact CB-CB 3.53Å; A73-N77 PolarHBondContact O-N 3.3Å; I74-N77 CarbonylContact O-C 3.2Å; I74-N77 PolarHBondContact O-N 3.37Å; N77-Q79 PolarHBondContact O-N 2.82Å; N77-Q79 WeakPolarHBondContact OD1-CB 3.45Å; N77-Q79 PolarHBondContact OD1-N 3.27Å; N77-F80 HydrophobicContact CB-CB 4.3Å; N77-F80 PolarHBondContact O-N 3.12Å
78	C	96.9	Very high	98.1	Very high	74 Å²	74	40.6 Å²	40.6	50%	0.5	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-2.7	179.5	68.6	0	0	0	0	114.5	I74	I74-C78 WeakPolarHBondContact O-CA 3.33Å; I74-C78 PolarHBondContact O-N 3.37Å; I74-C78 VanDerWaalsContact O-N 3.13Å
79	Q	97.3	Very high	98.1	Very high	143 Å²	143	37.2 Å²	37.2	67%	0.668	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	3.1	173.2	-61.6	-171.7	-26.9	0	0	112.9	N77 E81	N77-Q79 PolarHBondContact O-N 2.82Å; N77-Q79 WeakPolarHBondContact OD1-CB 3.45Å; N77-Q79 PolarHBondContact OD1-N 3.27Å; Q79-E81 PolarHBondContact O-N 3.4Å
80	F	96.9	Very high	98.1	Very high	38 Å²	38	37 Å²	37	17%	0.167	20%	0.195	C	C	.	.			trans	-90.6	92.9	179	-169.2	-150.5	0	0	0	111.8	A47 N51 N77 V82 S83	A47-F80 HydrophobicContact CB-CB 4.39Å; A47-F80 HydrophobicContact CB-CD1 3.75Å; A47-F80 HydrophobicContact CB-CE1 4.46Å; A47-F80 HydrophobicContact CB-CG 4.44Å; N51-F80 HydrophobicContact CB-CD1 4.46Å; N51-F80 HydrophobicContact CB-CE1 3.66Å; N51-F80 HydrophobicContact CB-CZ 4.48Å; N77-F80 HydrophobicContact CB-CB 4.3Å; N77-F80 PolarHBondContact O-N 3.12Å; F80-V82 VanDerWaalsContact C-N 3.25Å; F80-V82 HydrophobicContact CD2-CB 4.21Å; F80-V82 HydrophobicContact CD2-CG2 4.31Å; F80-V82 HydrophobicContact CE1-CB 4.46Å; F80-V82 HydrophobicContact CE2-CB 3.7Å; F80-V82 HydrophobicContact CE2-CG2 3.7Å; F80-V82 HydrophobicContact CZ-CB 3.85Å; F80-V82 HydrophobicContact CZ-CG1 4.43Å; F80-V82 HydrophobicContact CZ-CG2 4.23Å; F80-V82 PolarHBondContact O-N 2.93Å; F80-S83 WeakPolarHBondContact CD1-OG 3.35Å; F80-S83 PolarHBondContact O-N 2.96Å
81	E	98.1	Very high	98.1	Very high	47 Å²	47	39.4 Å²	39.4	22%	0.22	20%	0.204	C	C	.	.	H	α-helix	trans	-57.6	-34.4	-174.6	76	-78.2	-161.9	0	0	113.6	Q79 S83 F84 Y85 A107 L110 N111 F114	Q79-E81 PolarHBondContact O-N 3.4Å; E81-S83 PolarHBondContact O-N 2.85Å; E81-F84 PolarHBondContact O-N 3.24Å; E81-Y85 PolarHBondContact O-N 2.83Å; E81-A107 HydrophobicContact CB-CB 4.4Å; E81-L110 HydrophobicContact CB-CB 3.83Å; E81-L110 HydrophobicContact CB-CD1 4.11Å; E81-N111 HydrophobicContact CB-CB 4.31Å; E81-N111 HydrophobicContact CG-CB 3.85Å; E81-F114 HydrophobicContact CB-CD1 4.45Å; E81-F114 HydrophobicContact CG-CD1 3.74Å; E81-F114 HydrophobicContact CG-CE1 3.93Å
82	V	98.3	Very high	98.1	Very high	38 Å²	38	40.4 Å²	40.4	23%	0.23	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-34	-177.2	-179.3	0	0	0	0	111.5	F80 Y85 N86 F114	F80-V82 VanDerWaalsContact C-N 3.25Å; F80-V82 HydrophobicContact CD2-CB 4.21Å; F80-V82 HydrophobicContact CD2-CG2 4.31Å; F80-V82 HydrophobicContact CE1-CB 4.46Å; F80-V82 HydrophobicContact CE2-CB 3.7Å; F80-V82 HydrophobicContact CE2-CG2 3.7Å; F80-V82 HydrophobicContact CZ-CB 3.85Å; F80-V82 HydrophobicContact CZ-CG1 4.43Å; F80-V82 HydrophobicContact CZ-CG2 4.23Å; F80-V82 PolarHBondContact O-N 2.93Å; V82-Y85 PolarHBondContact O-N 3.18Å; V82-N86 WeakPolarHBondContact O-CB 3.39Å; V82-N86 VanDerWaalsContact O-CG 3.3Å; V82-N86 PolarHBondContact O-N 3.36Å; V82-N86 PolarHBondContact O-ND2 3.34Å; V82-F114 HydrophobicContact CG2-CE1 4.43Å
83	S	98.2	Very high	98	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.6	-37.4	179.7	-58.7	0	0	0	0	112	A73 F80 E81 R87	A73-S83 VanDerWaalsContact CB-OG 3.23Å; A73-S83 WeakPolarHBondContact CB-OG 3.4Å; F80-S83 WeakPolarHBondContact CD1-OG 3.35Å; F80-S83 PolarHBondContact O-N 2.96Å; E81-S83 PolarHBondContact O-N 2.85Å; S83-R87 WeakPolarHBondContact O-CB 3.38Å; S83-R87 PolarHBondContact O-N 3.44Å; S83-R87 VanDerWaalsContact O-N 3.08Å
84	F	98.8	Very high	97.9	Very high	15 Å²	15	49.9 Å²	49.9	7%	0.066	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-49	172.4	-70.7	-80.3	0	0	0	110.7	I74 E81 N86 R87 G88 D103 R106 A107 L110	I74-F84 HydrophobicContact CB-CZ 4.32Å; I74-F84 HydrophobicContact CD1-CD1 3.69Å; I74-F84 HydrophobicContact CD1-CE1 3.79Å; I74-F84 HydrophobicContact CD1-CG 4.07Å; I74-F84 HydrophobicContact CD1-CZ 4.28Å; I74-F84 HydrophobicContact CG1-CD1 4.18Å; I74-F84 HydrophobicContact CG1-CD2 4.2Å; I74-F84 HydrophobicContact CG1-CE1 4.03Å; I74-F84 HydrophobicContact CG1-CE2 4.07Å; I74-F84 HydrophobicContact CG1-CG 4.26Å; I74-F84 HydrophobicContact CG1-CZ 3.99Å; I74-F84 HydrophobicContact CG2-CE1 3.75Å; I74-F84 HydrophobicContact CG2-CE2 4.14Å; I74-F84 HydrophobicContact CG2-CZ 3.43Å; I74-F84 VanDerWaalsContact CG2-CZ 3.43Å; E81-F84 PolarHBondContact O-N 3.24Å; F84-N86 PolarHBondContact O-N 2.89Å; F84-R87 PolarHBondContact O-N 2.93Å; F84-G88 PolarHBondContact O-N 2.9Å; F84-D103 WeakPolarHBondContact O-CB 3.23Å; F84-R106 HydrophobicContact CD1-CB 3.93Å; F84-R106 HydrophobicContact CD1-CG 3.59Å; F84-R106 HydrophobicContact CD2-CG 4.01Å; F84-R106 HydrophobicContact CE1-CB 4.25Å; F84-R106 HydrophobicContact CE1-CG 3.48Å; F84-R106 VanDerWaalsContact CE1-CG 3.48Å; F84-R106 HydrophobicContact CE2-CG 3.91Å; F84-R106 HydrophobicContact CG-CB 4.21Å; F84-R106 HydrophobicContact CG-CG 3.86Å; F84-R106 HydrophobicContact CZ-CG 3.64Å; F84-A107 HydrophobicContact CB-CB 4.12Å; F84-L110 HydrophobicContact CD2-CD1 3.88Å; F84-L110 HydrophobicContact CE2-CD1 3.82Å
85	Y	98.8	Very high	97.7	Very high	31 Å²	31	49.8 Å²	49.8	12%	0.122	24%	0.243	C	C	.	.	H	α-helix	trans	-55.2	-49.8	177.9	173.2	-106.2	0	0	0	112	E81 V82 R87 G88 L89 F104 F114 D116 A117 S120	E81-Y85 PolarHBondContact O-N 2.83Å; V82-Y85 PolarHBondContact O-N 3.18Å; Y85-R87 VanDerWaalsContact C-N 3.35Å; Y85-R87 PolarHBondContact O-N 3.2Å; Y85-G88 PolarHBondContact O-N 3.39Å; Y85-L89 HydrophobicContact CD1-CD1 4.2Å; Y85-L89 HydrophobicContact CE1-CD1 3.5Å; Y85-L89 VanDerWaalsContact CE1-CD1 3.5Å; Y85-L89 HydrophobicContact CE1-CG 4.08Å; Y85-L89 HydrophobicContact CE2-CD1 4.42Å; Y85-L89 HydrophobicContact CE2-CD2 4.2Å; Y85-L89 HydrophobicContact CE2-CG 4.16Å; Y85-L89 PolarHBondContact O-N 3.28Å; Y85-F104 AromaticContact CD2-CD1 3.78Å; Y85-F104 HydrophobicContact CD2-CD1 3.78Å; Y85-F104 AromaticContact CD2-CE1 3.67Å; Y85-F104 HydrophobicContact CD2-CE1 3.67Å; Y85-F104 HydrophobicContact CE2-CD1 4.31Å; Y85-F104 AromaticContact CE2-CE1 3.91Å; Y85-F104 HydrophobicContact CE2-CE1 3.91Å; Y85-F104 WeakPolarHBondContact O-CE1 3.48Å; Y85-F114 HydrophobicContact CD1-CE1 4.37Å; Y85-F114 AromaticContact CD1-CZ 3.8Å; Y85-F114 HydrophobicContact CD1-CZ 3.8Å; Y85-F114 HydrophobicContact CD2-CZ 4.4Å; Y85-F114 HydrophobicContact CE1-CZ 4.39Å; Y85-F114 AromaticContact CG-CE1 3.99Å; Y85-F114 HydrophobicContact CG-CE1 3.99Å; Y85-F114 AromaticContact CG-CZ 3.8Å; Y85-F114 HydrophobicContact CG-CZ 3.8Å; Y85-D116 HydrophobicContact CE1-CB 4.46Å; Y85-D116 HydrophobicContact CE2-CB 4.02Å; Y85-A117 HydrophobicContact CD2-CB 3.82Å; Y85-A117 HydrophobicContact CE2-CB 4.37Å; Y85-S120 WeakPolarHBondContact CE2-OG 3.4Å
86	N	98.7	Very high	97.7	Very high	11 Å²	11	47.8 Å²	47.8	6%	0.059	23%	0.232	C	C	.	.	H	α-helix	trans	-65.5	-36	-178.5	-75.6	-24.6	0	0	0	113.2	N51 Y70 V82 F84 L89 I90	N51-N86 PolarHBondContact OD1-ND2 3.05Å; Y70-N86 HydrophobicContact CD1-CB 3.88Å; Y70-N86 HydrophobicContact CD2-CB 4.05Å; Y70-N86 HydrophobicContact CE1-CB 3.51Å; Y70-N86 HydrophobicContact CE2-CB 3.67Å; Y70-N86 HydrophobicContact CG-CB 4.16Å; Y70-N86 VanDerWaalsContact CZ-CB 3.41Å; V82-N86 WeakPolarHBondContact O-CB 3.39Å; V82-N86 VanDerWaalsContact O-CG 3.3Å; V82-N86 PolarHBondContact O-N 3.36Å; V82-N86 PolarHBondContact O-ND2 3.34Å; F84-N86 PolarHBondContact O-N 2.89Å; N86-L89 PolarHBondContact O-N 3.5Å; N86-I90 PolarHBondContact O-N 2.85Å
87	R	98.8	Very high	97.8	Very high	32 Å²	32	47.8 Å²	47.8	12%	0.121	23%	0.227	C	C	.	.	H	α-helix	trans	-66.8	-42.5	173	-162.5	176.4	69.1	-176.4	-5.9	111.8	M67 Y70 S83 F84 Y85 L89 I90 R91 D103	M67-R87 HydrophobicContact CE-CG 3.39Å; M67-R87 HydrophobicContact SD-CB 4.39Å; M67-R87 HydrophobicContact SD-CG 3.35Å; M67-R87 WeakPolarHBondContact SD-CG 3.12Å; Y70-R87 HydrophobicContact CD2-CB 4.27Å; Y70-R87 HydrophobicContact CG-CB 4.46Å; S83-R87 WeakPolarHBondContact O-CB 3.38Å; S83-R87 PolarHBondContact O-N 3.44Å; S83-R87 VanDerWaalsContact O-N 3.08Å; F84-R87 PolarHBondContact O-N 2.93Å; Y85-R87 VanDerWaalsContact C-N 3.35Å; Y85-R87 PolarHBondContact O-N 3.2Å; R87-L89 VanDerWaalsContact C-N 3.32Å; R87-L89 PolarHBondContact O-N 3.28Å; R87-I90 PolarHBondContact O-N 2.91Å; R87-R91 PolarHBondContact O-N 3.44Å; R87-R91 VanDerWaalsContact O-N 3.08Å; R87-D103 IonicContact CZ-OD1 3.05Å; R87-D103 IonicContact CZ-OD2 3.17Å; R87-D103 IonicContact NE-OD1 2.76Å; R87-D103 PolarHBondContact NE-OD1 2.71Å; R87-D103 IonicContact NE-OD2 3.52Å; R87-D103 PolarHBondContact NE-OD2 3Å; R87-D103 IonicContact NH2-OD1 3.49Å; R87-D103 PolarHBondContact NH2-OD1 2.84Å; R87-D103 IonicContact NH2-OD2 2.71Å
88	G	98.6	Very high	97.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-41.1	175.2	0	0	0	0	0	112.4	F84 Y85 I90 R91 Y92 A100 D103	F84-G88 PolarHBondContact O-N 2.9Å; Y85-G88 PolarHBondContact O-N 3.39Å; G88-I90 VanDerWaalsContact C-N 3.33Å; G88-I90 PolarHBondContact O-N 2.88Å; G88-R91 PolarHBondContact O-N 2.77Å; G88-Y92 WeakPolarHBondContact O-CB 3.3Å; G88-Y92 PolarHBondContact O-N 2.96Å; G88-A100 WeakPolarHBondContact O-CB 3.32Å; G88-D103 PolarHBondContact N-OD2 2.95Å
89	L	98.7	Very high	97.8	Very high	29 Å²	29	52.3 Å²	52.3	15%	0.152	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-41.2	175.9	-76	-179.6	0	0	0	113	Y85 N86 R87 R93 F104	Y85-L89 HydrophobicContact CD1-CD1 4.2Å; Y85-L89 HydrophobicContact CE1-CD1 3.5Å; Y85-L89 VanDerWaalsContact CE1-CD1 3.5Å; Y85-L89 HydrophobicContact CE1-CG 4.08Å; Y85-L89 HydrophobicContact CE2-CD1 4.42Å; Y85-L89 HydrophobicContact CE2-CD2 4.2Å; Y85-L89 HydrophobicContact CE2-CG 4.16Å; Y85-L89 PolarHBondContact O-N 3.28Å; N86-L89 PolarHBondContact O-N 3.5Å; R87-L89 VanDerWaalsContact C-N 3.32Å; R87-L89 PolarHBondContact O-N 3.28Å; L89-R93 WeakPolarHBondContact O-CG 3.42Å; L89-R93 PolarHBondContact O-N 3.15Å; L89-R93 VanDerWaalsContact O-N 3.08Å; L89-F104 HydrophobicContact CD2-CE1 4.3Å; L89-F104 HydrophobicContact CD2-CZ 4.09Å; L89-F104 HydrophobicContact CG-CE1 4.28Å; L89-F104 HydrophobicContact CG-CZ 4.4Å
90	I	98.6	Very high	97.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.2	-47.9	176.4	-67	178.4	0	0	0	110.2	Y58 F63 A66 M67 Y70 N86 R87 G88 Y92 R93 L94	Y58-I90 HydrophobicContact CD2-CD1 3.92Å; Y58-I90 HydrophobicContact CD2-CG1 3.58Å; Y58-I90 HydrophobicContact CE2-CG1 3.92Å; F63-I90 HydrophobicContact CB-CG2 3.79Å; F63-I90 HydrophobicContact CD1-CD1 4.13Å; F63-I90 HydrophobicContact CD1-CG1 3.97Å; F63-I90 HydrophobicContact CD1-CG2 4.14Å; F63-I90 HydrophobicContact CG-CG2 4.02Å; A66-I90 HydrophobicContact CB-CD1 3.54Å; M67-I90 HydrophobicContact CG-CB 4.14Å; M67-I90 HydrophobicContact CG-CD1 3.95Å; M67-I90 HydrophobicContact CG-CG2 3.63Å; M67-I90 HydrophobicContact SD-CB 3.68Å; M67-I90 HydrophobicContact SD-CD1 4.19Å; M67-I90 HydrophobicContact SD-CG1 4.49Å; M67-I90 HydrophobicContact SD-CG2 3.69Å; Y70-I90 HydrophobicContact CD2-CD1 4.02Å; Y70-I90 HydrophobicContact CE2-CD1 3.6Å; Y70-I90 HydrophobicContact CE2-CG1 4.39Å; N86-I90 PolarHBondContact O-N 2.85Å; R87-I90 PolarHBondContact O-N 2.91Å; G88-I90 VanDerWaalsContact C-N 3.33Å; G88-I90 PolarHBondContact O-N 2.88Å; I90-Y92 VanDerWaalsContact C-N 3.28Å; I90-Y92 PolarHBondContact O-N 3.39Å; I90-R93 PolarHBondContact O-N 3.37Å; I90-R93 VanDerWaalsContact O-N 3.12Å; I90-L94 HydrophobicContact CG2-CD1 3.78Å; I90-L94 HydrophobicContact CG2-CG 4.26Å; I90-L94 WeakPolarHBondContact O-CG 3.23Å; I90-L94 PolarHBondContact O-N 3.47Å
91	R	98.5	Very high	98	Very high	50 Å²	50	45.4 Å²	45.4	19%	0.189	21%	0.21	C	C	.	.	H	α-helix	trans	-57.3	-43	178.8	-75.9	166	160.8	-169.3	-6.4	111.8	M67 R87 G88 L94 G95 F96 D99 A100 D103	M67-R91 HydrophobicContact CE-CG 3.89Å; M67-R91 HydrophobicContact SD-CG 4.26Å; R87-R91 PolarHBondContact O-N 3.44Å; R87-R91 VanDerWaalsContact O-N 3.08Å; G88-R91 PolarHBondContact O-N 2.77Å; R91-L94 PolarHBondContact O-N 3.27Å; R91-G95 PolarHBondContact O-N 2.97Å; R91-F96 HydrophobicContact CB-CB 4.22Å; R91-F96 WeakPolarHBondContact O-CB 3.4Å; R91-F96 PolarHBondContact O-N 3.17Å; R91-D99 HydrophobicContact CB-CB 4.44Å; R91-D99 HydrophobicContact CG-CB 4.23Å; R91-D99 PolarHBondContact NH1-O 3.27Å; R91-A100 HydrophobicContact CB-CB 3.89Å; R91-D103 VanDerWaalsContact CD-OD2 3.24Å; R91-D103 WeakPolarHBondContact CD-OD2 3.33Å; R91-D103 IonicContact CZ-OD2 2.84Å; R91-D103 IonicContact NE-OD2 2.9Å; R91-D103 IonicContact NH1-OD1 2.97Å; R91-D103 PolarHBondContact NH1-OD1 2.79Å; R91-D103 IonicContact NH1-OD2 2.79Å; R91-D103 PolarHBondContact NH1-OD2 3.18Å
92	Y	98.4	Very high	98	Very high	63 Å²	63	49.2 Å²	49.2	25%	0.247	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-49	174.4	170.7	-97.7	0	0	0	111.4	G88 I90 L94 G95 F97 Q123 T124 D127	G88-Y92 WeakPolarHBondContact O-CB 3.3Å; G88-Y92 PolarHBondContact O-N 2.96Å; I90-Y92 VanDerWaalsContact C-N 3.28Å; I90-Y92 PolarHBondContact O-N 3.39Å; Y92-L94 PolarHBondContact O-N 3.17Å; Y92-G95 PolarHBondContact O-N 3.41Å; Y92-F97 AromaticContact CD2-CD1 3.73Å; Y92-F97 HydrophobicContact CD2-CD1 3.73Å; Y92-F97 AromaticContact CD2-CE1 3.69Å; Y92-F97 HydrophobicContact CD2-CE1 3.69Å; Y92-F97 HydrophobicContact CE2-CD1 4.13Å; Y92-F97 AromaticContact CE2-CE1 3.74Å; Y92-F97 HydrophobicContact CE2-CE1 3.74Å; Y92-Q123 HydrophobicContact CE2-CG 4.24Å; Y92-Q123 WeakPolarHBondContact OH-CG 3.46Å; Y92-T124 HydrophobicContact CD2-CG2 4.3Å; Y92-T124 VanDerWaalsContact CD2-OG1 3.25Å; Y92-T124 WeakPolarHBondContact CD2-OG1 3.38Å; Y92-D127 HydrophobicContact CE2-CB 4.34Å; Y92-D127 VanDerWaalsContact CE2-OD2 3.3Å; Y92-D127 WeakPolarHBondContact CE2-OD2 2.88Å; Y92-D127 VanDerWaalsContact CZ-OD2 3.29Å; Y92-D127 PolarHBondContact OH-OD2 3.05Å
93	R	96.5	Very high	98	Very high	152 Å²	152	47.7 Å²	47.7	57%	0.574	22%	0.22	S	C	*	.	H	α-helix	trans	-60.9	-31.2	177.5	-75.4	179	-176.2	-79.6	-5.3	113.7	Y58 L89 I90 G95	Y58-R93 VanDerWaalsContact OH-CZ 3.24Å; Y58-R93 PolarHBondContact OH-NE 3.25Å; Y58-R93 PolarHBondContact OH-NH2 3.35Å; L89-R93 WeakPolarHBondContact O-CG 3.42Å; L89-R93 PolarHBondContact O-N 3.15Å; L89-R93 VanDerWaalsContact O-N 3.08Å; I90-R93 PolarHBondContact O-N 3.37Å; I90-R93 VanDerWaalsContact O-N 3.12Å; R93-G95 VanDerWaalsContact C-N 3.27Å
94	L	95.9	Very high	98	Very high	87 Å²	87	47.7 Å²	47.7	46%	0.455	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.4	176.8	-63.6	176.7	0	0	0	113	F63 I90 R91 Y92 F96	F63-L94 HydrophobicContact CD2-CD2 4.09Å; I90-L94 HydrophobicContact CG2-CD1 3.78Å; I90-L94 HydrophobicContact CG2-CG 4.26Å; I90-L94 WeakPolarHBondContact O-CG 3.23Å; I90-L94 PolarHBondContact O-N 3.47Å; R91-L94 PolarHBondContact O-N 3.27Å; Y92-L94 PolarHBondContact O-N 3.17Å; L94-F96 VanDerWaalsContact C-N 3.32Å; L94-F96 HydrophobicContact CB-CD2 3.49Å; L94-F96 VanDerWaalsContact CB-CD2 3.49Å; L94-F96 HydrophobicContact CB-CE2 3.53Å; L94-F96 HydrophobicContact CB-CG 4.43Å; L94-F96 HydrophobicContact CB-CZ 4.48Å; L94-F96 HydrophobicContact CD1-CD2 4.18Å; L94-F96 HydrophobicContact CD1-CE2 3.86Å; L94-F96 HydrophobicContact CG-CD2 4.49Å; L94-F96 HydrophobicContact CG-CE2 4.33Å
95	G	95.4	Very high	98	Very high	19 Å²	19	51.5 Å²	51.5	20%	0.196	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	13	179.8	0	0	0	0	0	114.4	R91 Y92 R93 F97 K131	R91-G95 PolarHBondContact O-N 2.97Å; Y92-G95 PolarHBondContact O-N 3.41Å; R93-G95 VanDerWaalsContact C-N 3.27Å; G95-F97 PolarHBondContact O-N 2.93Å; G95-F97 VanDerWaalsContact O-N 3.13Å; G95-K131 PolarHBondContact O-NZ 3.1Å; G95-K131 VanDerWaalsContact O-NZ 3.14Å
96	F	97.1	Very high	98	Very high	109 Å²	109	54.2 Å²	54.2	48%	0.478	25%	0.246	S	C	.	.			trans	-84.6	65.1	172.6	-56	-53.9	0	0	0	109.8	R91 L94 Q98 D99 A100	R91-F96 HydrophobicContact CB-CB 4.22Å; R91-F96 WeakPolarHBondContact O-CB 3.4Å; R91-F96 PolarHBondContact O-N 3.17Å; L94-F96 VanDerWaalsContact C-N 3.32Å; L94-F96 HydrophobicContact CB-CD2 3.49Å; L94-F96 VanDerWaalsContact CB-CD2 3.49Å; L94-F96 HydrophobicContact CB-CE2 3.53Å; L94-F96 HydrophobicContact CB-CG 4.43Å; L94-F96 HydrophobicContact CB-CZ 4.48Å; L94-F96 HydrophobicContact CD1-CD2 4.18Å; L94-F96 HydrophobicContact CD1-CE2 3.86Å; L94-F96 HydrophobicContact CG-CD2 4.49Å; L94-F96 HydrophobicContact CG-CE2 4.33Å; F96-Q98 PolarHBondContact O-N 3.13Å; F96-D99 HydrophobicContact CB-CB 4.3Å; F96-D99 PolarHBondContact O-N 3.49Å; F96-A100 WeakPolarHBondContact O-CB 3.49Å; F96-A100 PolarHBondContact O-N 3.22Å
97	F	97.4	Very high	98	Very high	31 Å²	31	53.7 Å²	53.7	14%	0.136	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-38.1	-170.7	-59.9	-45.3	0	0	0	113.9	Y92 G95 D99 A100 E101 T124 D127 Q128 K131	Y92-F97 AromaticContact CD2-CD1 3.73Å; Y92-F97 HydrophobicContact CD2-CD1 3.73Å; Y92-F97 AromaticContact CD2-CE1 3.69Å; Y92-F97 HydrophobicContact CD2-CE1 3.69Å; Y92-F97 HydrophobicContact CE2-CD1 4.13Å; Y92-F97 AromaticContact CE2-CE1 3.74Å; Y92-F97 HydrophobicContact CE2-CE1 3.74Å; G95-F97 PolarHBondContact O-N 2.93Å; G95-F97 VanDerWaalsContact O-N 3.13Å; F97-D99 PolarHBondContact O-N 3.49Å; F97-A100 PolarHBondContact O-N 3.38Å; F97-E101 WeakPolarHBondContact O-CB 3.43Å; F97-E101 PolarHBondContact O-N 3.34Å; F97-T124 HydrophobicContact CB-CG2 3.93Å; F97-T124 HydrophobicContact CD1-CG2 4.28Å; F97-T124 VanDerWaalsContact O-CG2 3.29Å; F97-T124 WeakPolarHBondContact O-CG2 3.41Å; F97-D127 HydrophobicContact CE1-CB 4.06Å; F97-D127 HydrophobicContact CE2-CB 4.11Å; F97-D127 HydrophobicContact CZ-CB 3.76Å; F97-Q128 HydrophobicContact CB-CB 3.87Å; F97-Q128 HydrophobicContact CB-CG 4.23Å; F97-Q128 HydrophobicContact CD2-CB 4.08Å; F97-Q128 HydrophobicContact CG-CB 4.24Å; F97-K131 HydrophobicContact CD2-CB 4.42Å; F97-K131 HydrophobicContact CD2-CD 3.84Å; F97-K131 HydrophobicContact CE2-CB 4.08Å; F97-K131 HydrophobicContact CE2-CD 3.73Å
98	Q	97.1	Very high	98	Very high	138 Å²	138	53.6 Å²	53.6	65%	0.645	25%	0.245	S	C	*	.	H	α-helix	trans	-61.9	-45.5	176.7	-68.5	176.3	-12.1	0	0	111.8	F96 A100 E101 M102	F96-Q98 PolarHBondContact O-N 3.13Å; Q98-A100 VanDerWaalsContact C-N 3.34Å; Q98-A100 PolarHBondContact O-N 3.49Å; Q98-E101 WeakPolarHBondContact O-CB 3.33Å; Q98-E101 PolarHBondContact O-N 3.04Å; Q98-M102 WeakPolarHBondContact O-CG 3.24Å; Q98-M102 PolarHBondContact O-N 3.45Å; Q98-M102 VanDerWaalsContact O-N 3.13Å
99	D	98.1	Very high	98	Very high	66 Å²	66	59.7 Å²	59.7	35%	0.353	27%	0.274	S	S	.	.	H	α-helix	trans	-68.6	-35	178.5	-64.3	-56.2	0	0	0	112	R91 F96 F97 D103	R91-D99 HydrophobicContact CB-CB 4.44Å; R91-D99 HydrophobicContact CG-CB 4.23Å; R91-D99 PolarHBondContact NH1-O 3.27Å; F96-D99 HydrophobicContact CB-CB 4.3Å; F96-D99 PolarHBondContact O-N 3.49Å; F97-D99 PolarHBondContact O-N 3.49Å; D99-D103 PolarHBondContact O-N 3.45Å
100	A	98.7	Very high	98	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-43.5	174.9	0	0	0	0	0	111.7	G88 R91 F96 F97 Q98 M102 D103 F104 T124	G88-A100 WeakPolarHBondContact O-CB 3.32Å; R91-A100 HydrophobicContact CB-CB 3.89Å; F96-A100 WeakPolarHBondContact O-CB 3.49Å; F96-A100 PolarHBondContact O-N 3.22Å; F97-A100 PolarHBondContact O-N 3.38Å; Q98-A100 VanDerWaalsContact C-N 3.34Å; Q98-A100 PolarHBondContact O-N 3.49Å; A100-M102 VanDerWaalsContact C-N 3.32Å; A100-M102 PolarHBondContact O-N 3.48Å; A100-D103 PolarHBondContact O-N 2.9Å; A100-F104 HydrophobicContact CB-CD2 4.42Å; A100-F104 HydrophobicContact CB-CE2 3.98Å; A100-F104 WeakPolarHBondContact O-CD2 3.41Å; A100-F104 WeakPolarHBondContact O-CG 3.49Å; A100-F104 PolarHBondContact O-N 3.44Å; A100-T124 HydrophobicContact CB-CG2 4.14Å
101	E	98.6	Very high	98	Very high	36 Å²	36	63.1 Å²	63.1	17%	0.168	29%	0.292	C	S	.	.	H	α-helix	trans	-55.9	-46.9	175	-177.8	-169	158.4	0	0	111	F97 Q98 D103 F104 K105 L121 T124 L125	F97-E101 WeakPolarHBondContact O-CB 3.43Å; F97-E101 PolarHBondContact O-N 3.34Å; Q98-E101 WeakPolarHBondContact O-CB 3.33Å; Q98-E101 PolarHBondContact O-N 3.04Å; E101-D103 VanDerWaalsContact C-N 3.34Å; E101-D103 PolarHBondContact O-N 2.66Å; E101-F104 PolarHBondContact O-N 3.43Å; E101-K105 HydrophobicContact CG-CD 4.17Å; E101-K105 WeakPolarHBondContact O-CB 3.03Å; E101-K105 WeakPolarHBondContact O-CG 3.31Å; E101-K105 PolarHBondContact O-N 2.85Å; E101-K105 VanDerWaalsContact OE1-CE 3.27Å; E101-K105 WeakPolarHBondContact OE1-CE 3.38Å; E101-K105 IonicContact OE1-NZ 3.63Å; E101-K105 PolarHBondContact OE1-NZ 3.24Å; E101-L121 HydrophobicContact CB-CD1 4.31Å; E101-L121 HydrophobicContact CG-CD1 3.62Å; E101-T124 HydrophobicContact CB-CG2 4.3Å; E101-L125 HydrophobicContact CG-CD2 4.14Å
102	M	98.6	Very high	98	Very high	127 Å²	127	64.6 Å²	64.6	63%	0.626	31%	0.308	S	S	*	.	H	α-helix	trans	-59.3	-44.6	177.5	-71.4	-179	67.3	0	0	112	Q98 A100 R106	Q98-M102 WeakPolarHBondContact O-CG 3.24Å; Q98-M102 PolarHBondContact O-N 3.45Å; Q98-M102 VanDerWaalsContact O-N 3.13Å; A100-M102 VanDerWaalsContact C-N 3.32Å; A100-M102 PolarHBondContact O-N 3.48Å; M102-R106 WeakPolarHBondContact O-CB 3.39Å; M102-R106 PolarHBondContact O-N 2.9Å
103	D	98.8	Very high	98	Very high	5 Å²	5	67.9 Å²	67.9	3%	0.027	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-43.6	178.9	-83.3	-15.6	0	0	0	112.3	F84 R87 G88 R91 D99 A100 E101 R106 A107	F84-D103 WeakPolarHBondContact O-CB 3.23Å; R87-D103 IonicContact CZ-OD1 3.05Å; R87-D103 IonicContact CZ-OD2 3.17Å; R87-D103 IonicContact NE-OD1 2.76Å; R87-D103 PolarHBondContact NE-OD1 2.71Å; R87-D103 IonicContact NE-OD2 3.52Å; R87-D103 PolarHBondContact NE-OD2 3Å; R87-D103 IonicContact NH2-OD1 3.49Å; R87-D103 PolarHBondContact NH2-OD1 2.84Å; R87-D103 IonicContact NH2-OD2 2.71Å; G88-D103 PolarHBondContact N-OD2 2.95Å; R91-D103 VanDerWaalsContact CD-OD2 3.24Å; R91-D103 WeakPolarHBondContact CD-OD2 3.33Å; R91-D103 IonicContact CZ-OD2 2.84Å; R91-D103 IonicContact NE-OD2 2.9Å; R91-D103 IonicContact NH1-OD1 2.97Å; R91-D103 PolarHBondContact NH1-OD1 2.79Å; R91-D103 IonicContact NH1-OD2 2.79Å; R91-D103 PolarHBondContact NH1-OD2 3.18Å; D99-D103 PolarHBondContact O-N 3.45Å; A100-D103 PolarHBondContact O-N 2.9Å; E101-D103 VanDerWaalsContact C-N 3.34Å; E101-D103 PolarHBondContact O-N 2.66Å; D103-R106 PolarHBondContact O-N 3.05Å; D103-A107 PolarHBondContact O-N 3.49Å
104	F	98.8	Very high	98	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.3	-40.4	177.8	-63.1	-43	0	0	0	112.2	Y85 L89 A100 E101 R106 A107 L108 L121 T124	Y85-F104 AromaticContact CD2-CD1 3.78Å; Y85-F104 HydrophobicContact CD2-CD1 3.78Å; Y85-F104 AromaticContact CD2-CE1 3.67Å; Y85-F104 HydrophobicContact CD2-CE1 3.67Å; Y85-F104 HydrophobicContact CE2-CD1 4.31Å; Y85-F104 AromaticContact CE2-CE1 3.91Å; Y85-F104 HydrophobicContact CE2-CE1 3.91Å; Y85-F104 WeakPolarHBondContact O-CE1 3.48Å; L89-F104 HydrophobicContact CD2-CE1 4.3Å; L89-F104 HydrophobicContact CD2-CZ 4.09Å; L89-F104 HydrophobicContact CG-CE1 4.28Å; L89-F104 HydrophobicContact CG-CZ 4.4Å; A100-F104 HydrophobicContact CB-CD2 4.42Å; A100-F104 HydrophobicContact CB-CE2 3.98Å; A100-F104 WeakPolarHBondContact O-CD2 3.41Å; A100-F104 WeakPolarHBondContact O-CG 3.49Å; A100-F104 PolarHBondContact O-N 3.44Å; E101-F104 PolarHBondContact O-N 3.43Å; F104-R106 VanDerWaalsContact C-N 3.31Å; F104-R106 PolarHBondContact O-N 2.9Å; F104-A107 PolarHBondContact O-N 3.47Å; F104-L108 WeakPolarHBondContact O-CG 3.41Å; F104-L108 PolarHBondContact O-N 2.98Å; F104-L121 HydrophobicContact CB-CB 3.97Å; F104-L121 HydrophobicContact CB-CD1 4.36Å; F104-T124 VanDerWaalsContact CE2-OG1 3.3Å; F104-T124 WeakPolarHBondContact CE2-OG1 3.24Å
105	K	98.8	Very high	98.1	Very high	95 Å²	95	63.4 Å²	63.4	41%	0.413	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-44.1	172.7	-79	178.8	170.3	173.9	0	111.2	E101 A107 L108 E109 L121	E101-K105 HydrophobicContact CG-CD 4.17Å; E101-K105 WeakPolarHBondContact O-CB 3.03Å; E101-K105 WeakPolarHBondContact O-CG 3.31Å; E101-K105 PolarHBondContact O-N 2.85Å; E101-K105 VanDerWaalsContact OE1-CE 3.27Å; E101-K105 WeakPolarHBondContact OE1-CE 3.38Å; E101-K105 IonicContact OE1-NZ 3.63Å; E101-K105 PolarHBondContact OE1-NZ 3.24Å; K105-A107 VanDerWaalsContact C-N 3.34Å; K105-A107 PolarHBondContact O-N 3.36Å; K105-L108 CarbonylContact O-C 3.59Å; K105-L108 PolarHBondContact O-N 3.22Å; K105-L108 VanDerWaalsContact O-N 3.13Å; K105-E109 WeakPolarHBondContact O-CG 3.42Å; K105-E109 PolarHBondContact O-N 3.45Å; K105-L121 HydrophobicContact CG-CD1 4.2Å; K105-L121 HydrophobicContact CG-CD2 3.98Å
106	R	98.7	Very high	98.3	Very high	89 Å²	89	67 Å²	67	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-63.7	-39.3	178.1	-174.8	54.9	-178.8	171.3	5	112.6	F84 M102 D103 F104 L108 E109 L110	F84-R106 HydrophobicContact CD1-CB 3.93Å; F84-R106 HydrophobicContact CD1-CG 3.59Å; F84-R106 HydrophobicContact CD2-CG 4.01Å; F84-R106 HydrophobicContact CE1-CB 4.25Å; F84-R106 HydrophobicContact CE1-CG 3.48Å; F84-R106 VanDerWaalsContact CE1-CG 3.48Å; F84-R106 HydrophobicContact CE2-CG 3.91Å; F84-R106 HydrophobicContact CG-CB 4.21Å; F84-R106 HydrophobicContact CG-CG 3.86Å; F84-R106 HydrophobicContact CZ-CG 3.64Å; M102-R106 WeakPolarHBondContact O-CB 3.39Å; M102-R106 PolarHBondContact O-N 2.9Å; D103-R106 PolarHBondContact O-N 3.05Å; F104-R106 VanDerWaalsContact C-N 3.31Å; F104-R106 PolarHBondContact O-N 2.9Å; R106-L108 VanDerWaalsContact C-N 3.31Å; R106-L108 PolarHBondContact O-N 3.35Å; R106-E109 VanDerWaalsContact CD-OE2 3.25Å; R106-E109 WeakPolarHBondContact CD-OE2 3.38Å; R106-E109 IonicContact CZ-OE2 3.65Å; R106-E109 IonicContact NE-OE2 3.52Å; R106-E109 IonicContact NH1-OE2 2.66Å; R106-E109 PolarHBondContact NH1-OE2 2.93Å; R106-E109 PolarHBondContact O-N 2.93Å; R106-L110 WeakPolarHBondContact O-CG 3.3Å; R106-L110 PolarHBondContact O-N 2.76Å
107	A	98.7	Very high	98.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-41.2	173.1	0	0	0	0	0	111.7	E81 F84 D103 F104 K105 L110 N111 F114 A117	E81-A107 HydrophobicContact CB-CB 4.4Å; F84-A107 HydrophobicContact CB-CB 4.12Å; D103-A107 PolarHBondContact O-N 3.49Å; F104-A107 PolarHBondContact O-N 3.47Å; K105-A107 VanDerWaalsContact C-N 3.34Å; K105-A107 PolarHBondContact O-N 3.36Å; A107-L110 PolarHBondContact O-N 3.08Å; A107-N111 PolarHBondContact O-N 3.26Å; A107-F114 HydrophobicContact CB-CD1 4.43Å; A107-A117 HydrophobicContact CB-CB 4.28Å
108	L	98.7	Very high	98.4	Very high	29 Å²	29	63.3 Å²	63.3	15%	0.152	31%	0.311	C	S	.	.	H	α-helix	trans	-73.7	-28.9	178.7	-68.3	169.8	0	0	0	114.1	F104 K105 R106 L110 N111 P112 F114 A117 K118 L121	F104-L108 WeakPolarHBondContact O-CG 3.41Å; F104-L108 PolarHBondContact O-N 2.98Å; K105-L108 CarbonylContact O-C 3.59Å; K105-L108 PolarHBondContact O-N 3.22Å; K105-L108 VanDerWaalsContact O-N 3.13Å; R106-L108 VanDerWaalsContact C-N 3.31Å; R106-L108 PolarHBondContact O-N 3.35Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-N111 CarbonylContact O-C 3.25Å; L108-N111 VanDerWaalsContact O-C 3.25Å; L108-P112 VanDerWaalsContact O-CA 3.23Å; L108-P112 WeakPolarHBondContact O-CA 3.38Å; L108-P112 WeakPolarHBondContact O-CD 3.17Å; L108-P112 WeakPolarHBondContact O-CG 3.33Å; L108-P112 VanDerWaalsContact O-N 3.07Å; L108-F114 HydrophobicContact CD2-CB 4.26Å; L108-F114 WeakPolarHBondContact CD2-O 3.46Å; L108-A117 HydrophobicContact CD2-CB 3.89Å; L108-A117 HydrophobicContact CG-CB 3.96Å; L108-K118 HydrophobicContact CD1-CG 4.14Å; L108-K118 HydrophobicContact CD2-CG 3.5Å; L108-K118 HydrophobicContact CG-CG 4.49Å; L108-L121 HydrophobicContact CD1-CD2 3.74Å
109	E	98.6	Very high	98.5	Very high	128 Å²	128	60.5 Å²	60.5	60%	0.598	30%	0.303	S	S	*	.	H	α-helix	trans	-63.4	-37.2	170.5	-75.1	172.4	-174.1	0	0	111.7	K105 R106	K105-E109 WeakPolarHBondContact O-CG 3.42Å; K105-E109 PolarHBondContact O-N 3.45Å; R106-E109 VanDerWaalsContact CD-OE2 3.25Å; R106-E109 WeakPolarHBondContact CD-OE2 3.38Å; R106-E109 IonicContact CZ-OE2 3.65Å; R106-E109 IonicContact NE-OE2 3.52Å; R106-E109 IonicContact NH1-OE2 2.66Å; R106-E109 PolarHBondContact NH1-OE2 2.93Å; R106-E109 PolarHBondContact O-N 2.93Å
110	L	98.3	Very high	98.5	Very high	53 Å²	53	58.3 Å²	58.3	28%	0.277	29%	0.293	S	S	.	.	H	α-helix	trans	-79.2	-40.4	178.5	-66.6	172.1	0	0	0	111.8	E81 F84 R106 A107 L108	E81-L110 HydrophobicContact CB-CB 3.83Å; E81-L110 HydrophobicContact CB-CD1 4.11Å; F84-L110 HydrophobicContact CD2-CD1 3.88Å; F84-L110 HydrophobicContact CE2-CD1 3.82Å; R106-L110 WeakPolarHBondContact O-CG 3.3Å; R106-L110 PolarHBondContact O-N 2.76Å; A107-L110 PolarHBondContact O-N 3.08Å; L108-L110 VanDerWaalsContact C-N 3.28Å
111	N	98.3	Very high	98.5	Very high	49 Å²	49	59.5 Å²	59.5	26%	0.262	30%	0.299	S	S	.	.			trans	-136	92.4	178	-177	-4.4	0	0	0	110.4	E81 A107 L108 D113 F114	E81-N111 HydrophobicContact CB-CB 4.31Å; E81-N111 HydrophobicContact CG-CB 3.85Å; A107-N111 PolarHBondContact O-N 3.26Å; L108-N111 CarbonylContact O-C 3.25Å; L108-N111 VanDerWaalsContact O-C 3.25Å; N111-D113 PolarHBondContact O-N 3.36Å; N111-D113 VanDerWaalsContact O-N 3.09Å; N111-D113 PolarHBondContact OD1-N 3.02Å; N111-D113 VanDerWaalsContact OD1-N 3.1Å; N111-F114 HydrophobicContact CB-CB 4.19Å; N111-F114 WeakPolarHBondContact O-CB 3.34Å; N111-F114 PolarHBondContact O-N 2.97Å; N111-F114 VanDerWaalsContact O-N 3.11Å; N111-F114 PolarHBondContact OD1-N 2.66Å
112	P	98.3	Very high	98.4	Very high	81 Å²	81	63.9 Å²	63.9	53%	0.526	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.9	179.6	-26	35.6	0	0	0	114.5	L108 K118	L108-P112 VanDerWaalsContact O-CA 3.23Å; L108-P112 WeakPolarHBondContact O-CA 3.38Å; L108-P112 WeakPolarHBondContact O-CD 3.17Å; L108-P112 WeakPolarHBondContact O-CG 3.33Å; L108-P112 VanDerWaalsContact O-N 3.07Å; P112-K118 WeakPolarHBondContact O-CE 3.42Å; P112-K118 PolarHBondContact O-NZ 3.27Å
113	D	98	Very high	98.4	Very high	132 Å²	132	61.8 Å²	61.8	71%	0.706	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	7.3	-179.3	-65.5	-37.1	0	0	0	113	N111 E115	N111-D113 PolarHBondContact O-N 3.36Å; N111-D113 VanDerWaalsContact O-N 3.09Å; N111-D113 PolarHBondContact OD1-N 3.02Å; N111-D113 VanDerWaalsContact OD1-N 3.1Å; D113-E115 PolarHBondContact O-N 2.97Å
114	F	98.1	Very high	98.4	Very high	30 Å²	30	61.5 Å²	61.5	13%	0.132	31%	0.307	C	S	.	.			trans	-73	86.5	177.8	-161.1	168.7	0	0	0	111.5	E81 V82 Y85 A107 L108 N111 D116 A117 K118	E81-F114 HydrophobicContact CB-CD1 4.45Å; E81-F114 HydrophobicContact CG-CD1 3.74Å; E81-F114 HydrophobicContact CG-CE1 3.93Å; V82-F114 HydrophobicContact CG2-CE1 4.43Å; Y85-F114 HydrophobicContact CD1-CE1 4.37Å; Y85-F114 AromaticContact CD1-CZ 3.8Å; Y85-F114 HydrophobicContact CD1-CZ 3.8Å; Y85-F114 HydrophobicContact CD2-CZ 4.4Å; Y85-F114 HydrophobicContact CE1-CZ 4.39Å; Y85-F114 AromaticContact CG-CE1 3.99Å; Y85-F114 HydrophobicContact CG-CE1 3.99Å; Y85-F114 AromaticContact CG-CZ 3.8Å; Y85-F114 HydrophobicContact CG-CZ 3.8Å; A107-F114 HydrophobicContact CB-CD1 4.43Å; L108-F114 HydrophobicContact CD2-CB 4.26Å; L108-F114 WeakPolarHBondContact CD2-O 3.46Å; N111-F114 HydrophobicContact CB-CB 4.19Å; N111-F114 WeakPolarHBondContact O-CB 3.34Å; N111-F114 PolarHBondContact O-N 2.97Å; N111-F114 VanDerWaalsContact O-N 3.11Å; N111-F114 PolarHBondContact OD1-N 2.66Å; F114-D116 HydrophobicContact CD2-CB 4.17Å; F114-D116 HydrophobicContact CE2-CB 3.84Å; F114-D116 PolarHBondContact O-N 3.32Å; F114-A117 HydrophobicContact CB-CB 4.13Å; F114-A117 HydrophobicContact CD1-CB 4.1Å; F114-A117 HydrophobicContact CD2-CB 4.35Å; F114-A117 HydrophobicContact CG-CB 3.92Å; F114-A117 WeakPolarHBondContact O-CB 3.46Å; F114-A117 PolarHBondContact O-N 3Å; F114-A117 VanDerWaalsContact O-N 3.08Å; F114-K118 PolarHBondContact O-N 3.05Å
115	E	98.1	Very high	98.4	Very high	114 Å²	114	65.1 Å²	65.1	53%	0.533	33%	0.326	S	S	.	.	H	α-helix	trans	-57.7	-43.3	-172.7	-164.6	58.6	-152	0	0	113.4	D113 A117 K118 V119	D113-E115 PolarHBondContact O-N 2.97Å; E115-A117 PolarHBondContact O-N 3.42Å; E115-K118 WeakPolarHBondContact O-CB 3.45Å; E115-K118 PolarHBondContact O-N 3.07Å; E115-K118 IonicContact OE2-NZ 2.94Å; E115-V119 WeakPolarHBondContact O-CG2 3.38Å; E115-V119 PolarHBondContact O-N 3.05Å
116	D	98.1	Very high	98.3	Very high	94 Å²	94	64.8 Å²	64.8	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-60.6	-35.2	178.7	-65.3	-34.6	0	0	0	112.3	Y85 F114 S120	Y85-D116 HydrophobicContact CE1-CB 4.46Å; Y85-D116 HydrophobicContact CE2-CB 4.02Å; F114-D116 HydrophobicContact CD2-CB 4.17Å; F114-D116 HydrophobicContact CE2-CB 3.84Å; F114-D116 PolarHBondContact O-N 3.32Å; D116-S120 VanDerWaalsContact O-CB 3.29Å; D116-S120 WeakPolarHBondContact O-CB 3.44Å; D116-S120 PolarHBondContact O-N 2.93Å; D116-S120 PolarHBondContact O-OG 3.37Å
117	A	98.3	Very high	98.2	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-71	-36.1	175.9	0	0	0	0	0	111.6	Y85 A107 L108 F114 E115 S120 L121	Y85-A117 HydrophobicContact CD2-CB 3.82Å; Y85-A117 HydrophobicContact CE2-CB 4.37Å; A107-A117 HydrophobicContact CB-CB 4.28Å; L108-A117 HydrophobicContact CD2-CB 3.89Å; L108-A117 HydrophobicContact CG-CB 3.96Å; F114-A117 HydrophobicContact CB-CB 4.13Å; F114-A117 HydrophobicContact CD1-CB 4.1Å; F114-A117 HydrophobicContact CD2-CB 4.35Å; F114-A117 HydrophobicContact CG-CB 3.92Å; F114-A117 WeakPolarHBondContact O-CB 3.46Å; F114-A117 PolarHBondContact O-N 3Å; F114-A117 VanDerWaalsContact O-N 3.08Å; E115-A117 PolarHBondContact O-N 3.42Å; A117-S120 PolarHBondContact O-N 2.94Å; A117-L121 VanDerWaalsContact O-CB 3.25Å; A117-L121 WeakPolarHBondContact O-CB 3.47Å; A117-L121 PolarHBondContact O-N 2.91Å
118	K	98.6	Very high	98	Very high	63 Å²	63	64 Å²	64	27%	0.274	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-49.8	173.6	-64	179.5	-174.4	157	0	111.4	L108 P112 F114 E115 S120 L121 Q122	L108-K118 HydrophobicContact CD1-CG 4.14Å; L108-K118 HydrophobicContact CD2-CG 3.5Å; L108-K118 HydrophobicContact CG-CG 4.49Å; P112-K118 WeakPolarHBondContact O-CE 3.42Å; P112-K118 PolarHBondContact O-NZ 3.27Å; F114-K118 PolarHBondContact O-N 3.05Å; E115-K118 WeakPolarHBondContact O-CB 3.45Å; E115-K118 PolarHBondContact O-N 3.07Å; E115-K118 IonicContact OE2-NZ 2.94Å; K118-S120 VanDerWaalsContact C-N 3.33Å; K118-S120 PolarHBondContact O-N 2.76Å; K118-L121 PolarHBondContact O-N 3.34Å; K118-Q122 WeakPolarHBondContact O-CG 3.36Å; K118-Q122 PolarHBondContact O-N 2.88Å
119	V	98.6	Very high	97.7	Very high	80 Å²	80	67.9 Å²	67.9	49%	0.485	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-45.3	179	174.1	0	0	0	0	110.3	E115 L121 Q122 Q123	E115-V119 WeakPolarHBondContact O-CG2 3.38Å; E115-V119 PolarHBondContact O-N 3.05Å; V119-L121 PolarHBondContact O-N 3.43Å; V119-Q122 PolarHBondContact O-N 2.94Å; V119-Q123 WeakPolarHBondContact O-CB 3.33Å; V119-Q123 PolarHBondContact O-N 3.28Å
120	S	98.5	Very high	97.5	Very high	20 Å²	20	66.3 Å²	66.3	14%	0.14	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-37.5	180	-56.6	0	0	0	0	112.4	Y85 D116 A117 K118 T124	Y85-S120 WeakPolarHBondContact CE2-OG 3.4Å; D116-S120 VanDerWaalsContact O-CB 3.29Å; D116-S120 WeakPolarHBondContact O-CB 3.44Å; D116-S120 PolarHBondContact O-N 2.93Å; D116-S120 PolarHBondContact O-OG 3.37Å; A117-S120 PolarHBondContact O-N 2.94Å; K118-S120 VanDerWaalsContact C-N 3.33Å; K118-S120 PolarHBondContact O-N 2.76Å; S120-T124 VanDerWaalsContact O-CB 3.32Å; S120-T124 WeakPolarHBondContact O-CB 3.49Å; S120-T124 PolarHBondContact O-N 3.09Å; S120-T124 PolarHBondContact O-OG1 3.46Å
121	L	98.6	Very high	97.1	Very high	24 Å²	24	67.8 Å²	67.8	13%	0.126	34%	0.344	C	S	.	.	H	α-helix	trans	-63.6	-48.5	173.9	176.4	59.6	0	0	0	111.4	E101 F104 K105 L108 A117 K118 V119 Q123 T124 L125	E101-L121 HydrophobicContact CB-CD1 4.31Å; E101-L121 HydrophobicContact CG-CD1 3.62Å; F104-L121 HydrophobicContact CB-CB 3.97Å; F104-L121 HydrophobicContact CB-CD1 4.36Å; K105-L121 HydrophobicContact CG-CD1 4.2Å; K105-L121 HydrophobicContact CG-CD2 3.98Å; L108-L121 HydrophobicContact CD1-CD2 3.74Å; A117-L121 VanDerWaalsContact O-CB 3.25Å; A117-L121 WeakPolarHBondContact O-CB 3.47Å; A117-L121 PolarHBondContact O-N 2.91Å; K118-L121 PolarHBondContact O-N 3.34Å; V119-L121 PolarHBondContact O-N 3.43Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-Q123 PolarHBondContact O-N 2.9Å; L121-T124 WeakPolarHBondContact O-CB 3.47Å; L121-T124 PolarHBondContact O-N 2.95Å; L121-L125 HydrophobicContact CD1-CD1 4.36Å; L121-L125 HydrophobicContact CD1-CG 4.32Å; L121-L125 HydrophobicContact CG-CD1 4.38Å; L121-L125 WeakPolarHBondContact O-CG 3.4Å; L121-L125 PolarHBondContact O-N 3.48Å
122	Q	98.3	Very high	96.7	Very high	129 Å²	129	70.4 Å²	70.4	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-57.8	-47.1	177.5	-73.3	177.2	-2	0	0	111.5	K118 V119 T124 L125 L126	K118-Q122 WeakPolarHBondContact O-CG 3.36Å; K118-Q122 PolarHBondContact O-N 2.88Å; V119-Q122 PolarHBondContact O-N 2.94Å; Q122-T124 VanDerWaalsContact C-N 3.33Å; Q122-T124 PolarHBondContact O-N 3.25Å; Q122-L125 PolarHBondContact O-N 3.42Å; Q122-L126 WeakPolarHBondContact O-CG 3.5Å; Q122-L126 PolarHBondContact O-N 3.28Å
123	Q	98.3	Very high	96.3	Very high	82 Å²	82	72 Å²	72	38%	0.383	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-42.2	177.2	-174.4	60.2	53.2	0	0	111.9	Y92 V119 L121 L125 L126 D127	Y92-Q123 HydrophobicContact CE2-CG 4.24Å; Y92-Q123 WeakPolarHBondContact OH-CG 3.46Å; V119-Q123 WeakPolarHBondContact O-CB 3.33Å; V119-Q123 PolarHBondContact O-N 3.28Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-Q123 PolarHBondContact O-N 2.9Å; Q123-L125 VanDerWaalsContact C-N 3.33Å; Q123-L125 PolarHBondContact O-N 3.2Å; Q123-L126 PolarHBondContact O-N 2.94Å; Q123-D127 VanDerWaalsContact NE2-CG 3.26Å; Q123-D127 PolarHBondContact NE2-OD1 3.26Å; Q123-D127 PolarHBondContact NE2-OD2 3.5Å; Q123-D127 PolarHBondContact O-N 3.4Å
124	T	98.2	Very high	95.9	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.7	-43	178.2	-61.8	0	0	0	0	111.9	Y92 F97 A100 E101 F104 S120 L121 Q122 D127 Q128	Y92-T124 HydrophobicContact CD2-CG2 4.3Å; Y92-T124 VanDerWaalsContact CD2-OG1 3.25Å; Y92-T124 WeakPolarHBondContact CD2-OG1 3.38Å; F97-T124 HydrophobicContact CB-CG2 3.93Å; F97-T124 HydrophobicContact CD1-CG2 4.28Å; F97-T124 VanDerWaalsContact O-CG2 3.29Å; F97-T124 WeakPolarHBondContact O-CG2 3.41Å; A100-T124 HydrophobicContact CB-CG2 4.14Å; E101-T124 HydrophobicContact CB-CG2 4.3Å; F104-T124 VanDerWaalsContact CE2-OG1 3.3Å; F104-T124 WeakPolarHBondContact CE2-OG1 3.24Å; S120-T124 VanDerWaalsContact O-CB 3.32Å; S120-T124 WeakPolarHBondContact O-CB 3.49Å; S120-T124 PolarHBondContact O-N 3.09Å; S120-T124 PolarHBondContact O-OG1 3.46Å; L121-T124 WeakPolarHBondContact O-CB 3.47Å; L121-T124 PolarHBondContact O-N 2.95Å; Q122-T124 VanDerWaalsContact C-N 3.33Å; Q122-T124 PolarHBondContact O-N 3.25Å; T124-D127 PolarHBondContact O-N 3.25Å; T124-Q128 VanDerWaalsContact O-CB 3.23Å; T124-Q128 WeakPolarHBondContact O-CB 3.49Å; T124-Q128 PolarHBondContact O-N 3.02Å
125	L	97.7	Very high	94.9	Very high	76 Å²	76	76.9 Å²	76.9	40%	0.398	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-42.3	178.9	-67	173.4	0	0	0	111.9	E101 L121 Q122 Q123 Q128 E129	E101-L125 HydrophobicContact CG-CD2 4.14Å; L121-L125 HydrophobicContact CD1-CD1 4.36Å; L121-L125 HydrophobicContact CD1-CG 4.32Å; L121-L125 HydrophobicContact CG-CD1 4.38Å; L121-L125 WeakPolarHBondContact O-CG 3.4Å; L121-L125 PolarHBondContact O-N 3.48Å; Q122-L125 PolarHBondContact O-N 3.42Å; Q123-L125 VanDerWaalsContact C-N 3.33Å; Q123-L125 PolarHBondContact O-N 3.2Å; L125-Q128 PolarHBondContact O-N 3.48Å; L125-E129 PolarHBondContact O-N 2.92Å
126	L	97.2	Very high	93.1	Very high	88 Å²	88	82.2 Å²	82.2	46%	0.461	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-46.8	176.2	-68.4	173.2	0	0	0	111.5	Q122 Q123 Q128 E129 H130	Q122-L126 WeakPolarHBondContact O-CG 3.5Å; Q122-L126 PolarHBondContact O-N 3.28Å; Q123-L126 PolarHBondContact O-N 2.94Å; L126-Q128 VanDerWaalsContact C-N 3.34Å; L126-Q128 PolarHBondContact O-N 3.24Å; L126-E129 PolarHBondContact O-N 2.89Å; L126-H130 PolarHBondContact O-CD2 3.28Å; L126-H130 PolarHBondContact O-N 2Å
127	D	96.1	Very high	92.9	Very high	38 Å²	38	81.6 Å²	81.6	20%	0.203	40%	0.402	C	S	.	.	H	α-helix	trans	-69.9	-32.9	-179.1	-69.7	-33.5	0	0	0	112.7	Y92 F97 Q123 T124 H130 K131	Y92-D127 HydrophobicContact CE2-CB 4.34Å; Y92-D127 VanDerWaalsContact CE2-OD2 3.3Å; Y92-D127 WeakPolarHBondContact CE2-OD2 2.88Å; Y92-D127 VanDerWaalsContact CZ-OD2 3.29Å; Y92-D127 PolarHBondContact OH-OD2 3.05Å; F97-D127 HydrophobicContact CE1-CB 4.06Å; F97-D127 HydrophobicContact CE2-CB 4.11Å; F97-D127 HydrophobicContact CZ-CB 3.76Å; Q123-D127 VanDerWaalsContact NE2-CG 3.26Å; Q123-D127 PolarHBondContact NE2-OD1 3.26Å; Q123-D127 PolarHBondContact NE2-OD2 3.5Å; Q123-D127 PolarHBondContact O-N 3.4Å; T124-D127 PolarHBondContact O-N 3.25Å; D127-H130 PolarHBondContact O-N 2.94Å; D127-K131 WeakPolarHBondContact O-CB 2.86Å; D127-K131 PolarHBondContact O-N 2.91Å
128	Q	94.5	Very high	92.6	Very high	34 Å²	34	85.9 Å²	85.9	16%	0.159	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-45.9	171.7	-178.9	171.5	-22.4	0	0	111.5	F97 T124 L125 L126 K131 I132	F97-Q128 HydrophobicContact CB-CB 3.87Å; F97-Q128 HydrophobicContact CB-CG 4.23Å; F97-Q128 HydrophobicContact CD2-CB 4.08Å; F97-Q128 HydrophobicContact CG-CB 4.24Å; T124-Q128 VanDerWaalsContact O-CB 3.23Å; T124-Q128 WeakPolarHBondContact O-CB 3.49Å; T124-Q128 PolarHBondContact O-N 3.02Å; L125-Q128 PolarHBondContact O-N 3.48Å; L126-Q128 VanDerWaalsContact C-N 3.34Å; L126-Q128 PolarHBondContact O-N 3.24Å; Q128-K131 PolarHBondContact O-N 3.17Å; Q128-I132 HydrophobicContact CG-CD1 4.03Å; Q128-I132 VanDerWaalsContact O-CG1 3.31Å; Q128-I132 WeakPolarHBondContact O-CG1 3.36Å; Q128-I132 PolarHBondContact O-N 3.34Å
129	E	94.4	Very high	92.3	Very high	110 Å²	110	87.2 Å²	87.2	51%	0.514	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-45.3	175.3	-173.4	-177.9	-179.2	0	0	111.1	L125 L126 K131 I132 N133	L125-E129 PolarHBondContact O-N 2.92Å; L126-E129 PolarHBondContact O-N 2.89Å; E129-K131 VanDerWaalsContact C-N 3.29Å; E129-K131 PolarHBondContact O-N 3.45Å; E129-I132 PolarHBondContact O-N 3.44Å; E129-N133 WeakPolarHBondContact O-CB 3.33Å; E129-N133 PolarHBondContact O-N 3.12Å; E129-N133 PolarHBondContact O-ND2 3.35Å
130	H	92.7	Very high	91.9	Very high	96 Å²	96	87.6 Å²	87.6	44%	0.444	43%	0.429	S	S	.	.	H	α-helix	trans	-60	-37.7	175.3	-72	-46.7	0	0	0	112.9	L126 D127 R134	L126-H130 PolarHBondContact O-CD2 3.28Å; L126-H130 PolarHBondContact O-N 2Å; D127-H130 PolarHBondContact O-N 2.94Å; H130-R134 WeakPolarHBondContact O-CD 3.37Å; H130-R134 WeakPolarHBondContact O-CG 3.42Å; H130-R134 PolarHBondContact O-N 3.28Å; H130-R134 VanDerWaalsContact O-N 3.16Å
131	K	90.4	Very high	91.5	Very high	84 Å²	84	91.8 Å²	91.8	37%	0.365	45%	0.447	S	S	.	.	H	α-helix	trans	-65.3	-46.6	175.9	-178.5	176.5	175.4	-178.5	0	111.5	G95 F97 D127 Q128 E129 N133 R134 G135 Y136	G95-K131 PolarHBondContact O-NZ 3.1Å; G95-K131 VanDerWaalsContact O-NZ 3.14Å; F97-K131 HydrophobicContact CD2-CB 4.42Å; F97-K131 HydrophobicContact CD2-CD 3.84Å; F97-K131 HydrophobicContact CE2-CB 4.08Å; F97-K131 HydrophobicContact CE2-CD 3.73Å; D127-K131 WeakPolarHBondContact O-CB 2.86Å; D127-K131 PolarHBondContact O-N 2.91Å; Q128-K131 PolarHBondContact O-N 3.17Å; E129-K131 VanDerWaalsContact C-N 3.29Å; E129-K131 PolarHBondContact O-N 3.45Å; K131-N133 PolarHBondContact O-N 3.1Å; K131-R134 PolarHBondContact O-N 2.88Å; K131-G135 PolarHBondContact O-N 3.48Å; K131-Y136 PolarHBondContact O-N 3.32Å
132	I	89.4	Confident	91	Very high	103 Å²	103	96.3 Å²	96.3	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-61.7	-45.2	177.3	-67.4	164.8	0	0	0	110.5	Q128 E129 R134 G135	Q128-I132 HydrophobicContact CG-CD1 4.03Å; Q128-I132 VanDerWaalsContact O-CG1 3.31Å; Q128-I132 WeakPolarHBondContact O-CG1 3.36Å; Q128-I132 PolarHBondContact O-N 3.34Å; E129-I132 PolarHBondContact O-N 3.44Å; I132-R134 PolarHBondContact O-N 3.06Å; I132-G135 PolarHBondContact O-N 3.26Å
133	N	90.1	Very high	90.5	Very high	115 Å²	115	94 Å²	94	62%	0.615	46%	0.458	S	S	*	.	H	α-helix	trans	-65.4	-22.3	179.7	-72.1	-17.7	0	0	0	113.2	E129 K131 G135	E129-N133 WeakPolarHBondContact O-CB 3.33Å; E129-N133 PolarHBondContact O-N 3.12Å; E129-N133 PolarHBondContact O-ND2 3.35Å; K131-N133 PolarHBondContact O-N 3.1Å; N133-G135 VanDerWaalsContact C-N 3.31Å
134	R	89.1	Confident	89.9	Confident	193 Å²	193	94.9 Å²	94.9	73%	0.728	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.1	172.8	-71.4	171.6	-175.4	-176	4.7	113.3	H130 K131 I132 Y136	H130-R134 WeakPolarHBondContact O-CD 3.37Å; H130-R134 WeakPolarHBondContact O-CG 3.42Å; H130-R134 PolarHBondContact O-N 3.28Å; H130-R134 VanDerWaalsContact O-N 3.16Å; K131-R134 PolarHBondContact O-N 2.88Å; I132-R134 PolarHBondContact O-N 3.06Å; R134-Y136 HydrophobicContact CB-CD2 3.81Å; R134-Y136 HydrophobicContact CB-CE2 4.06Å
135	G	79	Confident	89.2	Confident	71 Å²	71	102.8 Å²	102.8	73%	0.732	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	24.9	175.1	0	0	0	0	0	115.2	K131 I132 N133	K131-G135 PolarHBondContact O-N 3.48Å; I132-G135 PolarHBondContact O-N 3.26Å; N133-G135 VanDerWaalsContact C-N 3.31Å
136	Y	60.2	Low	88.5	Confident	226 Å²	226	105.3 Å²	105.3	89%	0.886	51%	0.512	S	S	*	.			trans	-104.7	0	176.3	-66.9	-80.1	0	0	0	113	K131 R134	K131-Y136 PolarHBondContact O-N 3.32Å; R134-Y136 HydrophobicContact CB-CD2 3.81Å; R134-Y136 HydrophobicContact CB-CE2 4.06Å

Retrieved 136 of 136 residues in 82.4 ms (Link to these results)

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