A0A3Q0KRR4_SCHMA Loading...

Putative tangerin AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KRR4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 705 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	51.3	Low	65.6	Low	42 Å²	42	92.5 Å²	92.5	21%	0.207	47%	0.473	C	S	.	.				0	128.9	0	-171.2	-171.2	-45.5	0	0	106.7	V3 R5 R6 R9 I180 L188	M1-V3 PolarHBondContact O-N 3.29Å; M1-R5 HydrophobicContact CG-CB 4.42Å; M1-R6 HydrophobicContact SD-CG 4.28Å; M1-R9 PolarHBondContact SD-NH1 3.14Å; M1-R9 VanDerWaalsContact SD-NH1 3.44Å; M1-I180 HydrophobicContact CE-CG2 3.65Å; M1-L188 HydrophobicContact CB-CD1 4.41Å; M1-L188 VanDerWaalsContact N-CD1 3.25Å
2	S	59.1	Low	67.3	Low	67 Å²	67	88.6 Å²	88.6	47%	0.469	45%	0.45	S	S	.	.			trans	-56.4	132.6	-177.8	173	0	0	0	0	110.5	W4 R5	S2-W4 PolarHBondContact O-N 3.43Å; S2-W4 VanDerWaalsContact O-N 3.15Å; S2-W4 WeakPolarHBondContact OG-CB 3.29Å; S2-W4 PolarHBondContact OG-N 3.26Å; S2-R5 WeakPolarHBondContact O-CB 3.46Å; S2-R5 PolarHBondContact O-N 3.17Å
3	V	63.2	Low	69	Low	103 Å²	103	89 Å²	89	62%	0.624	45%	0.447	S	S	*	.	H	α-helix	trans	-51.9	-37.1	179.3	178.1	0	0	0	0	110.5	M1 R5 R6 L7	M1-V3 PolarHBondContact O-N 3.29Å; V3-R5 VanDerWaalsContact C-N 3.28Å; V3-R5 PolarHBondContact O-N 2.65Å; V3-R6 WeakPolarHBondContact O-CA 3.19Å; V3-R6 WeakPolarHBondContact O-CB 3.33Å; V3-R6 PolarHBondContact O-N 2.99Å; V3-L7 PolarHBondContact O-N 3Å
4	W	63.7	Low	70.5	Confident	167 Å²	167	82.9 Å²	82.9	63%	0.633	42%	0.417	S	S	*	.	H	α-helix	trans	-50.6	-41.5	173.2	-169.1	-101.2	0	0	0	113.9	S2 R6 L7 Q8	S2-W4 PolarHBondContact O-N 3.43Å; S2-W4 VanDerWaalsContact O-N 3.15Å; S2-W4 WeakPolarHBondContact OG-CB 3.29Å; S2-W4 PolarHBondContact OG-N 3.26Å; W4-R6 VanDerWaalsContact C-N 3.33Å; W4-R6 PolarHBondContact O-N 2.88Å; W4-L7 PolarHBondContact O-N 3.45Å; W4-Q8 WeakPolarHBondContact O-CB 3.48Å; W4-Q8 VanDerWaalsContact O-CG 3.29Å; W4-Q8 WeakPolarHBondContact O-CG 3.42Å; W4-Q8 PolarHBondContact O-N 3.26Å
5	R	66	Low	72	Confident	112 Å²	112	77.5 Å²	77.5	42%	0.423	39%	0.391	S	S	.	.	H	α-helix	trans	-73.8	-21.9	178.5	-62.3	-172.6	-164.2	143.3	5.8	113.4	M1 S2 V3 R9	M1-R5 HydrophobicContact CG-CB 4.42Å; S2-R5 WeakPolarHBondContact O-CB 3.46Å; S2-R5 PolarHBondContact O-N 3.17Å; V3-R5 VanDerWaalsContact C-N 3.28Å; V3-R5 PolarHBondContact O-N 2.65Å; R5-R9 WeakPolarHBondContact O-CG 3.48Å
6	R	62.4	Low	73.3	Confident	133 Å²	133	75.3 Å²	75.3	50%	0.502	38%	0.378	S	S	.	.	H	α-helix	trans	-77.9	-44.8	169.3	-59.7	-169.8	-168.4	124.9	-7.6	109.7	M1 V3 W4 Q8 R9 V10	M1-R6 HydrophobicContact SD-CG 4.28Å; V3-R6 WeakPolarHBondContact O-CA 3.19Å; V3-R6 WeakPolarHBondContact O-CB 3.33Å; V3-R6 PolarHBondContact O-N 2.99Å; W4-R6 VanDerWaalsContact C-N 3.33Å; W4-R6 PolarHBondContact O-N 2.88Å; R6-Q8 VanDerWaalsContact C-N 3.29Å; R6-Q8 PolarHBondContact O-N 3.15Å; R6-R9 WeakPolarHBondContact O-CB 3.39Å; R6-R9 PolarHBondContact O-N 2.82Å; R6-V10 PolarHBondContact O-N 3.17Å
7	L	67.5	Low	74.5	Confident	110 Å²	110	70.9 Å²	70.9	58%	0.576	36%	0.355	S	S	*	.	H	α-helix	trans	-59	-39.3	177.7	-166.4	65.7	0	0	0	112.1	V3 W4 R9 V10	V3-L7 PolarHBondContact O-N 3Å; W4-L7 PolarHBondContact O-N 3.45Å; L7-R9 PolarHBondContact O-N 2.71Å; L7-V10 HydrophobicContact CD1-CG2 4.44Å; L7-V10 PolarHBondContact O-N 3.42Å
8	Q	70.5	Confident	75.7	Confident	105 Å²	105	71.1 Å²	71.1	49%	0.491	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-9.6	172.6	-78.8	-179.3	-32.2	0	0	115.6	W4 R6 K12	W4-Q8 WeakPolarHBondContact O-CB 3.48Å; W4-Q8 VanDerWaalsContact O-CG 3.29Å; W4-Q8 WeakPolarHBondContact O-CG 3.42Å; W4-Q8 PolarHBondContact O-N 3.26Å; R6-Q8 VanDerWaalsContact C-N 3.29Å; R6-Q8 PolarHBondContact O-N 3.15Å; Q8-K12 WeakPolarHBondContact O-CD 3.5Å; Q8-K12 VanDerWaalsContact O-CE 3.23Å; Q8-K12 WeakPolarHBondContact O-CE 3.45Å; Q8-K12 PolarHBondContact O-NZ 3.18Å; Q8-K12 VanDerWaalsContact O-NZ 3.12Å
9	R	70.2	Confident	76.8	Confident	24 Å²	24	67.3 Å²	67.3	9%	0.091	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-15.8	178.9	-67.3	178.8	-171.7	148.4	-1.5	113.6	M1 R5 R6 L7 G11 K12 Y84 A174	M1-R9 PolarHBondContact SD-NH1 3.14Å; M1-R9 VanDerWaalsContact SD-NH1 3.44Å; R5-R9 WeakPolarHBondContact O-CG 3.48Å; R6-R9 WeakPolarHBondContact O-CB 3.39Å; R6-R9 PolarHBondContact O-N 2.82Å; L7-R9 PolarHBondContact O-N 2.71Å; R9-G11 PolarHBondContact O-N 3.34Å; R9-K12 WeakPolarHBondContact O-CB 3.5Å; R9-K12 PolarHBondContact O-N 3.25Å; R9-K12 VanDerWaalsContact O-N 3.08Å; R9-Y84 HydrophobicContact CG-CE1 4.37Å; R9-Y84 PolarHBondContact NE-OH 2.82Å; R9-A174 HydrophobicContact CB-CB 3.72Å; R9-A174 VanDerWaalsContact CD-O 3.29Å; R9-A174 WeakPolarHBondContact CD-O 3.44Å; R9-A174 HydrophobicContact CG-CB 4.18Å
10	V	70.6	Confident	77.9	Confident	96 Å²	96	64.9 Å²	64.9	58%	0.582	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	131.2	179	-179.5	0	0	0	0	109.1	R6 L7 K12	R6-V10 PolarHBondContact O-N 3.17Å; L7-V10 HydrophobicContact CD1-CG2 4.44Å; L7-V10 PolarHBondContact O-N 3.42Å; V10-K12 VanDerWaalsContact C-N 3.34Å
11	G	76.9	Confident	78.8	Confident	59 Å²	59	61.8 Å²	61.8	61%	0.608	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	13.4	-176.3	0	0	0	0	0	115.6	R9	R9-G11 PolarHBondContact O-N 3.34Å
12	K	85.8	Confident	81	Confident	45 Å²	45	60.5 Å²	60.5	20%	0.196	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.3	174.5	-61.5	-172.2	-177.6	176.9	0	111.6	Q8 R9 V10 R85 N86 E93 A174	Q8-K12 WeakPolarHBondContact O-CD 3.5Å; Q8-K12 VanDerWaalsContact O-CE 3.23Å; Q8-K12 WeakPolarHBondContact O-CE 3.45Å; Q8-K12 PolarHBondContact O-NZ 3.18Å; Q8-K12 VanDerWaalsContact O-NZ 3.12Å; R9-K12 WeakPolarHBondContact O-CB 3.5Å; R9-K12 PolarHBondContact O-N 3.25Å; R9-K12 VanDerWaalsContact O-N 3.08Å; V10-K12 VanDerWaalsContact C-N 3.34Å; K12-R85 CarbonylContact C-O 3.55Å; K12-R85 WeakPolarHBondContact CA-O 3.14Å; K12-R85 WeakPolarHBondContact CB-O 3.27Å; K12-N86 WeakPolarHBondContact CE-OD1 3.4Å; K12-E93 VanDerWaalsContact CE-OE1 3.24Å; K12-E93 WeakPolarHBondContact CE-OE1 3.46Å; K12-E93 IonicContact NZ-OE1 2.69Å; K12-E93 PolarHBondContact NZ-OE1 2.9Å; K12-E93 IonicContact NZ-OE2 3.26Å; K12-A174 HydrophobicContact CB-CB 3.99Å; K12-A174 WeakPolarHBondContact O-CB 3.21Å; K12-A174 PolarHBondContact O-N 2.8Å
13	K	89.5	Confident	82.8	Confident	94 Å²	94	57.3 Å²	57.3	41%	0.409	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	150.7	165	-71.2	-175.8	173.8	174.8	0	109.4	Y84 R85	K13-Y84 CarbonylContact O-C 3.53Å; K13-Y84 WeakPolarHBondContact O-CA 3.33Å; K13-R85 HydrophobicContact CB-CG 4.16Å; K13-R85 PolarHBondContact N-O 3.28Å; K13-R85 PolarHBondContact O-N 3.36Å
14	A	90.7	Very high	84.4	Confident	4 Å²	4	55 Å²	55	3%	0.033	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	152.4	176.3	0	0	0	0	0	110.3	T82 L83 Y84 A171 G172 A174 M179	A14-T82 HydrophobicContact CB-CG2 3.96Å; A14-L83 CarbonylContact C-O 3.58Å; A14-L83 VanDerWaalsContact CA-O 3.32Å; A14-L83 WeakPolarHBondContact CA-O 3.4Å; A14-Y84 HydrophobicContact CB-CD1 3.68Å; A14-Y84 HydrophobicContact CB-CE1 3.71Å; A14-A171 WeakPolarHBondContact O-CA 3.23Å; A14-G172 PolarHBondContact N-O 2.82Å; A14-G172 PolarHBondContact O-N 2.87Å; A14-A174 HydrophobicContact CB-CB 4.09Å; A14-M179 HydrophobicContact CB-CB 3.87Å; A14-M179 HydrophobicContact CB-CE 3.49Å; A14-M179 VanDerWaalsContact CB-CE 3.49Å; A14-M179 HydrophobicContact CB-CG 4.26Å; A14-M179 VanDerWaalsContact O-CE 3.3Å; A14-M179 WeakPolarHBondContact O-CE 3.37Å
15	A	92.4	Very high	85.9	Confident	2 Å²	2	49 Å²	49	2%	0.017	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	128.2	171.3	0	0	0	0	0	110.1	F17 T82 L83 F92 I168 K170	A15-F17 HydrophobicContact CB-CD2 4.21Å; A15-F17 HydrophobicContact CB-CE2 3.46Å; A15-F17 VanDerWaalsContact CB-CE2 3.46Å; A15-F17 HydrophobicContact CB-CZ 3.78Å; A15-T82 CarbonylContact O-C 3.53Å; A15-T82 VanDerWaalsContact O-CA 3.29Å; A15-T82 WeakPolarHBondContact O-CA 3.46Å; A15-L83 PolarHBondContact N-O 2.93Å; A15-L83 PolarHBondContact O-N 3.38Å; A15-F92 HydrophobicContact CB-CE1 3.64Å; A15-F92 HydrophobicContact CB-CZ 3.75Å; A15-I168 HydrophobicContact CB-CD1 3.86Å; A15-I168 HydrophobicContact CB-CG1 4.3Å; A15-K170 CarbonylContact C-O 3.57Å; A15-K170 WeakPolarHBondContact CA-O 3.16Å
16	K	92.9	Very high	87.3	Confident	42 Å²	42	43.8 Å²	43.8	18%	0.183	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	122.5	169	-77.3	-179.8	180	167.9	0	107.9	T82 V169 K170 D178 M179	K16-T82 HydrophobicContact CG-CG2 4.31Å; K16-V169 HydrophobicContact CB-CB 4.28Å; K16-V169 PolarHBondContact O-N 2.83Å; K16-K170 HydrophobicContact CB-CB 4.45Å; K16-K170 HydrophobicContact CD-CB 4.41Å; K16-K170 PolarHBondContact N-O 3.31Å; K16-K170 PolarHBondContact O-N 2.78Å; K16-D178 WeakPolarHBondContact CE-O 3.47Å; K16-D178 PolarHBondContact NZ-O 2.8Å; K16-D178 IonicContact NZ-OD1 3.23Å; K16-M179 HydrophobicContact CD-SD 4.45Å; K16-M179 HydrophobicContact CG-CE 4.15Å; K16-M179 HydrophobicContact CG-SD 4.21Å
17	F	94.8	Very high	88.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	135.7	171.2	-66.9	-81	0	0	0	110.3	A15 I19 V80 T81 L83 F92 V135 S136 S166 V167 I168	A15-F17 HydrophobicContact CB-CD2 4.21Å; A15-F17 HydrophobicContact CB-CE2 3.46Å; A15-F17 VanDerWaalsContact CB-CE2 3.46Å; A15-F17 HydrophobicContact CB-CZ 3.78Å; F17-I19 HydrophobicContact CB-CD1 3.89Å; F17-I19 HydrophobicContact CB-CG1 4.44Å; F17-V80 CarbonylContact O-C 3.59Å; F17-V80 WeakPolarHBondContact O-CA 3.34Å; F17-T81 HydrophobicContact CB-CG2 4.22Å; F17-T81 PolarHBondContact N-O 3.15Å; F17-T81 PolarHBondContact O-N 3.25Å; F17-L83 HydrophobicContact CD2-CB 4.13Å; F17-L83 HydrophobicContact CD2-CD1 3.68Å; F17-L83 HydrophobicContact CD2-CG 4.01Å; F17-L83 HydrophobicContact CE2-CB 4.07Å; F17-L83 HydrophobicContact CE2-CD1 3.84Å; F17-L83 HydrophobicContact CE2-CG 4.32Å; F17-F92 HydrophobicContact CE2-CD1 4.47Å; F17-F92 HydrophobicContact CE2-CD2 4.32Å; F17-F92 HydrophobicContact CE2-CE1 4.05Å; F17-F92 AromaticContact CE2-CE2 3.89Å; F17-F92 HydrophobicContact CE2-CE2 3.89Å; F17-F92 AromaticContact CE2-CZ 3.74Å; F17-F92 HydrophobicContact CE2-CZ 3.74Å; F17-F92 HydrophobicContact CZ-CD2 4.42Å; F17-F92 HydrophobicContact CZ-CE1 4.43Å; F17-F92 AromaticContact CZ-CE2 3.66Å; F17-F92 HydrophobicContact CZ-CE2 3.66Å; F17-F92 AromaticContact CZ-CZ 3.67Å; F17-F92 HydrophobicContact CZ-CZ 3.67Å; F17-V135 HydrophobicContact CB-CG1 4.4Å; F17-V135 HydrophobicContact CD1-CB 4.2Å; F17-V135 HydrophobicContact CD1-CG1 4.09Å; F17-V135 HydrophobicContact CD2-CB 4.38Å; F17-V135 HydrophobicContact CD2-CG1 4.04Å; F17-V135 HydrophobicContact CE1-CB 4.02Å; F17-V135 HydrophobicContact CE1-CG1 4.4Å; F17-V135 HydrophobicContact CE2-CB 4.17Å; F17-V135 HydrophobicContact CE2-CG1 4.33Å; F17-V135 HydrophobicContact CE2-CG2 4.22Å; F17-V135 HydrophobicContact CG-CB 4.37Å; F17-V135 HydrophobicContact CG-CG1 3.9Å; F17-V135 HydrophobicContact CZ-CB 4Å; F17-V135 HydrophobicContact CZ-CG2 4.28Å; F17-S136 WeakPolarHBondContact CE1-O 3.35Å; F17-S166 WeakPolarHBondContact CD1-OG 3.47Å; F17-V167 CarbonylContact C-O 3.55Å; F17-V167 VanDerWaalsContact CA-O 3.31Å; F17-V167 WeakPolarHBondContact CA-O 3.34Å; F17-I168 HydrophobicContact CD1-CB 4.06Å; F17-I168 HydrophobicContact CD1-CG1 4.39Å; F17-I168 HydrophobicContact CE1-CB 3.7Å; F17-I168 HydrophobicContact CE1-CD1 4.23Å; F17-I168 HydrophobicContact CE1-CG1 3.94Å; F17-I168 HydrophobicContact CZ-CD1 4.21Å; F17-I168 HydrophobicContact CZ-CG1 4.29Å
18	Q	95.8	Very high	90.1	Very high	74 Å²	74	34.3 Å²	34.3	35%	0.346	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.4	160.3	179.2	171.6	-5.9	0	0	106.7	E78 V167 V169	Q18-E78 PolarHBondContact NE2-OE2 3.33Å; Q18-V167 PolarHBondContact N-O 3.12Å; Q18-V167 PolarHBondContact O-N 3.03Å; Q18-V169 HydrophobicContact CB-CG2 3.62Å
19	I	96.8	Very high	91.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.9	177.7	-54	-60.3	0	0	0	107.7	F17 E78 F79 T81 I131 V135 L164 N165	F17-I19 HydrophobicContact CB-CD1 3.89Å; F17-I19 HydrophobicContact CB-CG1 4.44Å; I19-E78 WeakPolarHBondContact O-CA 3.39Å; I19-F79 HydrophobicContact CB-CD2 3.91Å; I19-F79 HydrophobicContact CB-CE1 4.47Å; I19-F79 HydrophobicContact CB-CE2 3.58Å; I19-F79 HydrophobicContact CB-CZ 3.89Å; I19-F79 HydrophobicContact CG1-CD2 4.27Å; I19-F79 HydrophobicContact CG1-CE2 3.88Å; I19-F79 HydrophobicContact CG2-CE1 4.17Å; I19-F79 HydrophobicContact CG2-CE2 3.76Å; I19-F79 HydrophobicContact CG2-CZ 3.56Å; I19-F79 PolarHBondContact N-O 2.92Å; I19-F79 PolarHBondContact O-N 3.33Å; I19-T81 HydrophobicContact CD1-CG2 4.44Å; I19-T81 HydrophobicContact CG1-CG2 3.78Å; I19-I131 HydrophobicContact CD1-CG2 3.76Å; I19-I131 HydrophobicContact CG1-CG2 3.94Å; I19-V135 HydrophobicContact CD1-CG1 4.1Å; I19-L164 HydrophobicContact CG2-CD1 4.5Å; I19-L164 HydrophobicContact CG2-CD2 3.68Å; I19-L164 HydrophobicContact CG2-CG 3.95Å; I19-N165 WeakPolarHBondContact CA-O 3.4Å
20	T	97.4	Very high	92.3	Very high	18 Å²	18	31.5 Å²	31.5	11%	0.11	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.9	172.2	-51.7	0	0	0	0	108.1	N76 E78 N165	T20-N76 HydrophobicContact CG2-CB 3.85Å; T20-E78 HydrophobicContact CG2-CG 3.86Å; T20-N165 PolarHBondContact N-O 3.42Å; T20-N165 PolarHBondContact O-N 2.7Å
21	A	97.3	Very high	93.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	103.7	172.9	0	0	0	0	0	109.4	W43 I77 T163	A21-W43 HydrophobicContact CB-CZ2 3.72Å; A21-I77 PolarHBondContact N-O 2.89Å; A21-I77 PolarHBondContact O-N 2.75Å; A21-T163 WeakPolarHBondContact CA-O 3.48Å
22	S	97.4	Very high	93.7	Very high	16 Å²	16	36.6 Å²	36.6	11%	0.112	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	114.3	177.9	-52.9	0	0	0	0	110.1	E75 N76 L162 T163	S22-E75 WeakPolarHBondContact CA-O 3.45Å; S22-N76 WeakPolarHBondContact CB-OD1 3.48Å; S22-N76 PolarHBondContact OG-OD1 2.86Å; S22-L162 CarbonylContact O-C 3.56Å; S22-L162 WeakPolarHBondContact O-CA 3.45Å; S22-L162 VanDerWaalsContact O-CB 3.27Å; S22-L162 WeakPolarHBondContact O-CB 3.49Å; S22-T163 PolarHBondContact N-O 3.33Å; S22-T163 PolarHBondContact O-N 2.86Å
23	L	97.1	Very high	93.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	128	-179.6	-56.4	179.3	0	0	0	111	V41 W71 P74 E75 I77 V160 L162	L23-V41 HydrophobicContact CD1-CB 3.77Å; L23-V41 HydrophobicContact CD1-CG1 4.08Å; L23-V41 HydrophobicContact CD1-CG2 4.05Å; L23-V41 HydrophobicContact CD2-CG1 4.13Å; L23-W71 HydrophobicContact CB-CD2 4Å; L23-W71 HydrophobicContact CB-CE3 4.11Å; L23-W71 HydrophobicContact CB-CH2 3.98Å; L23-W71 HydrophobicContact CB-CZ2 3.86Å; L23-W71 HydrophobicContact CB-CZ3 4.1Å; L23-W71 HydrophobicContact CD1-CH2 4Å; L23-W71 HydrophobicContact CD1-CZ2 3.6Å; L23-W71 HydrophobicContact CG-CZ2 4.39Å; L23-P74 WeakPolarHBondContact O-CA 3.44Å; L23-P74 WeakPolarHBondContact O-CB 3.46Å; L23-E75 HydrophobicContact CB-CB 4.5Å; L23-E75 PolarHBondContact N-O 2.65Å; L23-E75 PolarHBondContact O-N 2.97Å; L23-I77 HydrophobicContact CD1-CD1 3.84Å; L23-I77 HydrophobicContact CG-CD1 4.4Å; L23-V160 HydrophobicContact CD2-CG1 4.16Å; L23-L162 HydrophobicContact CD2-CB 4.02Å; L23-L162 HydrophobicContact CD2-CD2 4.21Å
24	H	96	Very high	93.4	Very high	54 Å²	54	40 Å²	40	25%	0.25	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-50.2	-178.1	-64.4	-72.8	0	0	0	113.2	W71 P74 L161 T163	H24-W71 PolarHBondContact O-N 3.37Å; H24-P74 VanDerWaalsContact ND1-CG 3.3Å; H24-P74 WeakPolarHBondContact ND1-CG 3.1Å; H24-L161 HydrophobicContact CB-CD2 4.35Å; H24-L161 HydrophobicContact CB-CG 4.35Å; H24-L161 PolarHBondContact N-O 3.19Å; H24-T163 PolarHBondContact NE2-OG1 3.32Å
25	E	95.7	Very high	93.2	Very high	42 Å²	42	44.1 Å²	44.1	20%	0.196	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	138.5	-175.1	-179.3	171.6	137.5	0	0	111.1	N27 K68 Y69 V70 V160 L161	E25-N27 PolarHBondContact OE1-ND2 2.82Å; E25-N27 PolarHBondContact OE1-OD1 2.74Å; E25-K68 WeakPolarHBondContact OE1-CE 3.26Å; E25-K68 IonicContact OE1-NZ 2.7Å; E25-K68 PolarHBondContact OE1-NZ 2.85Å; E25-K68 WeakPolarHBondContact OE2-CE 3.46Å; E25-K68 IonicContact OE2-NZ 3.32Å; E25-K68 PolarHBondContact OE2-NZ 2.84Å; E25-Y69 CarbonylContact C-O 3.57Å; E25-Y69 WeakPolarHBondContact CA-O 3.3Å; E25-V70 HydrophobicContact CG-CG2 4.13Å; E25-V160 CarbonylContact O-C 3.5Å; E25-V160 WeakPolarHBondContact O-CA 3.28Å; E25-L161 HydrophobicContact CB-CB 4Å; E25-L161 HydrophobicContact CB-CD2 4.43Å; E25-L161 PolarHBondContact N-O 3.14Å; E25-L161 PolarHBondContact O-N 3.05Å
26	L	95.8	Very high	92.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	126.3	167.4	173.7	71.4	0	0	0	108.5	I28 L39 F55 K68 Y69 W71 I101 V160	L26-I28 HydrophobicContact CD1-CG2 3.85Å; L26-I28 HydrophobicContact CD2-CG2 4.15Å; L26-I28 HydrophobicContact CG-CG2 4.03Å; L26-L39 HydrophobicContact CD2-CD1 3.9Å; L26-F55 HydrophobicContact CD2-CE2 3.72Å; L26-F55 HydrophobicContact CD2-CZ 3.83Å; L26-K68 CarbonylContact O-C 3.57Å; L26-K68 WeakPolarHBondContact O-CA 3.43Å; L26-Y69 PolarHBondContact N-O 3.03Å; L26-Y69 PolarHBondContact O-N 2.73Å; L26-W71 HydrophobicContact CB-CH2 4.22Å; L26-W71 HydrophobicContact CB-CZ3 3.94Å; L26-I101 HydrophobicContact CD1-CD1 3.37Å; L26-I101 HydrophobicContact CD1-CG1 4.23Å; L26-I101 HydrophobicContact CD2-CD1 4.44Å; L26-V160 HydrophobicContact CD1-CG2 3.55Å
27	N	94.4	Very high	92.6	Very high	44 Å²	44	43.2 Å²	43.2	24%	0.235	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.7	163.5	-58	-65.6	0	0	0	109.4	E25 K68 A158 T159	E25-N27 PolarHBondContact OE1-ND2 2.82Å; E25-N27 PolarHBondContact OE1-OD1 2.74Å; N27-K68 WeakPolarHBondContact OD1-CB 3.22Å; N27-K68 WeakPolarHBondContact OD1-CD 3.33Å; N27-K68 VanDerWaalsContact OD1-CG 3.26Å; N27-K68 WeakPolarHBondContact OD1-CG 3.36Å; N27-A158 WeakPolarHBondContact O-CA 3.3Å; N27-T159 PolarHBondContact N-O 3.27Å; N27-T159 PolarHBondContact O-N 2.97Å
28	I	94.4	Very high	92.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148	170.2	60	178	0	0	0	109.8	L26 P36 L39 F67 I101 L155 S157 A158	L26-I28 HydrophobicContact CD1-CG2 3.85Å; L26-I28 HydrophobicContact CD2-CG2 4.15Å; L26-I28 HydrophobicContact CG-CG2 4.03Å; I28-P36 HydrophobicContact CD1-CB 4.19Å; I28-P36 HydrophobicContact CD1-CG 3.96Å; I28-L39 HydrophobicContact CD1-CD1 3.48Å; I28-L39 VanDerWaalsContact CD1-CD1 3.48Å; I28-F67 HydrophobicContact CD1-CB 4.29Å; I28-F67 HydrophobicContact CG1-CB 3.84Å; I28-F67 PolarHBondContact N-O 2.82Å; I28-F67 PolarHBondContact O-N 2.85Å; I28-F67 VanDerWaalsContact O-O 3.11Å; I28-I101 HydrophobicContact CG2-CD1 4.07Å; I28-L155 HydrophobicContact CB-CD2 4.29Å; I28-L155 HydrophobicContact CG2-CD1 4.44Å; I28-S157 WeakPolarHBondContact CA-O 3.3Å; I28-A158 HydrophobicContact CG2-CB 4.1Å
29	E	93.6	Very high	92.3	Very high	70 Å²	70	40.7 Å²	40.7	33%	0.327	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.6	171.3	-169.8	-170	171.1	0	0	107.4	L155 I156 S157	E29-L155 CarbonylContact O-C 3.6Å; E29-L155 WeakPolarHBondContact O-CA 3.35Å; E29-I156 HydrophobicContact CB-CB 4.17Å; E29-I156 HydrophobicContact CG-CB 3.98Å; E29-I156 HydrophobicContact CG-CD1 4.24Å; E29-I156 HydrophobicContact CG-CG2 4.4Å; E29-I156 PolarHBondContact O-N 2.95Å; E29-I156 WeakPolarHBondContact OE2-CG2 3.39Å; E29-S157 WeakPolarHBondContact CB-OG 3.3Å; E29-S157 PolarHBondContact N-O 2.95Å; E29-S157 PolarHBondContact O-N 3.3Å; E29-S157 PolarHBondContact OE2-OG 3.35Å
30	C	92.3	Very high	92.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	158.8	-175.8	-64	0	0	0	0	110.9	Y34 N65 F67 K154 L155 I156	C30-Y34 HydrophobicContact CB-CD1 4.01Å; C30-Y34 VanDerWaalsContact CB-O 3.24Å; C30-Y34 WeakPolarHBondContact CB-O 3.24Å; C30-N65 HydrophobicContact CB-CB 4.34Å; C30-N65 PolarHBondContact N-O 3.41Å; C30-N65 WeakPolarHBondContact O-CB 3.39Å; C30-F67 HydrophobicContact CB-CD2 4.36Å; C30-F67 HydrophobicContact CB-CE2 4.01Å; C30-K154 CarbonylContact C-O 3.43Å; C30-K154 WeakPolarHBondContact CA-O 3.37Å; C30-L155 HydrophobicContact CB-CD2 4.39Å; C30-L155 WeakPolarHBondContact SG-CD2 3.29Å; C30-I156 WeakPolarHBondContact O-CD1 3.45Å
31	S	90.7	Very high	92.2	Very high	32 Å²	32	40.5 Å²	40.5	22%	0.224	20%	0.201	C	C	.	.			trans	-68.2	153.8	166.9	69.9	0	0	0	0	110.8	Q33 Y34 K154	S31-Q33 PolarHBondContact O-N 3.39Å; S31-Y34 PolarHBondContact O-N 2.82Å; S31-K154 PolarHBondContact N-O 3.22Å
32	R	86.2	Confident	92.2	Very high	230 Å²	230	40.5 Å²	40.5	87%	0.868	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-13.4	-176.3	-58.5	-170.7	177.4	-172.3	-0.5	115.6	N65	R32-N65 WeakPolarHBondContact CA-OD1 3.39Å
33	Q	83.2	Confident	92.2	Very high	196 Å²	196	39.8 Å²	39.8	92%	0.916	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	4.5	-176.9	-63	175.3	-8.1	0	0	112.9	S31	S31-Q33 PolarHBondContact O-N 3.39Å
34	Y	87.3	Confident	92.1	Very high	14 Å²	14	40.2 Å²	40.2	6%	0.055	20%	0.2	C	C	.	.			trans	-131	113.8	-174.9	175.9	-119	0	0	0	112.8	C30 S31 P36 D103 L124 K154 L155	C30-Y34 HydrophobicContact CB-CD1 4.01Å; C30-Y34 VanDerWaalsContact CB-O 3.24Å; C30-Y34 WeakPolarHBondContact CB-O 3.24Å; S31-Y34 PolarHBondContact O-N 2.82Å; Y34-P36 HydrophobicContact CE1-CB 4.17Å; Y34-D103 WeakPolarHBondContact OH-CB 3.35Å; Y34-D103 PolarHBondContact OH-OD2 2.84Å; Y34-L124 HydrophobicContact CE1-CD1 4.23Å; Y34-L124 HydrophobicContact CE1-CD2 4.29Å; Y34-L124 WeakPolarHBondContact OH-CD1 3.35Å; Y34-L124 WeakPolarHBondContact OH-CD2 3.24Å; Y34-K154 HydrophobicContact CD1-CB 3.55Å; Y34-K154 HydrophobicContact CD1-CD 4.1Å; Y34-K154 HydrophobicContact CD1-CG 4.24Å; Y34-K154 HydrophobicContact CD2-CD 3.68Å; Y34-K154 HydrophobicContact CD2-CG 4.41Å; Y34-K154 HydrophobicContact CE1-CB 3.94Å; Y34-K154 HydrophobicContact CE1-CD 4.18Å; Y34-K154 HydrophobicContact CE2-CD 3.79Å; Y34-K154 HydrophobicContact CG-CB 3.86Å; Y34-K154 HydrophobicContact CG-CD 3.8Å; Y34-K154 HydrophobicContact CG-CG 4.06Å; Y34-L155 HydrophobicContact CE1-CD2 4.36Å
35	S	85.9	Confident	91.9	Very high	91 Å²	91	40.1 Å²	40.1	64%	0.636	20%	0.197	S	C	*	.			trans	-89	128.3	157.4	46.8	0	0	0	0	109.8
36	P	86.1	Confident	91.4	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.078	22%	0.22	C	C	.	.			trans	-67.9	145.4	169.4	29.9	-32.4	0	0	0	110.3	I28 Y34 L39 P57 F67	I28-P36 HydrophobicContact CD1-CB 4.19Å; I28-P36 HydrophobicContact CD1-CG 3.96Å; Y34-P36 HydrophobicContact CE1-CB 4.17Å; P36-L39 HydrophobicContact CB-CD1 4.25Å; P36-L39 HydrophobicContact CB-CD2 3.96Å; P36-L39 HydrophobicContact CB-CG 4.28Å; P36-P57 HydrophobicContact CB-CG 4.14Å; P36-P57 HydrophobicContact CG-CG 3.6Å; P36-F67 VanDerWaalsContact CD-CZ 3.49Å; P36-F67 HydrophobicContact CG-CD1 4.09Å; P36-F67 HydrophobicContact CG-CD2 4.07Å; P36-F67 HydrophobicContact CG-CE1 4.18Å; P36-F67 HydrophobicContact CG-CE2 4.17Å; P36-F67 HydrophobicContact CG-CG 4.05Å; P36-F67 HydrophobicContact CG-CZ 4.23Å
37	G	86	Confident	90.8	Very high	12 Å²	12	50.2 Å²	50.2	12%	0.124	24%	0.244	C	C	.	.			trans	-87.4	-142.4	169.2	0	0	0	0	0	111.3	L39 P57 D103	G37-L39 PolarHBondContact O-N 2.9Å; G37-P57 WeakPolarHBondContact O-CD 3.34Å; G37-D103 PolarHBondContact N-OD1 3.49Å
38	N	91.6	Very high	90.5	Very high	22 Å²	22	50.5 Å²	50.5	12%	0.118	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	123.2	170.9	-67.5	-82.4	0	0	0	110.1	V104 G105	N38-V104 HydrophobicContact CB-CB 4.41Å; N38-V104 WeakPolarHBondContact O-CB 3.48Å; N38-V104 PolarHBondContact O-N 2.79Å; N38-G105 WeakPolarHBondContact CB-O 3Å; N38-G105 PolarHBondContact N-O 2.6Å; N38-G105 PolarHBondContact ND2-O 2.85Å
39	L	93.9	Very high	90.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.7	177.2	-60.5	-174.8	0	0	0	111.4	L26 I28 P36 G37 S54 F55 P57 I101 E102 D103 L124	L26-L39 HydrophobicContact CD2-CD1 3.9Å; I28-L39 HydrophobicContact CD1-CD1 3.48Å; I28-L39 VanDerWaalsContact CD1-CD1 3.48Å; P36-L39 HydrophobicContact CB-CD1 4.25Å; P36-L39 HydrophobicContact CB-CD2 3.96Å; P36-L39 HydrophobicContact CB-CG 4.28Å; G37-L39 PolarHBondContact O-N 2.9Å; L39-S54 WeakPolarHBondContact O-CA 3.42Å; L39-F55 HydrophobicContact CB-CD2 4.35Å; L39-F55 HydrophobicContact CB-CE2 3.83Å; L39-F55 HydrophobicContact CB-CZ 3.94Å; L39-F55 HydrophobicContact CD1-CE2 4.47Å; L39-F55 PolarHBondContact N-O 2.85Å; L39-F55 WeakPolarHBondContact O-CD1 3.34Å; L39-F55 PolarHBondContact O-N 3.4Å; L39-P57 HydrophobicContact CD1-CB 4.09Å; L39-P57 HydrophobicContact CD1-CG 3.76Å; L39-P57 HydrophobicContact CG-CG 4.16Å; L39-I101 HydrophobicContact CD1-CG2 4.4Å; L39-I101 HydrophobicContact CD2-CG2 4.32Å; L39-E102 WeakPolarHBondContact CA-O 3.22Å; L39-D103 HydrophobicContact CD2-CB 4.12Å; L39-L124 HydrophobicContact CD2-CD1 3.73Å
40	V	95.2	Very high	90.6	Very high	13 Å²	13	56.3 Å²	56.3	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.1	172.8	171.2	0	0	0	0	108.9	V42 P51 I101 E102 V104	V40-V42 HydrophobicContact CG1-CG2 3.68Å; V40-P51 HydrophobicContact CG1-CB 3.61Å; V40-I101 WeakPolarHBondContact O-CA 3.4Å; V40-E102 PolarHBondContact N-O 2.71Å; V40-E102 PolarHBondContact O-N 3.08Å; V40-V104 HydrophobicContact CB-CG2 4.14Å; V40-V104 HydrophobicContact CG2-CG2 3.61Å
41	V	96.3	Very high	90.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.8	168	180	0	0	0	0	108.3	L23 P51 S52 F55 W71 Q100	L23-V41 HydrophobicContact CD1-CB 3.77Å; L23-V41 HydrophobicContact CD1-CG1 4.08Å; L23-V41 HydrophobicContact CD1-CG2 4.05Å; L23-V41 HydrophobicContact CD2-CG1 4.13Å; V41-P51 CarbonylContact O-C 3.58Å; V41-S52 PolarHBondContact N-OG 3.41Å; V41-S52 PolarHBondContact O-N 2.84Å; V41-F55 HydrophobicContact CG2-CE1 4.26Å; V41-F55 HydrophobicContact CG2-CZ 4.2Å; V41-W71 HydrophobicContact CG2-CH2 4.2Å; V41-Q100 CarbonylContact C-O 3.55Å
42	V	96.6	Very high	91	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123	-177.2	-172.9	0	0	0	0	110.7	V40 R49 P51 C99 Q100 E102	V40-V42 HydrophobicContact CG1-CG2 3.68Å; V42-R49 HydrophobicContact CG1-CB 4.35Å; V42-P51 HydrophobicContact CG2-CB 4.13Å; V42-C99 WeakPolarHBondContact O-CA 3.4Å; V42-Q100 HydrophobicContact CB-CG 3.99Å; V42-Q100 PolarHBondContact N-O 3.04Å; V42-Q100 PolarHBondContact O-N 3.24Å; V42-E102 HydrophobicContact CG2-CG 4.26Å
43	W	97.1	Very high	91.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.7	164.3	-75.7	85.6	0	0	0	110	A21 R49 Y50 I77 F79 W97 I98 C99 I129 I131 L162 L164	A21-W43 HydrophobicContact CB-CZ2 3.72Å; W43-R49 CarbonylContact O-C 3.55Å; W43-R49 WeakPolarHBondContact O-CA 3.24Å; W43-Y50 PolarHBondContact N-O 2.94Å; W43-Y50 PolarHBondContact O-N 3.1Å; W43-I77 HydrophobicContact CB-CG2 4.42Å; W43-I77 HydrophobicContact CG-CG2 4.46Å; W43-F79 HydrophobicContact CB-CD1 4.36Å; W43-F79 HydrophobicContact CB-CE1 4.02Å; W43-F79 AromaticContact CD2-CE1 3.83Å; W43-F79 HydrophobicContact CD2-CE1 3.83Å; W43-F79 HydrophobicContact CD2-CZ 4.17Å; W43-F79 AromaticContact CE3-CE1 3.87Å; W43-F79 HydrophobicContact CE3-CE1 3.87Å; W43-F79 AromaticContact CE3-CZ 3.73Å; W43-F79 HydrophobicContact CE3-CZ 3.73Å; W43-F79 AromaticContact CG-CE1 3.91Å; W43-F79 HydrophobicContact CG-CE1 3.91Å; W43-F79 HydrophobicContact CZ3-CZ 4.11Å; W43-W97 HydrophobicContact CE3-CB 4.2Å; W43-W97 HydrophobicContact CZ3-CB 4.29Å; W43-I98 CarbonylContact C-O 3.52Å; W43-I98 WeakPolarHBondContact CA-O 3.12Å; W43-C99 HydrophobicContact CD2-CB 4.23Å; W43-C99 HydrophobicContact CE3-CB 4.33Å; W43-C99 HydrophobicContact CH2-CB 4.37Å; W43-C99 HydrophobicContact CZ2-CB 4.24Å; W43-C99 HydrophobicContact CZ3-CB 4.4Å; W43-I129 HydrophobicContact CH2-CB 4.48Å; W43-I129 HydrophobicContact CH2-CD1 3.51Å; W43-I129 HydrophobicContact CH2-CG2 4.41Å; W43-I129 HydrophobicContact CZ2-CD1 4.21Å; W43-I129 HydrophobicContact CZ3-CB 4.36Å; W43-I129 HydrophobicContact CZ3-CD1 4.03Å; W43-I131 HydrophobicContact CZ3-CD1 4.08Å; W43-L162 HydrophobicContact CZ2-CD1 4.31Å; W43-L162 HydrophobicContact CZ2-CD2 3.81Å; W43-L164 HydrophobicContact CH2-CD1 4.18Å
44	S	95.1	Very high	91.7	Very high	10 Å²	10	49.1 Å²	49.1	7%	0.07	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	148.6	-177	69	0	0	0	0	114.2	R48 I98	S44-R48 CarbonylContact C-O 3.56Å; S44-R48 VanDerWaalsContact CA-O 3.29Å; S44-R48 WeakPolarHBondContact CA-O 3.46Å; S44-I98 PolarHBondContact N-O 3.36Å; S44-I98 PolarHBondContact O-N 3.09Å
45	R	92	Very high	91.9	Very high	52 Å²	52	48.9 Å²	48.9	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	115.7	172.7	-172.8	172.3	-172.2	-90.5	-4.4	111.2	R48 K95 E96 W97	R45-R48 PolarHBondContact N-O 3.13Å; R45-R48 PolarHBondContact O-N 3.32Å; R45-K95 VanDerWaalsContact NE-CG 3.29Å; R45-E96 WeakPolarHBondContact CD-O 3.48Å; R45-E96 PolarHBondContact NE-O 3.09Å; R45-W97 HydrophobicContact CB-CD2 3.55Å; R45-W97 HydrophobicContact CB-CE3 3.51Å; R45-W97 HydrophobicContact CB-CG 4.08Å; R45-W97 HydrophobicContact CB-CH2 4.3Å; R45-W97 HydrophobicContact CB-CZ2 4.33Å; R45-W97 HydrophobicContact CB-CZ3 3.9Å; R45-W97 HydrophobicContact CG-CD2 4.31Å
46	R	86.5	Confident	92	Very high	182 Å²	182	51 Å²	51	69%	0.687	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	-130.9	-171	-55.3	-179.8	179.9	176.1	-1.6	109.8	R48	R46-R48 PolarHBondContact O-N 3.13Å
47	S	82.1	Confident	92.1	Very high	72 Å²	72	51 Å²	51	50%	0.503	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-5.2	178.4	51.2	0	0	0	0	115.1
48	R	89.3	Confident	92.1	Very high	50 Å²	50	55.1 Å²	55.1	19%	0.189	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	131.5	-178.2	-57.2	-177.1	-60.2	165.6	10.2	110.3	S44 R45 R46 Y50 V80 W97	S44-R48 CarbonylContact C-O 3.56Å; S44-R48 VanDerWaalsContact CA-O 3.29Å; S44-R48 WeakPolarHBondContact CA-O 3.46Å; R45-R48 PolarHBondContact N-O 3.13Å; R45-R48 PolarHBondContact O-N 3.32Å; R46-R48 PolarHBondContact O-N 3.13Å; R48-Y50 HydrophobicContact CB-CE2 3.98Å; R48-V80 PolarHBondContact NH1-O 2.78Å; R48-W97 VanDerWaalsContact NH2-CH2 3.29Å
49	R	93.6	Very high	91.9	Very high	123 Å²	123	59.3 Å²	59.3	46%	0.464	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	132	179.8	-69.4	174.5	58	85.2	-4.3	108.7	V42 W43 E102	V42-R49 HydrophobicContact CG1-CB 4.35Å; W43-R49 CarbonylContact O-C 3.55Å; W43-R49 WeakPolarHBondContact O-CA 3.24Å; R49-E102 IonicContact CZ-OE1 3.48Å; R49-E102 IonicContact NH1-OE1 3.36Å; R49-E102 PolarHBondContact NH1-OE1 3.18Å; R49-E102 VanDerWaalsContact NH2-CD 3.29Å; R49-E102 IonicContact NH2-OE1 2.71Å; R49-E102 PolarHBondContact NH2-OE1 3.15Å; R49-E102 IonicContact NH2-OE2 3.08Å; R49-E102 PolarHBondContact NH2-OE2 2.7Å; R49-E102 VanDerWaalsContact NH2-OE2 3.08Å
50	Y	95.7	Very high	91.4	Very high	70 Å²	70	61.5 Å²	61.5	28%	0.275	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	95.2	179.9	-57	-90.4	0	0	0	107.6	W43 R48 F79 W97	W43-Y50 PolarHBondContact N-O 2.94Å; W43-Y50 PolarHBondContact O-N 3.1Å; R48-Y50 HydrophobicContact CB-CE2 3.98Å; Y50-F79 HydrophobicContact CD1-CB 4.35Å; Y50-F79 HydrophobicContact CD2-CB 3.83Å; Y50-F79 HydrophobicContact CD2-CD1 4.49Å; Y50-F79 HydrophobicContact CD2-CG 4.4Å; Y50-F79 HydrophobicContact CE1-CB 4.09Å; Y50-F79 HydrophobicContact CE2-CB 3.52Å; Y50-F79 HydrophobicContact CE2-CG 4.38Å; Y50-F79 HydrophobicContact CG-CB 4.23Å; Y50-W97 HydrophobicContact CD2-CH2 4.39Å; Y50-W97 AromaticContact CD2-CZ3 3.96Å; Y50-W97 HydrophobicContact CD2-CZ3 3.96Å; Y50-W97 AromaticContact CE2-CH2 3.83Å; Y50-W97 HydrophobicContact CE2-CH2 3.83Å; Y50-W97 AromaticContact CE2-CZ3 3.83Å; Y50-W97 HydrophobicContact CE2-CZ3 3.83Å
51	P	95	Very high	90.4	Very high	81 Å²	81	67.2 Å²	67.2	53%	0.526	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	149	177.1	33.2	-33.1	0	0	0	111.8	V40 V41 V42	V40-P51 HydrophobicContact CG1-CB 3.61Å; V41-P51 CarbonylContact O-C 3.58Å; V42-P51 HydrophobicContact CG2-CB 4.13Å
52	S	95.8	Very high	89.2	Confident	10 Å²	10	70.3 Å²	70.3	7%	0.07	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-66.3	169.8	159.9	72	0	0	0	0	111.2	V41	V41-S52 PolarHBondContact N-OG 3.41Å; V41-S52 PolarHBondContact O-N 2.84Å
53	K	92.8	Very high	88	Confident	159 Å²	159	75.5 Å²	75.5	69%	0.691	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-56.2	150.3	156.2	-67.7	165	-173.3	173.9	0	109.5	F55 E75	K53-F55 WeakPolarHBondContact O-CD1 3.47Å; K53-E75 WeakPolarHBondContact CB-OE1 3.45Å; K53-E75 VanDerWaalsContact CG-OE1 3.29Å; K53-E75 WeakPolarHBondContact CG-OE1 3.44Å; K53-E75 PolarHBondContact N-OE1 2.91Å
54	S	92	Very high	86.9	Confident	58 Å²	58	79.4 Å²	79.4	41%	0.406	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-77.7	130.7	173.4	58.9	0	0	0	0	110.4	L39	L39-S54 WeakPolarHBondContact O-CA 3.42Å
55	F	91	Very high	86.6	Confident	9 Å²	9	80.8 Å²	80.8	4%	0.039	43%	0.434	C	S	.	.	B	Isolated β-bridge	trans	-129.1	152.5	177.7	56.6	-88.7	0	0	0	111	L26 L39 V41 K53 Y69 W71	L26-F55 HydrophobicContact CD2-CE2 3.72Å; L26-F55 HydrophobicContact CD2-CZ 3.83Å; L39-F55 HydrophobicContact CB-CD2 4.35Å; L39-F55 HydrophobicContact CB-CE2 3.83Å; L39-F55 HydrophobicContact CB-CZ 3.94Å; L39-F55 HydrophobicContact CD1-CE2 4.47Å; L39-F55 PolarHBondContact N-O 2.85Å; L39-F55 WeakPolarHBondContact O-CD1 3.34Å; L39-F55 PolarHBondContact O-N 3.4Å; V41-F55 HydrophobicContact CG2-CE1 4.26Å; V41-F55 HydrophobicContact CG2-CZ 4.2Å; K53-F55 WeakPolarHBondContact O-CD1 3.47Å; F55-Y69 HydrophobicContact CB-CD1 4.44Å; F55-Y69 HydrophobicContact CB-CD2 4.29Å; F55-Y69 HydrophobicContact CB-CE1 3.91Å; F55-Y69 HydrophobicContact CB-CE2 3.74Å; F55-Y69 HydrophobicContact CD1-CE1 4.37Å; F55-Y69 AromaticContact CD2-CD1 3.54Å; F55-Y69 HydrophobicContact CD2-CD1 3.54Å; F55-Y69 AromaticContact CD2-CD2 3.74Å; F55-Y69 HydrophobicContact CD2-CD2 3.74Å; F55-Y69 AromaticContact CD2-CE1 3.87Å; F55-Y69 HydrophobicContact CD2-CE1 3.87Å; F55-Y69 HydrophobicContact CD2-CE2 4.05Å; F55-Y69 AromaticContact CD2-CG 3.46Å; F55-Y69 HydrophobicContact CD2-CG 3.46Å; F55-Y69 VanDerWaalsContact CD2-CG 3.46Å; F55-Y69 AromaticContact CE2-CD1 3.87Å; F55-Y69 HydrophobicContact CE2-CD1 3.87Å; F55-Y69 AromaticContact CE2-CG 3.88Å; F55-Y69 HydrophobicContact CE2-CG 3.88Å; F55-Y69 AromaticContact CG-CD1 3.94Å; F55-Y69 HydrophobicContact CG-CD1 3.94Å; F55-Y69 HydrophobicContact CG-CD2 4.34Å; F55-Y69 AromaticContact CG-CE1 3.79Å; F55-Y69 HydrophobicContact CG-CE1 3.79Å; F55-Y69 HydrophobicContact CG-CE2 4.2Å; F55-Y69 HydrophobicContact CG-CG 4.22Å; F55-Y69 AromaticContact CG-CZ 3.93Å; F55-W71 AromaticContact CD1-CZ2 3.85Å; F55-W71 HydrophobicContact CD1-CZ2 3.85Å; F55-W71 AromaticContact CE1-CH2 3.77Å; F55-W71 HydrophobicContact CE1-CH2 3.77Å; F55-W71 AromaticContact CE1-CZ2 3.42Å; F55-W71 HydrophobicContact CE1-CZ2 3.42Å; F55-W71 VanDerWaalsContact CE1-CZ2 3.42Å; F55-W71 HydrophobicContact CE2-CH2 4.31Å; F55-W71 AromaticContact CZ-CH2 3.65Å; F55-W71 HydrophobicContact CZ-CH2 3.65Å; F55-W71 AromaticContact CZ-CZ2 3.81Å; F55-W71 HydrophobicContact CZ-CZ2 3.81Å
56	E	89	Confident	86.5	Confident	136 Å²	136	79.5 Å²	79.5	64%	0.636	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-98.7	122.4	175.6	-171.2	164.1	-169.1	0	0	108.7	Y69	E56-Y69 WeakPolarHBondContact O-CD2 3.32Å
57	P	87.2	Confident	86.8	Confident	11 Å²	11	71.8 Å²	71.8	7%	0.071	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-80.8	135.8	-172.7	35.2	-38.1	0	0	0	111.1	P36 G37 L39 F67	P36-P57 HydrophobicContact CB-CG 4.14Å; P36-P57 HydrophobicContact CG-CG 3.6Å; G37-P57 WeakPolarHBondContact O-CD 3.34Å; L39-P57 HydrophobicContact CD1-CB 4.09Å; L39-P57 HydrophobicContact CD1-CG 3.76Å; L39-P57 HydrophobicContact CG-CG 4.16Å; P57-F67 HydrophobicContact CB-CB 4.02Å; P57-F67 HydrophobicContact CG-CB 4.39Å; P57-F67 HydrophobicContact CG-CD1 4.37Å
58	V	86.9	Confident	87.2	Confident	98 Å²	98	72.2 Å²	72.2	59%	0.594	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.6	-177.1	-176.1	0	0	0	0	110	F67 K68	V58-F67 CarbonylContact O-C 3.56Å; V58-F67 VanDerWaalsContact O-CA 3.24Å; V58-F67 WeakPolarHBondContact O-CA 3.48Å; V58-K68 WeakPolarHBondContact CB-O 3.5Å; V58-K68 PolarHBondContact N-O 3.36Å; V58-K68 PolarHBondContact O-N 2.83Å; V58-K68 VanDerWaalsContact O-O 3.09Å
59	K	86.9	Confident	87.4	Confident	110 Å²	110	72.8 Å²	72.8	48%	0.478	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.7	177.2	-175.7	169.3	168.7	163.9	0	110.5	S64 F67	K59-S64 WeakPolarHBondContact CE-O 3.17Å; K59-S64 PolarHBondContact NZ-O 3.45Å; K59-S64 PolarHBondContact NZ-OG 2.91Å; K59-F67 HydrophobicContact CB-CD1 3.93Å; K59-F67 HydrophobicContact CB-CE1 3.87Å; K59-F67 HydrophobicContact CD-CE1 4.39Å; K59-F67 HydrophobicContact CD-CZ 4.49Å; K59-F67 HydrophobicContact CG-CD1 4.48Å; K59-F67 HydrophobicContact CG-CE1 4.21Å
60	S	84.1	Confident	87.4	Confident	47 Å²	47	70.8 Å²	70.8	33%	0.329	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-74.8	140.3	179.7	-174.6	0	0	0	0	111.5	G62 S66	S60-G62 PolarHBondContact O-N 2.57Å; S60-S66 WeakPolarHBondContact CB-O 3.44Å; S60-S66 PolarHBondContact N-O 2.81Å
61	S	73.9	Confident	87.3	Confident	132 Å²	132	68.4 Å²	68.4	92%	0.923	39%	0.392	S	S	*	.	S	Bend	trans	-68.4	-30.2	-174.4	50.5	0	0	0	0	114.2
62	G	71.6	Confident	87.1	Confident	65 Å²	65	70.9 Å²	70.9	67%	0.67	41%	0.411	S	S	*	.	S	Bend	trans	-83.9	-22	-176.1	0	0	0	0	0	115.6	S60	S60-G62 PolarHBondContact O-N 2.57Å
63	N	71.6	Confident	86.9	Confident	111 Å²	111	77.4 Å²	77.4	59%	0.594	44%	0.442	S	S	*	.	S	Bend	trans	-138.7	116.6	-171.5	-86.9	-38	0	0	0	111.4	N65 S66	N63-N65 PolarHBondContact O-N 3.36Å; N63-S66 PolarHBondContact O-N 2.94Å
64	S	73.6	Confident	86.9	Confident	82 Å²	82	72 Å²	72	57%	0.573	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-4.3	-169.1	-159.4	0	0	0	0	116.2	K59	K59-S64 WeakPolarHBondContact CE-O 3.17Å; K59-S64 PolarHBondContact NZ-O 3.45Å; K59-S64 PolarHBondContact NZ-OG 2.91Å
65	N	87.4	Confident	87	Confident	38 Å²	38	70.6 Å²	70.6	20%	0.203	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	13.8	172.4	-51.2	-77.4	0	0	0	113.8	C30 R32 N63 F67	C30-N65 HydrophobicContact CB-CB 4.34Å; C30-N65 PolarHBondContact N-O 3.41Å; C30-N65 WeakPolarHBondContact O-CB 3.39Å; R32-N65 WeakPolarHBondContact CA-OD1 3.39Å; N63-N65 PolarHBondContact O-N 3.36Å; N65-F67 WeakPolarHBondContact O-CD2 3.39Å
66	S	90.7	Very high	87.3	Confident	26 Å²	26	74.4 Å²	74.4	18%	0.182	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.6	170.1	-176.6	0	0	0	0	109	S60 N63	S60-S66 WeakPolarHBondContact CB-O 3.44Å; S60-S66 PolarHBondContact N-O 2.81Å; N63-S66 PolarHBondContact O-N 2.94Å
67	F	92.1	Very high	87.7	Confident	20 Å²	20	68.3 Å²	68.3	9%	0.088	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.6	175.1	-57.2	-104.6	0	0	0	109.3	I28 C30 P36 P57 V58 K59 N65	I28-F67 HydrophobicContact CD1-CB 4.29Å; I28-F67 HydrophobicContact CG1-CB 3.84Å; I28-F67 PolarHBondContact N-O 2.82Å; I28-F67 PolarHBondContact O-N 2.85Å; I28-F67 VanDerWaalsContact O-O 3.11Å; C30-F67 HydrophobicContact CB-CD2 4.36Å; C30-F67 HydrophobicContact CB-CE2 4.01Å; P36-F67 VanDerWaalsContact CD-CZ 3.49Å; P36-F67 HydrophobicContact CG-CD1 4.09Å; P36-F67 HydrophobicContact CG-CD2 4.07Å; P36-F67 HydrophobicContact CG-CE1 4.18Å; P36-F67 HydrophobicContact CG-CE2 4.17Å; P36-F67 HydrophobicContact CG-CG 4.05Å; P36-F67 HydrophobicContact CG-CZ 4.23Å; P57-F67 HydrophobicContact CB-CB 4.02Å; P57-F67 HydrophobicContact CG-CB 4.39Å; P57-F67 HydrophobicContact CG-CD1 4.37Å; V58-F67 CarbonylContact O-C 3.56Å; V58-F67 VanDerWaalsContact O-CA 3.24Å; V58-F67 WeakPolarHBondContact O-CA 3.48Å; K59-F67 HydrophobicContact CB-CD1 3.93Å; K59-F67 HydrophobicContact CB-CE1 3.87Å; K59-F67 HydrophobicContact CD-CE1 4.39Å; K59-F67 HydrophobicContact CD-CZ 4.49Å; K59-F67 HydrophobicContact CG-CD1 4.48Å; K59-F67 HydrophobicContact CG-CE1 4.21Å; N65-F67 WeakPolarHBondContact O-CD2 3.39Å
68	K	91.7	Very high	88.1	Confident	81 Å²	81	72.3 Å²	72.3	35%	0.352	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.6	179.5	174.6	165	174.3	145.5	0	108.9	E25 L26 N27 V58 V70	E25-K68 WeakPolarHBondContact OE1-CE 3.26Å; E25-K68 IonicContact OE1-NZ 2.7Å; E25-K68 PolarHBondContact OE1-NZ 2.85Å; E25-K68 WeakPolarHBondContact OE2-CE 3.46Å; E25-K68 IonicContact OE2-NZ 3.32Å; E25-K68 PolarHBondContact OE2-NZ 2.84Å; L26-K68 CarbonylContact O-C 3.57Å; L26-K68 WeakPolarHBondContact O-CA 3.43Å; N27-K68 WeakPolarHBondContact OD1-CB 3.22Å; N27-K68 WeakPolarHBondContact OD1-CD 3.33Å; N27-K68 VanDerWaalsContact OD1-CG 3.26Å; N27-K68 WeakPolarHBondContact OD1-CG 3.36Å; V58-K68 WeakPolarHBondContact CB-O 3.5Å; V58-K68 PolarHBondContact N-O 3.36Å; V58-K68 PolarHBondContact O-N 2.83Å; V58-K68 VanDerWaalsContact O-O 3.09Å; K68-V70 HydrophobicContact CD-CG2 4.31Å; K68-V70 HydrophobicContact CG-CG2 4.12Å
69	Y	93.5	Very high	88.5	Confident	62 Å²	62	67.9 Å²	67.9	24%	0.243	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.2	170.8	-173	-94.6	0	0	0	108.5	E25 L26 F55 E56 W71	E25-Y69 CarbonylContact C-O 3.57Å; E25-Y69 WeakPolarHBondContact CA-O 3.3Å; L26-Y69 PolarHBondContact N-O 3.03Å; L26-Y69 PolarHBondContact O-N 2.73Å; F55-Y69 HydrophobicContact CB-CD1 4.44Å; F55-Y69 HydrophobicContact CB-CD2 4.29Å; F55-Y69 HydrophobicContact CB-CE1 3.91Å; F55-Y69 HydrophobicContact CB-CE2 3.74Å; F55-Y69 HydrophobicContact CD1-CE1 4.37Å; F55-Y69 AromaticContact CD2-CD1 3.54Å; F55-Y69 HydrophobicContact CD2-CD1 3.54Å; F55-Y69 AromaticContact CD2-CD2 3.74Å; F55-Y69 HydrophobicContact CD2-CD2 3.74Å; F55-Y69 AromaticContact CD2-CE1 3.87Å; F55-Y69 HydrophobicContact CD2-CE1 3.87Å; F55-Y69 HydrophobicContact CD2-CE2 4.05Å; F55-Y69 AromaticContact CD2-CG 3.46Å; F55-Y69 HydrophobicContact CD2-CG 3.46Å; F55-Y69 VanDerWaalsContact CD2-CG 3.46Å; F55-Y69 AromaticContact CE2-CD1 3.87Å; F55-Y69 HydrophobicContact CE2-CD1 3.87Å; F55-Y69 AromaticContact CE2-CG 3.88Å; F55-Y69 HydrophobicContact CE2-CG 3.88Å; F55-Y69 AromaticContact CG-CD1 3.94Å; F55-Y69 HydrophobicContact CG-CD1 3.94Å; F55-Y69 HydrophobicContact CG-CD2 4.34Å; F55-Y69 AromaticContact CG-CE1 3.79Å; F55-Y69 HydrophobicContact CG-CE1 3.79Å; F55-Y69 HydrophobicContact CG-CE2 4.2Å; F55-Y69 HydrophobicContact CG-CG 4.22Å; F55-Y69 AromaticContact CG-CZ 3.93Å; E56-Y69 WeakPolarHBondContact O-CD2 3.32Å; Y69-W71 AromaticContact CD1-CD2 3.79Å; Y69-W71 HydrophobicContact CD1-CD2 3.79Å; Y69-W71 AromaticContact CD1-CE3 3.68Å; Y69-W71 HydrophobicContact CD1-CE3 3.68Å; Y69-W71 HydrophobicContact CD1-CG 4.47Å; Y69-W71 HydrophobicContact CD1-CH2 4.08Å; Y69-W71 HydrophobicContact CD1-CZ2 4.17Å; Y69-W71 AromaticContact CD1-CZ3 3.84Å; Y69-W71 HydrophobicContact CD1-CZ3 3.84Å; Y69-W71 AromaticContact CE1-CD2 3.6Å; Y69-W71 HydrophobicContact CE1-CD2 3.6Å; Y69-W71 AromaticContact CE1-CE2 3.68Å; Y69-W71 HydrophobicContact CE1-CE3 4Å; Y69-W71 AromaticContact CE1-CG 3.9Å; Y69-W71 HydrophobicContact CE1-CG 3.9Å; Y69-W71 HydrophobicContact CE1-CZ2 4.17Å; Y69-W71 HydrophobicContact CE1-CZ3 4.46Å; Y69-W71 AromaticContact CE1-NE1 3.95Å
70	V	94	Very high	88.8	Confident	81 Å²	81	65.8 Å²	65.8	49%	0.491	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.2	176.4	-177.2	0	0	0	0	107.1	E25 K68 S72	E25-V70 HydrophobicContact CG-CG2 4.13Å; K68-V70 HydrophobicContact CD-CG2 4.31Å; K68-V70 HydrophobicContact CG-CG2 4.12Å; V70-S72 PolarHBondContact O-N 3.49Å
71	W	93.3	Very high	89.2	Confident	20 Å²	20	63.6 Å²	63.6	8%	0.076	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	117.9	173.9	-79.2	-101.9	0	0	0	108.8	L23 H24 L26 V41 F55 Y69 M73 E75	L23-W71 HydrophobicContact CB-CD2 4Å; L23-W71 HydrophobicContact CB-CE3 4.11Å; L23-W71 HydrophobicContact CB-CH2 3.98Å; L23-W71 HydrophobicContact CB-CZ2 3.86Å; L23-W71 HydrophobicContact CB-CZ3 4.1Å; L23-W71 HydrophobicContact CD1-CH2 4Å; L23-W71 HydrophobicContact CD1-CZ2 3.6Å; L23-W71 HydrophobicContact CG-CZ2 4.39Å; H24-W71 PolarHBondContact O-N 3.37Å; L26-W71 HydrophobicContact CB-CH2 4.22Å; L26-W71 HydrophobicContact CB-CZ3 3.94Å; V41-W71 HydrophobicContact CG2-CH2 4.2Å; F55-W71 AromaticContact CD1-CZ2 3.85Å; F55-W71 HydrophobicContact CD1-CZ2 3.85Å; F55-W71 AromaticContact CE1-CH2 3.77Å; F55-W71 HydrophobicContact CE1-CH2 3.77Å; F55-W71 AromaticContact CE1-CZ2 3.42Å; F55-W71 HydrophobicContact CE1-CZ2 3.42Å; F55-W71 VanDerWaalsContact CE1-CZ2 3.42Å; F55-W71 HydrophobicContact CE2-CH2 4.31Å; F55-W71 AromaticContact CZ-CH2 3.65Å; F55-W71 HydrophobicContact CZ-CH2 3.65Å; F55-W71 AromaticContact CZ-CZ2 3.81Å; F55-W71 HydrophobicContact CZ-CZ2 3.81Å; Y69-W71 AromaticContact CD1-CD2 3.79Å; Y69-W71 HydrophobicContact CD1-CD2 3.79Å; Y69-W71 AromaticContact CD1-CE3 3.68Å; Y69-W71 HydrophobicContact CD1-CE3 3.68Å; Y69-W71 HydrophobicContact CD1-CG 4.47Å; Y69-W71 HydrophobicContact CD1-CH2 4.08Å; Y69-W71 HydrophobicContact CD1-CZ2 4.17Å; Y69-W71 AromaticContact CD1-CZ3 3.84Å; Y69-W71 HydrophobicContact CD1-CZ3 3.84Å; Y69-W71 AromaticContact CE1-CD2 3.6Å; Y69-W71 HydrophobicContact CE1-CD2 3.6Å; Y69-W71 AromaticContact CE1-CE2 3.68Å; Y69-W71 HydrophobicContact CE1-CE3 4Å; Y69-W71 AromaticContact CE1-CG 3.9Å; Y69-W71 HydrophobicContact CE1-CG 3.9Å; Y69-W71 HydrophobicContact CE1-CZ2 4.17Å; Y69-W71 HydrophobicContact CE1-CZ3 4.46Å; Y69-W71 AromaticContact CE1-NE1 3.95Å; W71-M73 PolarHBondContact O-N 2.97Å; W71-E75 VanDerWaalsContact CD1-CB 3.5Å; W71-E75 HydrophobicContact CG-CB 4.46Å; W71-E75 PolarHBondContact NE1-OE2 3.24Å
72	S	90.4	Very high	90	Very high	132 Å²	132	57.5 Å²	57.5	92%	0.923	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	-29.2	176.2	53.3	0	0	0	0	113	V70	V70-S72 PolarHBondContact O-N 3.49Å
73	M	91.8	Very high	91	Very high	148 Å²	148	54.5 Å²	54.5	73%	0.729	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	123.2	165.2	-179.8	60.9	63	0	0	107.2	W71 E75	W71-M73 PolarHBondContact O-N 2.97Å; M73-E75 PolarHBondContact O-N 2.9Å
74	P	92.7	Very high	91.9	Very high	44 Å²	44	50.7 Å²	50.7	29%	0.286	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	131.8	-174.6	-28.4	36.5	0	0	0	112.8	L23 H24 N76	L23-P74 WeakPolarHBondContact O-CA 3.44Å; L23-P74 WeakPolarHBondContact O-CB 3.46Å; H24-P74 VanDerWaalsContact ND1-CG 3.3Å; H24-P74 WeakPolarHBondContact ND1-CG 3.1Å; P74-N76 PolarHBondContact O-N 2.86Å
75	E	94.7	Very high	92.7	Very high	29 Å²	29	48.1 Å²	48.1	14%	0.136	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117	-178.1	-176.2	172.8	-175.9	0	0	111	S22 L23 K53 W71 M73	S22-E75 WeakPolarHBondContact CA-O 3.45Å; L23-E75 HydrophobicContact CB-CB 4.5Å; L23-E75 PolarHBondContact N-O 2.65Å; L23-E75 PolarHBondContact O-N 2.97Å; K53-E75 WeakPolarHBondContact CB-OE1 3.45Å; K53-E75 VanDerWaalsContact CG-OE1 3.29Å; K53-E75 WeakPolarHBondContact CG-OE1 3.44Å; K53-E75 PolarHBondContact N-OE1 2.91Å; W71-E75 VanDerWaalsContact CD1-CB 3.5Å; W71-E75 HydrophobicContact CG-CB 4.46Å; W71-E75 PolarHBondContact NE1-OE2 3.24Å; M73-E75 PolarHBondContact O-N 2.9Å
76	N	96.5	Very high	92.7	Very high	90 Å²	90	50.3 Å²	50.3	48%	0.481	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	117.3	-179.6	-68.9	-22.3	0	0	0	111.7	T20 S22 P74	T20-N76 HydrophobicContact CG2-CB 3.85Å; S22-N76 WeakPolarHBondContact CB-OD1 3.48Å; S22-N76 PolarHBondContact OG-OD1 2.86Å; P74-N76 PolarHBondContact O-N 2.86Å
77	I	96.7	Very high	92.3	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.041	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	111.8	168.4	-58	175.8	0	0	0	108.5	A21 L23 W43	A21-I77 PolarHBondContact N-O 2.89Å; A21-I77 PolarHBondContact O-N 2.75Å; L23-I77 HydrophobicContact CD1-CD1 3.84Å; L23-I77 HydrophobicContact CG-CD1 4.4Å; W43-I77 HydrophobicContact CB-CG2 4.42Å; W43-I77 HydrophobicContact CG-CG2 4.46Å
78	E	95.8	Very high	91.7	Very high	95 Å²	95	63.6 Å²	63.6	44%	0.444	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.5	-176.6	-68	-172.1	-140.4	0	0	113.1	Q18 I19 T20	Q18-E78 PolarHBondContact NE2-OE2 3.33Å; I19-E78 WeakPolarHBondContact O-CA 3.39Å; T20-E78 HydrophobicContact CG2-CG 3.86Å
79	F	94.8	Very high	91.2	Very high	5 Å²	5	61.4 Å²	61.4	2%	0.022	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141.8	173.6	54.9	-94.6	0	0	0	113.6	I19 W43 Y50 W97 I131	I19-F79 HydrophobicContact CB-CD2 3.91Å; I19-F79 HydrophobicContact CB-CE1 4.47Å; I19-F79 HydrophobicContact CB-CE2 3.58Å; I19-F79 HydrophobicContact CB-CZ 3.89Å; I19-F79 HydrophobicContact CG1-CD2 4.27Å; I19-F79 HydrophobicContact CG1-CE2 3.88Å; I19-F79 HydrophobicContact CG2-CE1 4.17Å; I19-F79 HydrophobicContact CG2-CE2 3.76Å; I19-F79 HydrophobicContact CG2-CZ 3.56Å; I19-F79 PolarHBondContact N-O 2.92Å; I19-F79 PolarHBondContact O-N 3.33Å; W43-F79 HydrophobicContact CB-CD1 4.36Å; W43-F79 HydrophobicContact CB-CE1 4.02Å; W43-F79 AromaticContact CD2-CE1 3.83Å; W43-F79 HydrophobicContact CD2-CE1 3.83Å; W43-F79 HydrophobicContact CD2-CZ 4.17Å; W43-F79 AromaticContact CE3-CE1 3.87Å; W43-F79 HydrophobicContact CE3-CE1 3.87Å; W43-F79 AromaticContact CE3-CZ 3.73Å; W43-F79 HydrophobicContact CE3-CZ 3.73Å; W43-F79 AromaticContact CG-CE1 3.91Å; W43-F79 HydrophobicContact CG-CE1 3.91Å; W43-F79 HydrophobicContact CZ3-CZ 4.11Å; Y50-F79 HydrophobicContact CD1-CB 4.35Å; Y50-F79 HydrophobicContact CD2-CB 3.83Å; Y50-F79 HydrophobicContact CD2-CD1 4.49Å; Y50-F79 HydrophobicContact CD2-CG 4.4Å; Y50-F79 HydrophobicContact CE1-CB 4.09Å; Y50-F79 HydrophobicContact CE2-CB 3.52Å; Y50-F79 HydrophobicContact CE2-CG 4.38Å; Y50-F79 HydrophobicContact CG-CB 4.23Å; F79-W97 HydrophobicContact CB-CH2 3.9Å; F79-W97 HydrophobicContact CB-CZ3 4.37Å; F79-W97 HydrophobicContact CD1-CZ3 4.41Å; F79-W97 HydrophobicContact CD2-CD2 4.26Å; F79-W97 AromaticContact CD2-CE2 3.83Å; F79-W97 HydrophobicContact CD2-CE3 4.21Å; F79-W97 AromaticContact CD2-CH2 3.29Å; F79-W97 HydrophobicContact CD2-CH2 3.29Å; F79-W97 AromaticContact CD2-CZ2 3.32Å; F79-W97 HydrophobicContact CD2-CZ2 3.32Å; F79-W97 AromaticContact CD2-CZ3 3.77Å; F79-W97 HydrophobicContact CD2-CZ3 3.77Å; F79-W97 AromaticContact CE2-CD2 3.83Å; F79-W97 HydrophobicContact CE2-CD2 3.83Å; F79-W97 AromaticContact CE2-CE2 3.64Å; F79-W97 HydrophobicContact CE2-CE3 4.05Å; F79-W97 HydrophobicContact CE2-CG 4.44Å; F79-W97 AromaticContact CE2-CH2 3.89Å; F79-W97 HydrophobicContact CE2-CH2 3.89Å; F79-W97 AromaticContact CE2-CZ2 3.66Å; F79-W97 HydrophobicContact CE2-CZ2 3.66Å; F79-W97 HydrophobicContact CE2-CZ3 4.09Å; F79-W97 AromaticContact CG-CH2 3.69Å; F79-W97 HydrophobicContact CG-CH2 3.69Å; F79-W97 HydrophobicContact CG-CZ2 4.2Å; F79-W97 AromaticContact CG-CZ3 3.94Å; F79-W97 HydrophobicContact CG-CZ3 3.94Å; F79-W97 HydrophobicContact CZ-CD2 4.32Å; F79-W97 HydrophobicContact CZ-CE3 4.32Å; F79-I131 HydrophobicContact CE2-CD1 4.41Å; F79-I131 HydrophobicContact CZ-CD1 4.27Å
80	V	93.7	Very high	90.6	Very high	66 Å²	66	60.5 Å²	60.5	40%	0.4	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	137.4	177.5	-178.3	0	0	0	0	112	F17 R48	F17-V80 CarbonylContact O-C 3.59Å; F17-V80 WeakPolarHBondContact O-CA 3.34Å; R48-V80 PolarHBondContact NH1-O 2.78Å
81	T	92.1	Very high	90.1	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	124.3	-177.2	-170.9	0	0	0	0	113.3	F17 I19 L83 K95 I131	F17-T81 HydrophobicContact CB-CG2 4.22Å; F17-T81 PolarHBondContact N-O 3.15Å; F17-T81 PolarHBondContact O-N 3.25Å; I19-T81 HydrophobicContact CD1-CG2 4.44Å; I19-T81 HydrophobicContact CG1-CG2 3.78Å; T81-L83 PolarHBondContact O-N 2.86Å; T81-K95 WeakPolarHBondContact OG1-CD 3.5Å; T81-K95 PolarHBondContact OG1-NZ 3.33Å; T81-I131 HydrophobicContact CG2-CG2 4.14Å
82	T	92.1	Very high	90	Very high	4 Å²	4	60.2 Å²	60.2	3%	0.025	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	106.6	173.8	-40	0	0	0	0	111.9	A14 A15 K16 Y84 K95 M179 S181	A14-T82 HydrophobicContact CB-CG2 3.96Å; A15-T82 CarbonylContact O-C 3.53Å; A15-T82 VanDerWaalsContact O-CA 3.29Å; A15-T82 WeakPolarHBondContact O-CA 3.46Å; K16-T82 HydrophobicContact CG-CG2 4.31Å; T82-Y84 HydrophobicContact CG2-CE1 4.34Å; T82-K95 VanDerWaalsContact C-NZ 3.33Å; T82-K95 WeakPolarHBondContact O-CE 3.24Å; T82-K95 PolarHBondContact O-NZ 3.07Å; T82-M179 HydrophobicContact CG2-CE 3.88Å; T82-M179 WeakPolarHBondContact CG2-O 3.37Å; T82-S181 PolarHBondContact OG1-OG 2.85Å; T82-S181 VanDerWaalsContact OG1-OG 3.1Å
83	L	92.3	Very high	90.1	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	155	169.6	-65.5	175	0	0	0	110.6	A14 A15 F17 T81 F92 K95 I131 V135	A14-L83 CarbonylContact C-O 3.58Å; A14-L83 VanDerWaalsContact CA-O 3.32Å; A14-L83 WeakPolarHBondContact CA-O 3.4Å; A15-L83 PolarHBondContact N-O 2.93Å; A15-L83 PolarHBondContact O-N 3.38Å; F17-L83 HydrophobicContact CD2-CB 4.13Å; F17-L83 HydrophobicContact CD2-CD1 3.68Å; F17-L83 HydrophobicContact CD2-CG 4.01Å; F17-L83 HydrophobicContact CE2-CB 4.07Å; F17-L83 HydrophobicContact CE2-CD1 3.84Å; F17-L83 HydrophobicContact CE2-CG 4.32Å; T81-L83 PolarHBondContact O-N 2.86Å; L83-F92 HydrophobicContact CB-CB 3.95Å; L83-F92 HydrophobicContact CB-CD1 3.54Å; L83-F92 HydrophobicContact CB-CE1 4.27Å; L83-F92 HydrophobicContact CB-CG 3.84Å; L83-F92 HydrophobicContact CD1-CB 4.14Å; L83-F92 HydrophobicContact CD1-CG 4.22Å; L83-K95 HydrophobicContact CD2-CB 3.33Å; L83-K95 HydrophobicContact CD2-CD 3.66Å; L83-K95 HydrophobicContact CD2-CG 4.06Å; L83-I131 HydrophobicContact CD1-CG2 4.49Å; L83-V135 HydrophobicContact CD1-CB 4.06Å; L83-V135 HydrophobicContact CD1-CG1 3.57Å; L83-V135 HydrophobicContact CD1-CG2 3.42Å; L83-V135 VanDerWaalsContact CD1-CG2 3.42Å
84	Y	90	Very high	90.1	Very high	32 Å²	32	58.2 Å²	58.2	13%	0.125	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147.6	179.6	-63.2	-75.4	0	0	0	109	R9 K13 A14 T82 F92 E93 A174 M179	R9-Y84 HydrophobicContact CG-CE1 4.37Å; R9-Y84 PolarHBondContact NE-OH 2.82Å; K13-Y84 CarbonylContact O-C 3.53Å; K13-Y84 WeakPolarHBondContact O-CA 3.33Å; A14-Y84 HydrophobicContact CB-CD1 3.68Å; A14-Y84 HydrophobicContact CB-CE1 3.71Å; T82-Y84 HydrophobicContact CG2-CE1 4.34Å; Y84-F92 CarbonylContact O-C 3.6Å; Y84-F92 WeakPolarHBondContact O-CA 3.14Å; Y84-E93 WeakPolarHBondContact O-CG 3.48Å; Y84-E93 PolarHBondContact O-N 3.32Å; Y84-A174 HydrophobicContact CD1-CB 3.59Å; Y84-A174 HydrophobicContact CE1-CB 3.63Å; Y84-M179 PolarHBondContact OH-O 3.36Å
85	R	90.4	Very high	90.1	Very high	28 Å²	28	56.9 Å²	56.9	11%	0.106	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.3	169.1	62.7	-171.9	178.7	178.2	-6	109.9	K12 K13 A89 I90 Q91 F92 D137	K12-R85 CarbonylContact C-O 3.55Å; K12-R85 WeakPolarHBondContact CA-O 3.14Å; K12-R85 WeakPolarHBondContact CB-O 3.27Å; K13-R85 HydrophobicContact CB-CG 4.16Å; K13-R85 PolarHBondContact N-O 3.28Å; K13-R85 PolarHBondContact O-N 3.36Å; R85-A89 VanDerWaalsContact CD-O 3.3Å; R85-A89 WeakPolarHBondContact CD-O 3.42Å; R85-I90 WeakPolarHBondContact CD-O 3.26Å; R85-I90 PolarHBondContact NH1-O 2.7Å; R85-Q91 WeakPolarHBondContact CB-O 3.5Å; R85-F92 HydrophobicContact CB-CD1 3.96Å; R85-F92 HydrophobicContact CB-CE1 4.32Å; R85-F92 HydrophobicContact CG-CD1 4.1Å; R85-F92 HydrophobicContact CG-CE1 3.93Å; R85-D137 IonicContact CZ-OD1 2.76Å; R85-D137 IonicContact CZ-OD2 2.85Å; R85-D137 VanDerWaalsContact CZ-OD2 3.23Å; R85-D137 IonicContact NH1-OD1 2.64Å; R85-D137 PolarHBondContact NH1-OD1 2.87Å; R85-D137 IonicContact NH1-OD2 3.13Å; R85-D137 PolarHBondContact NH1-OD2 3.33Å; R85-D137 VanDerWaalsContact NH2-CG 3.26Å; R85-D137 IonicContact NH2-OD1 2.79Å; R85-D137 PolarHBondContact NH2-OD1 2.83Å; R85-D137 IonicContact NH2-OD2 2.7Å; R85-D137 PolarHBondContact NH2-OD2 3.01Å
86	N	86.9	Confident	90.1	Very high	83 Å²	83	60.3 Å²	60.3	44%	0.444	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	148	169.8	-62.8	-33.4	0	0	0	108.7	K12 K88 A89	K12-N86 WeakPolarHBondContact CE-OD1 3.4Å; N86-K88 PolarHBondContact O-N 3.47Å; N86-K88 VanDerWaalsContact O-N 3.08Å; N86-A89 HydrophobicContact CB-CB 3.93Å; N86-A89 PolarHBondContact O-N 2.78Å; N86-A89 VanDerWaalsContact O-O 3.11Å
87	E	81.8	Confident	90.1	Very high	129 Å²	129	56 Å²	56	60%	0.603	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.9	-176.8	-176.9	-179	-152.5	0	0	113.9
88	K	80.8	Confident	90.1	Very high	197 Å²	197	58.4 Å²	58.4	86%	0.857	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-1.6	179.1	-56.8	-175.8	-178.8	-176	0	114.1	N86	N86-K88 PolarHBondContact O-N 3.47Å; N86-K88 VanDerWaalsContact O-N 3.08Å
89	A	81.5	Confident	90.1	Very high	34 Å²	34	53.9 Å²	53.9	28%	0.281	26%	0.261	S	S	.	.			trans	-107.8	126.8	-177.9	0	0	0	0	0	110.2	R85 N86	R85-A89 VanDerWaalsContact CD-O 3.3Å; R85-A89 WeakPolarHBondContact CD-O 3.42Å; N86-A89 HydrophobicContact CB-CB 3.93Å; N86-A89 PolarHBondContact O-N 2.78Å; N86-A89 VanDerWaalsContact O-O 3.11Å
90	I	80.3	Confident	90.2	Very high	43 Å²	43	54.6 Å²	54.6	22%	0.221	27%	0.265	C	S	.	.	S	Bend	trans	-73.7	-36.8	177	-57.8	87.7	0	0	0	110.2	R85 K510 L514	R85-I90 WeakPolarHBondContact CD-O 3.26Å; R85-I90 PolarHBondContact NH1-O 2.7Å; I90-K510 HydrophobicContact CG2-CG 4.42Å; I90-L514 HydrophobicContact CD1-CD1 4.5Å; I90-L514 HydrophobicContact CD1-CD2 3.41Å; I90-L514 VanDerWaalsContact CD1-CD2 3.41Å; I90-L514 HydrophobicContact CD1-CG 4.05Å; I90-L514 HydrophobicContact CG1-CD2 3.72Å; I90-L514 HydrophobicContact CG1-CG 3.96Å
91	Q	84.3	Confident	90.3	Very high	86 Å²	86	51.4 Å²	51.4	40%	0.402	25%	0.246	S	C	.	.	S	Bend	trans	-77	136	-178.3	-175.2	160.3	-0.5	0	0	112.1	R85 K510	R85-Q91 WeakPolarHBondContact CB-O 3.5Å; Q91-K510 VanDerWaalsContact CD-NZ 3.32Å
92	F	91.1	Very high	90.4	Very high	10 Å²	10	51.8 Å²	51.8	4%	0.044	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-72.6	147	170.9	-66.4	-78.7	0	0	0	112.1	A15 F17 L83 Y84 R85 A132 V135	A15-F92 HydrophobicContact CB-CE1 3.64Å; A15-F92 HydrophobicContact CB-CZ 3.75Å; F17-F92 HydrophobicContact CE2-CD1 4.47Å; F17-F92 HydrophobicContact CE2-CD2 4.32Å; F17-F92 HydrophobicContact CE2-CE1 4.05Å; F17-F92 AromaticContact CE2-CE2 3.89Å; F17-F92 HydrophobicContact CE2-CE2 3.89Å; F17-F92 AromaticContact CE2-CZ 3.74Å; F17-F92 HydrophobicContact CE2-CZ 3.74Å; F17-F92 HydrophobicContact CZ-CD2 4.42Å; F17-F92 HydrophobicContact CZ-CE1 4.43Å; F17-F92 AromaticContact CZ-CE2 3.66Å; F17-F92 HydrophobicContact CZ-CE2 3.66Å; F17-F92 AromaticContact CZ-CZ 3.67Å; F17-F92 HydrophobicContact CZ-CZ 3.67Å; L83-F92 HydrophobicContact CB-CB 3.95Å; L83-F92 HydrophobicContact CB-CD1 3.54Å; L83-F92 HydrophobicContact CB-CE1 4.27Å; L83-F92 HydrophobicContact CB-CG 3.84Å; L83-F92 HydrophobicContact CD1-CB 4.14Å; L83-F92 HydrophobicContact CD1-CG 4.22Å; Y84-F92 CarbonylContact O-C 3.6Å; Y84-F92 WeakPolarHBondContact O-CA 3.14Å; R85-F92 HydrophobicContact CB-CD1 3.96Å; R85-F92 HydrophobicContact CB-CE1 4.32Å; R85-F92 HydrophobicContact CG-CD1 4.1Å; R85-F92 HydrophobicContact CG-CE1 3.93Å; F92-A132 HydrophobicContact CB-CB 4.24Å; F92-V135 HydrophobicContact CB-CG2 4.5Å; F92-V135 HydrophobicContact CD2-CG2 3.53Å; F92-V135 HydrophobicContact CE2-CG2 4.11Å; F92-V135 HydrophobicContact CG-CG2 4.25Å
93	E	91	Very high	90.5	Very high	73 Å²	73	52.3 Å²	52.3	34%	0.341	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-61.5	138.6	172.4	-65.8	-176.8	162.1	0	0	110.9	K12 Y84 K95	K12-E93 VanDerWaalsContact CE-OE1 3.24Å; K12-E93 WeakPolarHBondContact CE-OE1 3.46Å; K12-E93 IonicContact NZ-OE1 2.69Å; K12-E93 PolarHBondContact NZ-OE1 2.9Å; K12-E93 IonicContact NZ-OE2 3.26Å; Y84-E93 WeakPolarHBondContact O-CG 3.48Å; Y84-E93 PolarHBondContact O-N 3.32Å; E93-K95 PolarHBondContact O-N 3.26Å
94	E	92.1	Very high	90.3	Very high	164 Å²	164	53.5 Å²	53.5	77%	0.766	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-49.1	129.7	-179.7	-60.8	178.2	-178.4	0	0	111.6	D130	E94-D130 VanDerWaalsContact CA-OD2 3.28Å; E94-D130 WeakPolarHBondContact CA-OD2 3.38Å; E94-D130 WeakPolarHBondContact CB-OD2 3.36Å; E94-D130 WeakPolarHBondContact CG-OD2 3.48Å
95	K	92.6	Very high	89.6	Confident	16 Å²	16	53.3 Å²	53.3	7%	0.07	26%	0.264	C	S	.	.			trans	-138	82.9	177.1	-167.2	-175.8	-86.2	-166.5	0	111.3	R45 T81 T82 L83 E93 W97 D130 I131	R45-K95 VanDerWaalsContact NE-CG 3.29Å; T81-K95 WeakPolarHBondContact OG1-CD 3.5Å; T81-K95 PolarHBondContact OG1-NZ 3.33Å; T82-K95 VanDerWaalsContact C-NZ 3.33Å; T82-K95 WeakPolarHBondContact O-CE 3.24Å; T82-K95 PolarHBondContact O-NZ 3.07Å; L83-K95 HydrophobicContact CD2-CB 3.33Å; L83-K95 HydrophobicContact CD2-CD 3.66Å; L83-K95 HydrophobicContact CD2-CG 4.06Å; E93-K95 PolarHBondContact O-N 3.26Å; K95-W97 PolarHBondContact O-N 2.85Å; K95-D130 WeakPolarHBondContact CA-OD1 3.42Å; K95-D130 PolarHBondContact N-OD1 3.2Å; K95-I131 PolarHBondContact O-N 2.87Å; K95-I131 VanDerWaalsContact O-N 3.13Å
96	E	94.9	Very high	88.5	Confident	101 Å²	101	54.8 Å²	54.8	47%	0.472	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	130.6	166.9	-59.5	-169.2	142.8	0	0	112.4	R45 Q128 I129	R45-E96 WeakPolarHBondContact CD-O 3.48Å; R45-E96 PolarHBondContact NE-O 3.09Å; E96-Q128 PolarHBondContact OE1-NE2 2.76Å; E96-Q128 PolarHBondContact OE2-NE2 3.42Å; E96-I129 WeakPolarHBondContact CA-O 3.31Å
97	W	96.4	Very high	87.2	Confident	1 Å²	1	59 Å²	59	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	157.7	159.2	-78	73.4	0	0	0	109.3	W43 R45 R48 Y50 F79 K95 Q128 I129 I131	W43-W97 HydrophobicContact CE3-CB 4.2Å; W43-W97 HydrophobicContact CZ3-CB 4.29Å; R45-W97 HydrophobicContact CB-CD2 3.55Å; R45-W97 HydrophobicContact CB-CE3 3.51Å; R45-W97 HydrophobicContact CB-CG 4.08Å; R45-W97 HydrophobicContact CB-CH2 4.3Å; R45-W97 HydrophobicContact CB-CZ2 4.33Å; R45-W97 HydrophobicContact CB-CZ3 3.9Å; R45-W97 HydrophobicContact CG-CD2 4.31Å; R48-W97 VanDerWaalsContact NH2-CH2 3.29Å; Y50-W97 HydrophobicContact CD2-CH2 4.39Å; Y50-W97 AromaticContact CD2-CZ3 3.96Å; Y50-W97 HydrophobicContact CD2-CZ3 3.96Å; Y50-W97 AromaticContact CE2-CH2 3.83Å; Y50-W97 HydrophobicContact CE2-CH2 3.83Å; Y50-W97 AromaticContact CE2-CZ3 3.83Å; Y50-W97 HydrophobicContact CE2-CZ3 3.83Å; F79-W97 HydrophobicContact CB-CH2 3.9Å; F79-W97 HydrophobicContact CB-CZ3 4.37Å; F79-W97 HydrophobicContact CD1-CZ3 4.41Å; F79-W97 HydrophobicContact CD2-CD2 4.26Å; F79-W97 AromaticContact CD2-CE2 3.83Å; F79-W97 HydrophobicContact CD2-CE3 4.21Å; F79-W97 AromaticContact CD2-CH2 3.29Å; F79-W97 HydrophobicContact CD2-CH2 3.29Å; F79-W97 AromaticContact CD2-CZ2 3.32Å; F79-W97 HydrophobicContact CD2-CZ2 3.32Å; F79-W97 AromaticContact CD2-CZ3 3.77Å; F79-W97 HydrophobicContact CD2-CZ3 3.77Å; F79-W97 AromaticContact CE2-CD2 3.83Å; F79-W97 HydrophobicContact CE2-CD2 3.83Å; F79-W97 AromaticContact CE2-CE2 3.64Å; F79-W97 HydrophobicContact CE2-CE3 4.05Å; F79-W97 HydrophobicContact CE2-CG 4.44Å; F79-W97 AromaticContact CE2-CH2 3.89Å; F79-W97 HydrophobicContact CE2-CH2 3.89Å; F79-W97 AromaticContact CE2-CZ2 3.66Å; F79-W97 HydrophobicContact CE2-CZ2 3.66Å; F79-W97 HydrophobicContact CE2-CZ3 4.09Å; F79-W97 AromaticContact CG-CH2 3.69Å; F79-W97 HydrophobicContact CG-CH2 3.69Å; F79-W97 HydrophobicContact CG-CZ2 4.2Å; F79-W97 AromaticContact CG-CZ3 3.94Å; F79-W97 HydrophobicContact CG-CZ3 3.94Å; F79-W97 HydrophobicContact CZ-CD2 4.32Å; F79-W97 HydrophobicContact CZ-CE3 4.32Å; K95-W97 PolarHBondContact O-N 2.85Å; W97-Q128 WeakPolarHBondContact O-CA 3.37Å; W97-I129 PolarHBondContact N-O 2.86Å; W97-I129 PolarHBondContact O-N 2.83Å; W97-I131 HydrophobicContact CB-CG1 4.18Å; W97-I131 HydrophobicContact CG-CG1 3.85Å
98	I	96.7	Very high	85.7	Confident	57 Å²	57	58 Å²	58	29%	0.292	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.9	179.3	-58.3	170.7	0	0	0	108.5	W43 S44 Q100 T126 R127 Q128	W43-I98 CarbonylContact C-O 3.52Å; W43-I98 WeakPolarHBondContact CA-O 3.12Å; S44-I98 PolarHBondContact N-O 3.36Å; S44-I98 PolarHBondContact O-N 3.09Å; I98-Q100 HydrophobicContact CG2-CB 4.24Å; I98-Q100 HydrophobicContact CG2-CG 4.48Å; I98-T126 VanDerWaalsContact CG2-OG1 3.27Å; I98-T126 WeakPolarHBondContact CG2-OG1 3.29Å; I98-R127 WeakPolarHBondContact CA-O 3.34Å; I98-Q128 HydrophobicContact CG1-CG 4.31Å
99	C	97	Very high	84.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125	163.8	177.2	0	0	0	0	108	V42 W43 T126 R127 I129 M148	V42-C99 WeakPolarHBondContact O-CA 3.4Å; W43-C99 HydrophobicContact CD2-CB 4.23Å; W43-C99 HydrophobicContact CE3-CB 4.33Å; W43-C99 HydrophobicContact CH2-CB 4.37Å; W43-C99 HydrophobicContact CZ2-CB 4.24Å; W43-C99 HydrophobicContact CZ3-CB 4.4Å; C99-T126 CarbonylContact O-C 3.54Å; C99-T126 WeakPolarHBondContact O-CA 3.27Å; C99-R127 PolarHBondContact N-O 3.1Å; C99-R127 PolarHBondContact O-N 2.7Å; C99-I129 HydrophobicContact CB-CD1 3.84Å; C99-M148 WeakPolarHBondContact O-CE 3.49Å
100	Q	96.2	Very high	82.6	Confident	20 Å²	20	53 Å²	53	9%	0.093	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146.1	-177	65.1	-171.5	36.9	0	0	112.8	V41 V42 I98 E102 V123 A125	V41-Q100 CarbonylContact C-O 3.55Å; V42-Q100 HydrophobicContact CB-CG 3.99Å; V42-Q100 PolarHBondContact N-O 3.04Å; V42-Q100 PolarHBondContact O-N 3.24Å; I98-Q100 HydrophobicContact CG2-CB 4.24Å; I98-Q100 HydrophobicContact CG2-CG 4.48Å; Q100-E102 PolarHBondContact NE2-OE1 3.49Å; Q100-V123 HydrophobicContact CB-CG1 4.12Å; Q100-A125 CarbonylContact C-O 3.6Å; Q100-A125 VanDerWaalsContact CA-O 3.26Å; Q100-A125 WeakPolarHBondContact CA-O 2.8Å; Q100-A125 WeakPolarHBondContact CB-O 3.36Å
101	I	96	Very high	81.1	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	127	173.7	-59.6	164.8	0	0	0	108	L26 I28 L39 V40 V123 L124 A125 M148 A158 V160	L26-I101 HydrophobicContact CD1-CD1 3.37Å; L26-I101 HydrophobicContact CD1-CG1 4.23Å; L26-I101 HydrophobicContact CD2-CD1 4.44Å; I28-I101 HydrophobicContact CG2-CD1 4.07Å; L39-I101 HydrophobicContact CD1-CG2 4.4Å; L39-I101 HydrophobicContact CD2-CG2 4.32Å; V40-I101 WeakPolarHBondContact O-CA 3.4Å; I101-V123 WeakPolarHBondContact O-CA 3.43Å; I101-L124 HydrophobicContact CG2-CB 4.43Å; I101-L124 HydrophobicContact CG2-CD1 4.32Å; I101-L124 PolarHBondContact O-N 2.76Å; I101-A125 HydrophobicContact CD1-CB 4.34Å; I101-A125 PolarHBondContact N-O 2.92Å; I101-M148 HydrophobicContact CD1-CE 4.49Å; I101-M148 HydrophobicContact CD1-SD 3.42Å; I101-M148 WeakPolarHBondContact CD1-SD 3.44Å; I101-M148 HydrophobicContact CG1-CE 4.16Å; I101-M148 HydrophobicContact CG1-SD 3.69Å; I101-A158 HydrophobicContact CD1-CB 4.25Å; I101-V160 HydrophobicContact CD1-CG2 4.31Å
102	E	94.9	Very high	79.7	Confident	9 Å²	9	62.5 Å²	62.5	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.2	174.4	-71.8	178	-162.4	0	0	110.8	L39 V40 V42 R49 Q100 R122 V123	L39-E102 WeakPolarHBondContact CA-O 3.22Å; V40-E102 PolarHBondContact N-O 2.71Å; V40-E102 PolarHBondContact O-N 3.08Å; V42-E102 HydrophobicContact CG2-CG 4.26Å; R49-E102 IonicContact CZ-OE1 3.48Å; R49-E102 IonicContact NH1-OE1 3.36Å; R49-E102 PolarHBondContact NH1-OE1 3.18Å; R49-E102 VanDerWaalsContact NH2-CD 3.29Å; R49-E102 IonicContact NH2-OE1 2.71Å; R49-E102 PolarHBondContact NH2-OE1 3.15Å; R49-E102 IonicContact NH2-OE2 3.08Å; R49-E102 PolarHBondContact NH2-OE2 2.7Å; R49-E102 VanDerWaalsContact NH2-OE2 3.08Å; Q100-E102 PolarHBondContact NE2-OE1 3.49Å; E102-R122 CarbonylContact C-O 3.57Å; E102-R122 WeakPolarHBondContact CA-O 3.19Å; E102-V123 HydrophobicContact CG-CG2 4.07Å
103	D	93.1	Very high	77.5	Confident	14 Å²	14	65 Å²	65	8%	0.075	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.7	163.2	-178.3	10.8	0	0	0	108.3	Y34 G37 L39 G105 R121 R122 L124	Y34-D103 WeakPolarHBondContact OH-CB 3.35Å; Y34-D103 PolarHBondContact OH-OD2 2.84Å; G37-D103 PolarHBondContact N-OD1 3.49Å; L39-D103 HydrophobicContact CD2-CB 4.12Å; D103-G105 VanDerWaalsContact C-N 3.35Å; D103-G105 WeakPolarHBondContact OD1-CA 3.48Å; D103-G105 PolarHBondContact OD1-N 2.85Å; D103-R121 CarbonylContact O-C 3.56Å; D103-R121 VanDerWaalsContact O-CA 3.28Å; D103-R121 WeakPolarHBondContact O-CA 3.46Å; D103-R122 PolarHBondContact N-O 3.25Å; D103-R122 PolarHBondContact O-N 2.98Å; D103-L124 HydrophobicContact CB-CD1 3.99Å; D103-L124 HydrophobicContact CB-CD2 3.91Å; D103-L124 HydrophobicContact CB-CG 3.91Å
104	V	88.4	Confident	75.5	Confident	27 Å²	27	66.2 Å²	66.2	16%	0.164	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-9.4	177	-171.2	0	0	0	0	110.5	N38 V40 V119 R121	N38-V104 HydrophobicContact CB-CB 4.41Å; N38-V104 WeakPolarHBondContact O-CB 3.48Å; N38-V104 PolarHBondContact O-N 2.79Å; V40-V104 HydrophobicContact CB-CG2 4.14Å; V40-V104 HydrophobicContact CG2-CG2 3.61Å; V104-V119 HydrophobicContact CB-CG1 4.49Å; V104-V119 HydrophobicContact CG1-CG1 3.38Å; V104-V119 WeakPolarHBondContact O-CG1 3.34Å; V104-R121 HydrophobicContact CG1-CG 4.43Å; V104-R121 HydrophobicContact CG2-CG 4.43Å
105	G	76.3	Confident	73.4	Confident	27 Å²	27	62.1 Å²	62.1	28%	0.278	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79.7	170.3	-176.1	0	0	0	0	0	113	N38 D103	N38-G105 WeakPolarHBondContact CB-O 3Å; N38-G105 PolarHBondContact N-O 2.6Å; N38-G105 PolarHBondContact ND2-O 2.85Å; D103-G105 VanDerWaalsContact C-N 3.35Å; D103-G105 WeakPolarHBondContact OD1-CA 3.48Å; D103-G105 PolarHBondContact OD1-N 2.85Å
106	S	67.1	Low	71.2	Confident	60 Å²	60	67.1 Å²	67.1	42%	0.42	42%	0.42	S	S	.	.			trans	-81.6	140.3	173.2	-169.8	0	0	0	0	111.2	T108 A109	S106-T108 PolarHBondContact O-N 3.34Å; S106-T108 PolarHBondContact OG-OG1 2.7Å; S106-A109 PolarHBondContact O-N 2.74Å
107	K	58.3	Low	68.9	Low	172 Å²	172	67.3 Å²	67.3	75%	0.748	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-60.7	-25	-179.3	-65.7	176.2	-177.7	170.9	0	112.6	A109	K107-A109 VanDerWaalsContact C-N 3.34Å; K107-A109 PolarHBondContact O-N 3.34Å
108	T	51.6	Low	66.4	Low	107 Å²	107	72.2 Å²	72.2	66%	0.656	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-74	-16.6	-178.8	43.3	0	0	0	0	114.7	S106 G110	S106-T108 PolarHBondContact O-N 3.34Å; S106-T108 PolarHBondContact OG-OG1 2.7Å; T108-G110 PolarHBondContact O-N 2.94Å; T108-G110 VanDerWaalsContact O-N 3.17Å
109	A	49.5	Very low	64.5	Low	82 Å²	82	72.8 Å²	72.8	68%	0.678	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-68.3	-13.3	-179.6	0	0	0	0	0	114.2	S106 K107	S106-A109 PolarHBondContact O-N 2.74Å; K107-A109 VanDerWaalsContact C-N 3.34Å; K107-A109 PolarHBondContact O-N 3.34Å
110	G	46.4	Very low	63.1	Low	43 Å²	43	81.3 Å²	81.3	44%	0.443	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-90.3	-3.2	-177.4	0	0	0	0	0	116.1	T108	T108-G110 PolarHBondContact O-N 2.94Å; T108-G110 VanDerWaalsContact O-N 3.17Å
111	L	50.3	Low	62.6	Low	149 Å²	149	87.7 Å²	87.7	78%	0.78	53%	0.526	S	S	*	.	S	Bend	trans	-93.1	-11.7	-169.6	-112.4	141.8	0	0	0	115.2
112	L	54.2	Low	62.3	Low	180 Å²	180	93 Å²	93	94%	0.942	55%	0.546	S	S	*	.	S	Bend	trans	-115.5	0.5	-178.8	-65.7	174.7	0	0	0	114
113	S	45.1	Very low	62.3	Low	64 Å²	64	95 Å²	95	45%	0.448	56%	0.559	S	S	.	*			trans	-121.4	108	175.8	178	0	0	0	0	108.6	S115	S113-S115 PolarHBondContact O-N 2.72Å; S113-S115 PolarHBondContact OG-OG 3.01Å
114	G	48.5	Very low	62.4	Low	97 Å²	97	94.4 Å²	94.4	100%	1	56%	0.556	S	S	*	*			trans	-68.6	18.1	178.1	0	0	0	0	0	115.3
115	S	48.8	Very low	62.7	Low	79 Å²	79	93.1 Å²	93.1	55%	0.552	55%	0.548	S	S	*	.	S	Bend	trans	-88.4	149.7	166.1	64.3	0	0	0	0	109.2	S113	S113-S115 PolarHBondContact O-N 2.72Å; S113-S115 PolarHBondContact OG-OG 3.01Å
116	T	46.1	Very low	63.7	Low	121 Å²	121	93.7 Å²	93.7	74%	0.742	55%	0.546	S	S	*	.			trans	-49.8	143.1	180	44.6	0	0	0	0	111.1	S118	T116-S118 PolarHBondContact O-N 2.76Å
117	P	45.7	Very low	65.2	Low	105 Å²	105	95.2 Å²	95.2	68%	0.682	54%	0.543	S	S	*	.			trans	-69.3	79.7	-175	28.7	-35.7	0	0	0	110.6	V119	P117-V119 PolarHBondContact O-N 3.25Å
118	S	43.9	Very low	67	Low	104 Å²	104	90.9 Å²	90.9	73%	0.727	53%	0.525	S	S	*	.			trans	-73.6	77.2	170.2	-173.5	0	0	0	0	107.3	T116 R120	T116-S118 PolarHBondContact O-N 2.76Å; S118-R120 PolarHBondContact O-N 2.96Å
119	V	57.6	Low	69.1	Low	68 Å²	68	86.4 Å²	86.4	41%	0.412	50%	0.497	S	S	.	.			trans	-56.4	83	167.4	177.8	0	0	0	0	106.9	V104 P117 R121	V104-V119 HydrophobicContact CB-CG1 4.49Å; V104-V119 HydrophobicContact CG1-CG1 3.38Å; V104-V119 WeakPolarHBondContact O-CG1 3.34Å; P117-V119 PolarHBondContact O-N 3.25Å; V119-R121 HydrophobicContact CG1-CG 4.35Å; V119-R121 PolarHBondContact O-N 2.78Å
120	R	67.5	Low	71.3	Confident	180 Å²	180	83.5 Å²	83.5	68%	0.679	47%	0.47	S	S	*	.			trans	-73.6	80.2	-174.1	-176.2	177.9	175.2	171.9	1.9	108.3	S118 R122	S118-R120 PolarHBondContact O-N 2.96Å; R120-R122 VanDerWaalsContact O-CG 3.3Å; R120-R122 WeakPolarHBondContact O-CG 3.49Å; R120-R122 PolarHBondContact O-N 2.92Å
121	R	84.4	Confident	73.6	Confident	153 Å²	153	81.4 Å²	81.4	58%	0.577	45%	0.449	S	S	*	.			trans	-53.5	128.2	173.8	-67.8	-178	176.7	82.5	-2.7	109.3	D103 V104 V119	D103-R121 CarbonylContact O-C 3.56Å; D103-R121 VanDerWaalsContact O-CA 3.28Å; D103-R121 WeakPolarHBondContact O-CA 3.46Å; V104-R121 HydrophobicContact CG1-CG 4.43Å; V104-R121 HydrophobicContact CG2-CG 4.43Å; V119-R121 HydrophobicContact CG1-CG 4.35Å; V119-R121 PolarHBondContact O-N 2.78Å
122	R	91	Very high	75.7	Confident	111 Å²	111	74.5 Å²	74.5	42%	0.419	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.7	178.9	-55.3	-173.3	-171.8	-153.4	5.6	109.3	E102 D103 R120 L124	E102-R122 CarbonylContact C-O 3.57Å; E102-R122 WeakPolarHBondContact CA-O 3.19Å; D103-R122 PolarHBondContact N-O 3.25Å; D103-R122 PolarHBondContact O-N 2.98Å; R120-R122 VanDerWaalsContact O-CG 3.3Å; R120-R122 WeakPolarHBondContact O-CG 3.49Å; R120-R122 PolarHBondContact O-N 2.92Å; R122-L124 PolarHBondContact O-N 2.91Å
123	V	94.3	Very high	77.5	Confident	53 Å²	53	67.6 Å²	67.6	32%	0.321	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	120.4	170.9	-174.1	0	0	0	0	108.3	Q100 I101 E102 A151	Q100-V123 HydrophobicContact CB-CG1 4.12Å; I101-V123 WeakPolarHBondContact O-CA 3.43Å; E102-V123 HydrophobicContact CG-CG2 4.07Å; V123-A151 HydrophobicContact CB-CB 4.37Å; V123-A151 HydrophobicContact CG1-CB 3.87Å
124	L	94.6	Very high	79.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-43.4	178.2	-60.1	-173.2	0	0	0	111.9	Y34 L39 I101 D103 R122 A151 S152 L155	Y34-L124 HydrophobicContact CE1-CD1 4.23Å; Y34-L124 HydrophobicContact CE1-CD2 4.29Å; Y34-L124 WeakPolarHBondContact OH-CD1 3.35Å; Y34-L124 WeakPolarHBondContact OH-CD2 3.24Å; L39-L124 HydrophobicContact CD2-CD1 3.73Å; I101-L124 HydrophobicContact CG2-CB 4.43Å; I101-L124 HydrophobicContact CG2-CD1 4.32Å; I101-L124 PolarHBondContact O-N 2.76Å; D103-L124 HydrophobicContact CB-CD1 3.99Å; D103-L124 HydrophobicContact CB-CD2 3.91Å; D103-L124 HydrophobicContact CB-CG 3.91Å; R122-L124 PolarHBondContact O-N 2.91Å; L124-A151 WeakPolarHBondContact O-CA 3.49Å; L124-A151 PolarHBondContact O-N 3.43Å; L124-S152 PolarHBondContact O-N 2.84Å; L124-L155 HydrophobicContact CB-CD1 3.63Å; L124-L155 HydrophobicContact CB-CG 4.17Å; L124-L155 HydrophobicContact CD1-CD1 4.36Å; L124-L155 HydrophobicContact CD1-CD2 4.48Å
125	A	96.7	Very high	81.9	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	155.1	177.7	0	0	0	0	0	111.1	Q100 I101 M148 R149 L155 A158	Q100-A125 CarbonylContact C-O 3.6Å; Q100-A125 VanDerWaalsContact CA-O 3.26Å; Q100-A125 WeakPolarHBondContact CA-O 2.8Å; Q100-A125 WeakPolarHBondContact CB-O 3.36Å; I101-A125 HydrophobicContact CD1-CB 4.34Å; I101-A125 PolarHBondContact N-O 2.92Å; A125-M148 HydrophobicContact CB-CB 3.81Å; A125-M148 HydrophobicContact CB-SD 4.3Å; A125-R149 CarbonylContact C-O 3.57Å; A125-R149 VanDerWaalsContact CA-O 3.24Å; A125-R149 WeakPolarHBondContact CA-O 3.43Å; A125-R149 WeakPolarHBondContact CB-O 3.49Å; A125-L155 HydrophobicContact CB-CD1 4.19Å; A125-A158 HydrophobicContact CB-CB 3.74Å
126	T	97.1	Very high	83.8	Confident	40 Å²	40	58.8 Å²	58.8	25%	0.245	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	146.2	-175.1	-176.6	0	0	0	0	111.6	I98 C99 R149 A151	I98-T126 VanDerWaalsContact CG2-OG1 3.27Å; I98-T126 WeakPolarHBondContact CG2-OG1 3.29Å; C99-T126 CarbonylContact O-C 3.54Å; C99-T126 WeakPolarHBondContact O-CA 3.27Å; T126-R149 PolarHBondContact N-O 2.84Å; T126-R149 WeakPolarHBondContact O-CA 3.37Å; T126-R149 WeakPolarHBondContact O-CB 3.3Å; T126-R149 PolarHBondContact O-N 2.85Å; T126-A151 HydrophobicContact CG2-CB 4.4Å
127	R	96.9	Very high	85.8	Confident	91 Å²	91	55 Å²	55	34%	0.343	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.6	173.6	-171.6	61.4	-175.5	-131.2	5.2	110.4	I98 C99 I129 V146 V147 M148	I98-R127 WeakPolarHBondContact CA-O 3.34Å; C99-R127 PolarHBondContact N-O 3.1Å; C99-R127 PolarHBondContact O-N 2.7Å; R127-I129 HydrophobicContact CG-CG1 4.18Å; R127-V146 HydrophobicContact CB-CG1 3.95Å; R127-V146 HydrophobicContact CG-CG1 3.67Å; R127-V147 PolarHBondContact NH1-O 2.67Å; R127-M148 HydrophobicContact CB-CE 4.36Å; R127-M148 HydrophobicContact CB-CG 4.41Å
128	Q	96.4	Very high	87.9	Confident	81 Å²	81	54.6 Å²	54.6	38%	0.379	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.7	163.8	-72.9	159.2	-59.7	0	0	109	E96 W97 I98	E96-Q128 PolarHBondContact OE1-NE2 2.76Å; E96-Q128 PolarHBondContact OE2-NE2 3.42Å; W97-Q128 WeakPolarHBondContact O-CA 3.37Å; I98-Q128 HydrophobicContact CG1-CG 4.31Å
129	I	96	Very high	90.1	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.1	177.6	-61.1	173.9	0	0	0	106	W43 E96 W97 C99 R127 I131 F134 V146	W43-I129 HydrophobicContact CH2-CB 4.48Å; W43-I129 HydrophobicContact CH2-CD1 3.51Å; W43-I129 HydrophobicContact CH2-CG2 4.41Å; W43-I129 HydrophobicContact CZ2-CD1 4.21Å; W43-I129 HydrophobicContact CZ3-CB 4.36Å; W43-I129 HydrophobicContact CZ3-CD1 4.03Å; E96-I129 WeakPolarHBondContact CA-O 3.31Å; W97-I129 PolarHBondContact N-O 2.86Å; W97-I129 PolarHBondContact O-N 2.83Å; C99-I129 HydrophobicContact CB-CD1 3.84Å; R127-I129 HydrophobicContact CG-CG1 4.18Å; I129-I131 HydrophobicContact CG2-CD1 4.47Å; I129-I131 PolarHBondContact O-N 2.89Å; I129-F134 HydrophobicContact CG2-CD2 4.14Å; I129-F134 HydrophobicContact CG2-CE2 3.61Å; I129-V146 HydrophobicContact CD1-CG1 4.1Å; I129-V146 HydrophobicContact CD1-CG2 4.19Å
130	D	96	Very high	91.8	Very high	20 Å²	20	51.6 Å²	51.6	11%	0.107	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	115.5	172.9	-174.7	4.7	0	0	0	109.7	E94 K95 A132 E133 F134	E94-D130 VanDerWaalsContact CA-OD2 3.28Å; E94-D130 WeakPolarHBondContact CA-OD2 3.38Å; E94-D130 WeakPolarHBondContact CB-OD2 3.36Å; E94-D130 WeakPolarHBondContact CG-OD2 3.48Å; K95-D130 WeakPolarHBondContact CA-OD1 3.42Å; K95-D130 PolarHBondContact N-OD1 3.2Å; D130-A132 PolarHBondContact O-N 2.92Å; D130-A132 WeakPolarHBondContact OD1-CB 3.24Å; D130-A132 PolarHBondContact OD1-N 3.02Å; D130-E133 HydrophobicContact CB-CG 4.13Å; D130-E133 PolarHBondContact O-N 2.93Å; D130-F134 WeakPolarHBondContact O-CD2 3.48Å; D130-F134 VanDerWaalsContact O-CE2 3.23Å; D130-F134 WeakPolarHBondContact O-CE2 3.36Å
131	I	95.4	Very high	93.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-69	-23.8	177.5	-61.5	-61.2	0	0	0	111.5	I19 W43 F79 T81 L83 K95 W97 I129 E133 F134 V135 L164	I19-I131 HydrophobicContact CD1-CG2 3.76Å; I19-I131 HydrophobicContact CG1-CG2 3.94Å; W43-I131 HydrophobicContact CZ3-CD1 4.08Å; F79-I131 HydrophobicContact CE2-CD1 4.41Å; F79-I131 HydrophobicContact CZ-CD1 4.27Å; T81-I131 HydrophobicContact CG2-CG2 4.14Å; L83-I131 HydrophobicContact CD1-CG2 4.49Å; K95-I131 PolarHBondContact O-N 2.87Å; K95-I131 VanDerWaalsContact O-N 3.13Å; W97-I131 HydrophobicContact CB-CG1 4.18Å; W97-I131 HydrophobicContact CG-CG1 3.85Å; I129-I131 HydrophobicContact CG2-CD1 4.47Å; I129-I131 PolarHBondContact O-N 2.89Å; I131-E133 PolarHBondContact O-N 2.77Å; I131-E133 VanDerWaalsContact O-N 3.16Å; I131-F134 PolarHBondContact O-N 2.82Å; I131-V135 HydrophobicContact CG2-CG1 3.98Å; I131-V135 WeakPolarHBondContact O-CG1 3.48Å; I131-L164 HydrophobicContact CD1-CD1 3.83Å
132	A	93.6	Very high	93.7	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.033	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-63.7	-18.4	177.1	0	0	0	0	0	113.5	F92 D130	F92-A132 HydrophobicContact CB-CB 4.24Å; D130-A132 PolarHBondContact O-N 2.92Å; D130-A132 WeakPolarHBondContact OD1-CB 3.24Å; D130-A132 PolarHBondContact OD1-N 3.02Å
133	E	92.2	Very high	93.9	Very high	35 Å²	35	44.1 Å²	44.1	16%	0.164	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-78.7	-18.3	174.3	-64.4	179.6	176.2	0	0	113.6	D130 I131 P500 H506	D130-E133 HydrophobicContact CB-CG 4.13Å; D130-E133 PolarHBondContact O-N 2.93Å; I131-E133 PolarHBondContact O-N 2.77Å; I131-E133 VanDerWaalsContact O-N 3.16Å; E133-P500 VanDerWaalsContact OE1-CB 3.3Å; E133-P500 WeakPolarHBondContact OE1-CB 3.49Å; E133-P500 VanDerWaalsContact OE1-CG 3.28Å; E133-P500 WeakPolarHBondContact OE1-CG 3.31Å; E133-H506 PolarHBondContact O-CE1 3.21Å; E133-H506 PolarHBondContact O-NE2 3.1Å
134	F	93.4	Very high	94	Very high	27 Å²	27	42.9 Å²	42.9	12%	0.118	22%	0.222	C	C	.	.	S	Bend	trans	-120.4	22.3	-172.4	-48.3	-75.8	0	0	0	113.6	I129 D130 I131 T142 L144 L164 S166	I129-F134 HydrophobicContact CG2-CD2 4.14Å; I129-F134 HydrophobicContact CG2-CE2 3.61Å; D130-F134 WeakPolarHBondContact O-CD2 3.48Å; D130-F134 VanDerWaalsContact O-CE2 3.23Å; D130-F134 WeakPolarHBondContact O-CE2 3.36Å; I131-F134 PolarHBondContact O-N 2.82Å; F134-T142 HydrophobicContact CD1-CG2 4.35Å; F134-T142 WeakPolarHBondContact CD1-OG1 3.08Å; F134-L144 HydrophobicContact CD1-CD1 4.2Å; F134-L144 HydrophobicContact CD1-CD2 4.07Å; F134-L144 HydrophobicContact CE1-CD1 3.98Å; F134-L144 HydrophobicContact CE1-CD2 3.45Å; F134-L144 VanDerWaalsContact CE1-CD2 3.45Å; F134-L144 HydrophobicContact CE1-CG 4.37Å; F134-L144 HydrophobicContact CE2-CD1 4.41Å; F134-L144 HydrophobicContact CZ-CD1 4.09Å; F134-L144 HydrophobicContact CZ-CD2 4.03Å; F134-L164 HydrophobicContact CB-CD1 4.32Å; F134-L164 HydrophobicContact CB-CD2 3.83Å; F134-L164 HydrophobicContact CD2-CD1 4.15Å; F134-L164 HydrophobicContact CG-CD1 4.28Å; F134-S166 VanDerWaalsContact O-CB 3.24Å; F134-S166 WeakPolarHBondContact O-CB 3.5Å
135	V	92.3	Very high	94.1	Very high	10 Å²	10	50.7 Å²	50.7	6%	0.061	26%	0.256	C	S	.	.			trans	-119	152.7	173.6	-59	0	0	0	0	111.4	F17 I19 L83 F92 I131 S166	F17-V135 HydrophobicContact CB-CG1 4.4Å; F17-V135 HydrophobicContact CD1-CB 4.2Å; F17-V135 HydrophobicContact CD1-CG1 4.09Å; F17-V135 HydrophobicContact CD2-CB 4.38Å; F17-V135 HydrophobicContact CD2-CG1 4.04Å; F17-V135 HydrophobicContact CE1-CB 4.02Å; F17-V135 HydrophobicContact CE1-CG1 4.4Å; F17-V135 HydrophobicContact CE2-CB 4.17Å; F17-V135 HydrophobicContact CE2-CG1 4.33Å; F17-V135 HydrophobicContact CE2-CG2 4.22Å; F17-V135 HydrophobicContact CG-CB 4.37Å; F17-V135 HydrophobicContact CG-CG1 3.9Å; F17-V135 HydrophobicContact CZ-CB 4Å; F17-V135 HydrophobicContact CZ-CG2 4.28Å; I19-V135 HydrophobicContact CD1-CG1 4.1Å; L83-V135 HydrophobicContact CD1-CB 4.06Å; L83-V135 HydrophobicContact CD1-CG1 3.57Å; L83-V135 HydrophobicContact CD1-CG2 3.42Å; L83-V135 VanDerWaalsContact CD1-CG2 3.42Å; F92-V135 HydrophobicContact CB-CG2 4.5Å; F92-V135 HydrophobicContact CD2-CG2 3.53Å; F92-V135 HydrophobicContact CE2-CG2 4.11Å; F92-V135 HydrophobicContact CG-CG2 4.25Å; I131-V135 HydrophobicContact CG2-CG1 3.98Å; I131-V135 WeakPolarHBondContact O-CG1 3.48Å; V135-S166 VanDerWaalsContact CG1-OG 3.31Å; V135-S166 WeakPolarHBondContact CG1-OG 3.47Å
136	S	88.9	Confident	94	Very high	17 Å²	17	51.3 Å²	51.3	12%	0.119	26%	0.26	C	S	.	.			trans	-144.3	173.3	164	95.2	0	0	0	0	109.6	F17 L138 V140	F17-S136 WeakPolarHBondContact CE1-O 3.35Å; S136-L138 CarbonylContact C-O 3.47Å; S136-L138 PolarHBondContact O-N 3Å; S136-L138 PolarHBondContact OG-N 2.89Å; S136-L138 PolarHBondContact OG-O 2.97Å; S136-V140 WeakPolarHBondContact OG-CG2 3.29Å
137	D	86.9	Confident	94	Very high	43 Å²	43	53.4 Å²	53.4	23%	0.23	27%	0.273	C	S	.	.	S	Bend	trans	-68.7	-9.7	173.1	-67.4	-34.4	0	0	0	112.7	R85	R85-D137 IonicContact CZ-OD1 2.76Å; R85-D137 IonicContact CZ-OD2 2.85Å; R85-D137 VanDerWaalsContact CZ-OD2 3.23Å; R85-D137 IonicContact NH1-OD1 2.64Å; R85-D137 PolarHBondContact NH1-OD1 2.87Å; R85-D137 IonicContact NH1-OD2 3.13Å; R85-D137 PolarHBondContact NH1-OD2 3.33Å; R85-D137 VanDerWaalsContact NH2-CG 3.26Å; R85-D137 IonicContact NH2-OD1 2.79Å; R85-D137 PolarHBondContact NH2-OD1 2.83Å; R85-D137 IonicContact NH2-OD2 2.7Å; R85-D137 PolarHBondContact NH2-OD2 3.01Å
138	L	90	Very high	93.9	Very high	95 Å²	95	49.6 Å²	49.6	50%	0.497	26%	0.259	S	S	.	.	S	Bend	trans	-108.2	158	169.8	-60.9	176.1	0	0	0	111.3	S136 V140	S136-L138 CarbonylContact C-O 3.47Å; S136-L138 PolarHBondContact O-N 3Å; S136-L138 PolarHBondContact OG-N 2.89Å; S136-L138 PolarHBondContact OG-O 2.97Å; L138-V140 PolarHBondContact O-N 2.87Å
139	P	91.7	Very high	93.9	Very high	89 Å²	89	52.3 Å²	52.3	58%	0.578	27%	0.266	S	S	*	.			trans	-54	129.7	169	-25.4	35.6	0	0	0	111.9	S166 V167	P139-S166 WeakPolarHBondContact CA-O 3.49Å; P139-V167 HydrophobicContact CB-CG2 4.36Å
140	V	93.5	Very high	93.9	Very high	20 Å²	20	55.5 Å²	55.5	12%	0.121	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.2	-179.6	168.3	0	0	0	0	110.2	S136 L138 T142 N165 S166	S136-V140 WeakPolarHBondContact OG-CG2 3.29Å; L138-V140 PolarHBondContact O-N 2.87Å; V140-T142 HydrophobicContact CG1-CG2 4.02Å; V140-N165 CarbonylContact O-C 3.57Å; V140-N165 WeakPolarHBondContact O-CA 3.47Å; V140-N165 PolarHBondContact O-OD1 3.28Å; V140-S166 PolarHBondContact N-O 2.81Å; V140-S166 PolarHBondContact O-N 2.89Å
141	Q	95.3	Very high	93.8	Very high	140 Å²	140	57.3 Å²	57.3	65%	0.654	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.9	175.6	-170.2	177.8	26.9	0	0	109.4	T163 L164 N165	Q141-T163 HydrophobicContact CG-CG2 3.29Å; Q141-L164 WeakPolarHBondContact CA-O 3.44Å; Q141-N165 HydrophobicContact CG-CB 4.41Å
142	T	95.2	Very high	93.6	Very high	21 Å²	21	58.6 Å²	58.6	13%	0.129	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.5	179.7	50.4	0	0	0	0	112.5	F134 V140 T163 L164 H506	F134-T142 HydrophobicContact CD1-CG2 4.35Å; F134-T142 WeakPolarHBondContact CD1-OG1 3.08Å; V140-T142 HydrophobicContact CG1-CG2 4.02Å; T142-T163 CarbonylContact O-C 3.52Å; T142-T163 WeakPolarHBondContact O-CA 3.24Å; T142-L164 PolarHBondContact N-O 3.01Å; T142-L164 PolarHBondContact O-N 2.64Å; T142-L164 PolarHBondContact OG1-O 2.87Å; T142-H506 VanDerWaalsContact CG2-CE1 3.47Å; T142-H506 WeakPolarHBondContact CG2-CE1 3.34Å
143	N	96.4	Very high	93.5	Very high	127 Å²	127	68.3 Å²	68.3	68%	0.679	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.6	175.3	-66.6	-41.2	0	0	0	109.9	T163	N143-T163 WeakPolarHBondContact OD1-CB 3.45Å; N143-T163 WeakPolarHBondContact OD1-CG2 3.29Å; N143-T163 PolarHBondContact OD1-OG1 2.7Å
144	L	95	Very high	93.4	Very high	27 Å²	27	69.7 Å²	69.7	14%	0.141	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.4	-170.1	-56.9	180	0	0	0	111.1	F134 V146 L162 L164	F134-L144 HydrophobicContact CD1-CD1 4.2Å; F134-L144 HydrophobicContact CD1-CD2 4.07Å; F134-L144 HydrophobicContact CE1-CD1 3.98Å; F134-L144 HydrophobicContact CE1-CD2 3.45Å; F134-L144 VanDerWaalsContact CE1-CD2 3.45Å; F134-L144 HydrophobicContact CE1-CG 4.37Å; F134-L144 HydrophobicContact CE2-CD1 4.41Å; F134-L144 HydrophobicContact CZ-CD1 4.09Å; F134-L144 HydrophobicContact CZ-CD2 4.03Å; L144-V146 HydrophobicContact CB-CG2 3.96Å; L144-L162 HydrophobicContact CB-CD1 4.14Å; L144-L162 HydrophobicContact CB-CG 4.4Å; L144-L162 HydrophobicContact CD1-CD1 4.05Å; L144-L162 HydrophobicContact CG-CD1 4.46Å; L144-L162 PolarHBondContact N-O 3.3Å; L144-L162 PolarHBondContact O-N 3.41Å; L144-L164 HydrophobicContact CD1-CB 3.85Å; L144-L164 HydrophobicContact CD1-CD1 3.98Å
145	K	96.3	Very high	93.4	Very high	163 Å²	163	68.8 Å²	68.8	71%	0.709	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	93.4	166.5	-172.5	174.4	-178.7	175.3	0	109.2	V147 L161	K145-V147 PolarHBondContact O-N 2.89Å; K145-L161 HydrophobicContact CB-CD1 4.11Å
146	V	95.5	Very high	93.4	Very high	14 Å²	14	72.8 Å²	72.8	9%	0.085	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	102.6	-171.7	-174.4	0	0	0	0	110.8	R127 I129 L144 M148 T159 V160 L162	R127-V146 HydrophobicContact CB-CG1 3.95Å; R127-V146 HydrophobicContact CG-CG1 3.67Å; I129-V146 HydrophobicContact CD1-CG1 4.1Å; I129-V146 HydrophobicContact CD1-CG2 4.19Å; L144-V146 HydrophobicContact CB-CG2 3.96Å; V146-M148 HydrophobicContact CG1-CG 4.39Å; V146-M148 PolarHBondContact O-N 2.87Å; V146-T159 WeakPolarHBondContact O-CA 3.14Å; V146-V160 PolarHBondContact N-O 3.39Å; V146-V160 PolarHBondContact O-N 3.3Å; V146-L162 HydrophobicContact CG2-CD2 4.07Å; V146-L162 HydrophobicContact CG2-CG 4.28Å
147	V	96.7	Very high	93.6	Very high	84 Å²	84	74.2 Å²	74.2	51%	0.509	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	118.8	169.5	-174.5	0	0	0	0	109.8	R127 K145 T159	R127-V147 PolarHBondContact NH1-O 2.67Å; K145-V147 PolarHBondContact O-N 2.89Å; V147-T159 HydrophobicContact CG1-CG2 4.44Å; V147-T159 HydrophobicContact CG2-CG2 4.09Å
148	M	96.2	Very high	94.1	Very high	11 Å²	11	72.2 Å²	72.2	5%	0.054	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-93.5	151.2	-171.5	-52.2	-170	81.7	0	0	112.2	C99 I101 A125 R127 V146 A158 V160	C99-M148 WeakPolarHBondContact O-CE 3.49Å; I101-M148 HydrophobicContact CD1-CE 4.49Å; I101-M148 HydrophobicContact CD1-SD 3.42Å; I101-M148 WeakPolarHBondContact CD1-SD 3.44Å; I101-M148 HydrophobicContact CG1-CE 4.16Å; I101-M148 HydrophobicContact CG1-SD 3.69Å; A125-M148 HydrophobicContact CB-CB 3.81Å; A125-M148 HydrophobicContact CB-SD 4.3Å; R127-M148 HydrophobicContact CB-CE 4.36Å; R127-M148 HydrophobicContact CB-CG 4.41Å; V146-M148 HydrophobicContact CG1-CG 4.39Å; V146-M148 PolarHBondContact O-N 2.87Å; M148-A158 HydrophobicContact CB-CB 4.14Å; M148-A158 PolarHBondContact N-O 3Å; M148-V160 HydrophobicContact SD-CG2 3.64Å
149	R	95.9	Very high	94.4	Very high	137 Å²	137	69.1 Å²	69.1	52%	0.517	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.6	170.8	-61.6	-179.4	177.9	129.6	0.1	108.7	A125 T126 A151	A125-R149 CarbonylContact C-O 3.57Å; A125-R149 VanDerWaalsContact CA-O 3.24Å; A125-R149 WeakPolarHBondContact CA-O 3.43Å; A125-R149 WeakPolarHBondContact CB-O 3.49Å; T126-R149 PolarHBondContact N-O 2.84Å; T126-R149 WeakPolarHBondContact O-CA 3.37Å; T126-R149 WeakPolarHBondContact O-CB 3.3Å; T126-R149 PolarHBondContact O-N 2.85Å; R149-A151 PolarHBondContact O-N 2.74Å
150	L	95.6	Very high	94.6	Very high	82 Å²	82	64.9 Å²	64.9	43%	0.429	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121.3	179.8	-48.3	172	0	0	0	109.3	L155 I156 A158	L150-L155 HydrophobicContact CD2-CB 3.87Å; L150-I156 VanDerWaalsContact CD1-O 3.3Å; L150-I156 WeakPolarHBondContact CD1-O 3.3Å; L150-A158 HydrophobicContact CD2-CB 4.35Å
151	A	93.3	Very high	94.8	Very high	57 Å²	57	67.2 Å²	67.2	47%	0.471	34%	0.341	S	S	.	.	S	Bend	trans	-94.2	-20.4	173.7	0	0	0	0	0	111.6	V123 L124 T126 R149	V123-A151 HydrophobicContact CB-CB 4.37Å; V123-A151 HydrophobicContact CG1-CB 3.87Å; L124-A151 WeakPolarHBondContact O-CA 3.49Å; L124-A151 PolarHBondContact O-N 3.43Å; T126-A151 HydrophobicContact CG2-CB 4.4Å; R149-A151 PolarHBondContact O-N 2.74Å
152	S	92.1	Very high	94.9	Very high	28 Å²	28	60.6 Å²	60.6	20%	0.196	31%	0.31	C	S	.	.	S	Bend	trans	-120	137.3	177.5	-163.5	0	0	0	0	111.7	L124 K154 L155	L124-S152 PolarHBondContact O-N 2.84Å; S152-K154 PolarHBondContact O-N 3.1Å; S152-K154 WeakPolarHBondContact OG-CB 3.35Å; S152-K154 PolarHBondContact OG-N 3.46Å; S152-L155 PolarHBondContact O-N 3.19Å
153	K	91.2	Very high	94.9	Very high	207 Å²	207	59.8 Å²	59.8	90%	0.9	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-5.5	168.9	-60.9	-175.4	178.3	-175.3	0	113.8
154	K	90.5	Very high	95	Very high	65 Å²	65	53.8 Å²	53.8	28%	0.283	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-16.3	176.5	-72.3	-177.4	153.5	-150.9	0	113.9	C30 S31 Y34 S152	C30-K154 CarbonylContact C-O 3.43Å; C30-K154 WeakPolarHBondContact CA-O 3.37Å; S31-K154 PolarHBondContact N-O 3.22Å; Y34-K154 HydrophobicContact CD1-CB 3.55Å; Y34-K154 HydrophobicContact CD1-CD 4.1Å; Y34-K154 HydrophobicContact CD1-CG 4.24Å; Y34-K154 HydrophobicContact CD2-CD 3.68Å; Y34-K154 HydrophobicContact CD2-CG 4.41Å; Y34-K154 HydrophobicContact CE1-CB 3.94Å; Y34-K154 HydrophobicContact CE1-CD 4.18Å; Y34-K154 HydrophobicContact CE2-CD 3.79Å; Y34-K154 HydrophobicContact CG-CB 3.86Å; Y34-K154 HydrophobicContact CG-CD 3.8Å; Y34-K154 HydrophobicContact CG-CG 4.06Å; S152-K154 PolarHBondContact O-N 3.1Å; S152-K154 WeakPolarHBondContact OG-CB 3.35Å; S152-K154 PolarHBondContact OG-N 3.46Å
155	L	92	Very high	95.1	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	148.6	174.4	-65.6	-170.3	0	0	0	110.8	I28 E29 C30 Y34 L124 A125 L150 S152 A158	I28-L155 HydrophobicContact CB-CD2 4.29Å; I28-L155 HydrophobicContact CG2-CD1 4.44Å; E29-L155 CarbonylContact O-C 3.6Å; E29-L155 WeakPolarHBondContact O-CA 3.35Å; C30-L155 HydrophobicContact CB-CD2 4.39Å; C30-L155 WeakPolarHBondContact SG-CD2 3.29Å; Y34-L155 HydrophobicContact CE1-CD2 4.36Å; L124-L155 HydrophobicContact CB-CD1 3.63Å; L124-L155 HydrophobicContact CB-CG 4.17Å; L124-L155 HydrophobicContact CD1-CD1 4.36Å; L124-L155 HydrophobicContact CD1-CD2 4.48Å; A125-L155 HydrophobicContact CB-CD1 4.19Å; L150-L155 HydrophobicContact CD2-CB 3.87Å; S152-L155 PolarHBondContact O-N 3.19Å; L155-A158 HydrophobicContact CD1-CB 4.09Å
156	I	93.2	Very high	95	Very high	93 Å²	93	47 Å²	47	48%	0.477	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-42.1	172.2	-59.5	175.4	0	0	0	109.3	E29 C30 L150	E29-I156 HydrophobicContact CB-CB 4.17Å; E29-I156 HydrophobicContact CG-CB 3.98Å; E29-I156 HydrophobicContact CG-CD1 4.24Å; E29-I156 HydrophobicContact CG-CG2 4.4Å; E29-I156 PolarHBondContact O-N 2.95Å; E29-I156 WeakPolarHBondContact OE2-CG2 3.39Å; C30-I156 WeakPolarHBondContact O-CD1 3.45Å; L150-I156 VanDerWaalsContact CD1-O 3.3Å; L150-I156 WeakPolarHBondContact CD1-O 3.3Å
157	S	94	Very high	95	Very high	47 Å²	47	48.9 Å²	48.9	33%	0.329	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.1	176.4	67.9	0	0	0	0	111.6	I28 E29	I28-S157 WeakPolarHBondContact CA-O 3.3Å; E29-S157 WeakPolarHBondContact CB-OG 3.3Å; E29-S157 PolarHBondContact N-O 2.95Å; E29-S157 PolarHBondContact O-N 3.3Å; E29-S157 PolarHBondContact OE2-OG 3.35Å
158	A	95.9	Very high	94.9	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.017	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	124.3	176.7	0	0	0	0	0	111	N27 I28 I101 A125 M148 L150 L155	N27-A158 WeakPolarHBondContact O-CA 3.3Å; I28-A158 HydrophobicContact CG2-CB 4.1Å; I101-A158 HydrophobicContact CD1-CB 4.25Å; A125-A158 HydrophobicContact CB-CB 3.74Å; M148-A158 HydrophobicContact CB-CB 4.14Å; M148-A158 PolarHBondContact N-O 3Å; L150-A158 HydrophobicContact CD2-CB 4.35Å; L155-A158 HydrophobicContact CD1-CB 4.09Å
159	T	96.6	Very high	94.7	Very high	29 Å²	29	50.7 Å²	50.7	18%	0.178	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	134.4	178.4	65.9	0	0	0	0	110.8	N27 V146 V147	N27-T159 PolarHBondContact N-O 3.27Å; N27-T159 PolarHBondContact O-N 2.97Å; V146-T159 WeakPolarHBondContact O-CA 3.14Å; V147-T159 HydrophobicContact CG1-CG2 4.44Å; V147-T159 HydrophobicContact CG2-CG2 4.09Å
160	V	96.4	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.5	174.1	179	0	0	0	0	108.5	L23 E25 L26 I101 V146 M148 L162	L23-V160 HydrophobicContact CD2-CG1 4.16Å; E25-V160 CarbonylContact O-C 3.5Å; E25-V160 WeakPolarHBondContact O-CA 3.28Å; L26-V160 HydrophobicContact CD1-CG2 3.55Å; I101-V160 HydrophobicContact CD1-CG2 4.31Å; V146-V160 PolarHBondContact N-O 3.39Å; V146-V160 PolarHBondContact O-N 3.3Å; M148-V160 HydrophobicContact SD-CG2 3.64Å; V160-L162 HydrophobicContact CG1-CB 4.31Å; V160-L162 HydrophobicContact CG1-CD2 3.93Å
161	L	96.8	Very high	94.3	Very high	69 Å²	69	47.5 Å²	47.5	36%	0.361	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.8	166.3	-171.8	66.4	0	0	0	108.5	H24 E25 K145	H24-L161 HydrophobicContact CB-CD2 4.35Å; H24-L161 HydrophobicContact CB-CG 4.35Å; H24-L161 PolarHBondContact N-O 3.19Å; E25-L161 HydrophobicContact CB-CB 4Å; E25-L161 HydrophobicContact CB-CD2 4.43Å; E25-L161 PolarHBondContact N-O 3.14Å; E25-L161 PolarHBondContact O-N 3.05Å; K145-L161 HydrophobicContact CB-CD1 4.11Å
162	L	97.1	Very high	94.1	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155.7	179.3	67	87.8	0	0	0	111.2	S22 L23 W43 L144 V146 V160 L164	S22-L162 CarbonylContact O-C 3.56Å; S22-L162 WeakPolarHBondContact O-CA 3.45Å; S22-L162 VanDerWaalsContact O-CB 3.27Å; S22-L162 WeakPolarHBondContact O-CB 3.49Å; L23-L162 HydrophobicContact CD2-CB 4.02Å; L23-L162 HydrophobicContact CD2-CD2 4.21Å; W43-L162 HydrophobicContact CZ2-CD1 4.31Å; W43-L162 HydrophobicContact CZ2-CD2 3.81Å; L144-L162 HydrophobicContact CB-CD1 4.14Å; L144-L162 HydrophobicContact CB-CG 4.4Å; L144-L162 HydrophobicContact CD1-CD1 4.05Å; L144-L162 HydrophobicContact CG-CD1 4.46Å; L144-L162 PolarHBondContact N-O 3.3Å; L144-L162 PolarHBondContact O-N 3.41Å; V146-L162 HydrophobicContact CG2-CD2 4.07Å; V146-L162 HydrophobicContact CG2-CG 4.28Å; V160-L162 HydrophobicContact CG1-CB 4.31Å; V160-L162 HydrophobicContact CG1-CD2 3.93Å; L162-L164 HydrophobicContact CD1-CB 4.13Å
163	T	97.2	Very high	93.8	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.031	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.8	167.5	-55.3	0	0	0	0	109.2	A21 S22 H24 Q141 T142 N143	A21-T163 WeakPolarHBondContact CA-O 3.48Å; S22-T163 PolarHBondContact N-O 3.33Å; S22-T163 PolarHBondContact O-N 2.86Å; H24-T163 PolarHBondContact NE2-OG1 3.32Å; Q141-T163 HydrophobicContact CG-CG2 3.29Å; T142-T163 CarbonylContact O-C 3.52Å; T142-T163 WeakPolarHBondContact O-CA 3.24Å; N143-T163 WeakPolarHBondContact OD1-CB 3.45Å; N143-T163 WeakPolarHBondContact OD1-CG2 3.29Å; N143-T163 PolarHBondContact OD1-OG1 2.7Å
164	L	96.8	Very high	93.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109.9	176.7	-163.9	163.4	0	0	0	108.5	I19 W43 I131 F134 Q141 T142 L144 L162	I19-L164 HydrophobicContact CG2-CD1 4.5Å; I19-L164 HydrophobicContact CG2-CD2 3.68Å; I19-L164 HydrophobicContact CG2-CG 3.95Å; W43-L164 HydrophobicContact CH2-CD1 4.18Å; I131-L164 HydrophobicContact CD1-CD1 3.83Å; F134-L164 HydrophobicContact CB-CD1 4.32Å; F134-L164 HydrophobicContact CB-CD2 3.83Å; F134-L164 HydrophobicContact CD2-CD1 4.15Å; F134-L164 HydrophobicContact CG-CD1 4.28Å; Q141-L164 WeakPolarHBondContact CA-O 3.44Å; T142-L164 PolarHBondContact N-O 3.01Å; T142-L164 PolarHBondContact O-N 2.64Å; T142-L164 PolarHBondContact OG1-O 2.87Å; L144-L164 HydrophobicContact CD1-CB 3.85Å; L144-L164 HydrophobicContact CD1-CD1 3.98Å; L162-L164 HydrophobicContact CD1-CB 4.13Å
165	N	97	Very high	92.8	Very high	49 Å²	49	40.7 Å²	40.7	26%	0.262	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.6	172.4	-178.9	29	0	0	0	109.8	I19 T20 V140 Q141	I19-N165 WeakPolarHBondContact CA-O 3.4Å; T20-N165 PolarHBondContact N-O 3.42Å; T20-N165 PolarHBondContact O-N 2.7Å; V140-N165 CarbonylContact O-C 3.57Å; V140-N165 WeakPolarHBondContact O-CA 3.47Å; V140-N165 PolarHBondContact O-OD1 3.28Å; Q141-N165 HydrophobicContact CG-CB 4.41Å
166	S	95.9	Very high	92.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.2	179	171.9	0	0	0	0	110.6	F17 F134 V135 P139 V140	F17-S166 WeakPolarHBondContact CD1-OG 3.47Å; F134-S166 VanDerWaalsContact O-CB 3.24Å; F134-S166 WeakPolarHBondContact O-CB 3.5Å; V135-S166 VanDerWaalsContact CG1-OG 3.31Å; V135-S166 WeakPolarHBondContact CG1-OG 3.47Å; P139-S166 WeakPolarHBondContact CA-O 3.49Å; V140-S166 PolarHBondContact N-O 2.81Å; V140-S166 PolarHBondContact O-N 2.89Å
167	V	95.7	Very high	91.6	Very high	53 Å²	53	45.5 Å²	45.5	32%	0.321	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.5	176.2	-177.4	0	0	0	0	109.7	F17 Q18 P139	F17-V167 CarbonylContact C-O 3.55Å; F17-V167 VanDerWaalsContact CA-O 3.31Å; F17-V167 WeakPolarHBondContact CA-O 3.34Å; Q18-V167 PolarHBondContact N-O 3.12Å; Q18-V167 PolarHBondContact O-N 3.03Å; P139-V167 HydrophobicContact CB-CG2 4.36Å
168	I	93.8	Very high	90.7	Very high	49 Å²	49	47.2 Å²	47.2	25%	0.251	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	126.4	174.4	-164	168.1	0	0	0	110.2	A15 F17 A171	A15-I168 HydrophobicContact CB-CD1 3.86Å; A15-I168 HydrophobicContact CB-CG1 4.3Å; F17-I168 HydrophobicContact CD1-CB 4.06Å; F17-I168 HydrophobicContact CD1-CG1 4.39Å; F17-I168 HydrophobicContact CE1-CB 3.7Å; F17-I168 HydrophobicContact CE1-CD1 4.23Å; F17-I168 HydrophobicContact CE1-CG1 3.94Å; F17-I168 HydrophobicContact CZ-CD1 4.21Å; F17-I168 HydrophobicContact CZ-CG1 4.29Å; I168-A171 HydrophobicContact CD1-CB 4.15Å
169	V	92.6	Very high	90.1	Very high	83 Å²	83	47.1 Å²	47.1	50%	0.503	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-40.2	-179.1	179.4	0	0	0	0	111.1	K16 Q18	K16-V169 HydrophobicContact CB-CB 4.28Å; K16-V169 PolarHBondContact O-N 2.83Å; Q18-V169 HydrophobicContact CB-CG2 3.62Å
170	K	90.8	Very high	88.8	Confident	85 Å²	85	46.6 Å²	46.6	37%	0.37	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	135.9	177.7	-175	164	-179.6	161.2	0	110.4	A15 K16 D178 M179	A15-K170 CarbonylContact C-O 3.57Å; A15-K170 WeakPolarHBondContact CA-O 3.16Å; K16-K170 HydrophobicContact CB-CB 4.45Å; K16-K170 HydrophobicContact CD-CB 4.41Å; K16-K170 PolarHBondContact N-O 3.31Å; K16-K170 PolarHBondContact O-N 2.78Å; K170-D178 HydrophobicContact CD-CB 4.21Å; K170-D178 IonicContact NZ-OD2 3.53Å; K170-D178 PolarHBondContact NZ-OD2 3.48Å; K170-M179 HydrophobicContact CB-SD 4.31Å; K170-M179 HydrophobicContact CD-SD 4.27Å; K170-M179 HydrophobicContact CG-SD 3.93Å
171	A	91.1	Very high	87	Confident	67 Å²	67	47.8 Å²	47.8	55%	0.554	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	154.1	166.2	0	0	0	0	0	109.8	A14 I168	A14-A171 WeakPolarHBondContact O-CA 3.23Å; I168-A171 HydrophobicContact CD1-CB 4.15Å
172	G	89.5	Confident	85	Confident	22 Å²	22	50.3 Å²	50.3	23%	0.227	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	-170.7	179.4	0	0	0	0	0	112.5	A14 D176	A14-G172 PolarHBondContact N-O 2.82Å; A14-G172 PolarHBondContact O-N 2.87Å; G172-D176 WeakPolarHBondContact CA-OD2 3.28Å
173	E	86.1	Confident	82.9	Confident	119 Å²	119	51.8 Å²	51.8	56%	0.556	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	150.5	169.3	-57.9	-160.2	158.1	0	0	110.3	T175 D176 M179	E173-T175 WeakPolarHBondContact CB-OG1 3.33Å; E173-T175 PolarHBondContact O-N 2.76Å; E173-T175 VanDerWaalsContact O-N 3.15Å; E173-T175 PolarHBondContact OE2-OG1 3Å; E173-D176 PolarHBondContact N-OD2 2.96Å; E173-D176 WeakPolarHBondContact O-CB 3.37Å; E173-D176 PolarHBondContact O-N 3.5Å; E173-M179 VanDerWaalsContact O-CB 3.24Å; E173-M179 WeakPolarHBondContact O-CB 3.32Å; E173-M179 WeakPolarHBondContact O-CG 3.48Å
174	A	82.8	Confident	80.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-8	178.3	0	0	0	0	0	113.6	R9 K12 A14 Y84	R9-A174 HydrophobicContact CB-CB 3.72Å; R9-A174 VanDerWaalsContact CD-O 3.29Å; R9-A174 WeakPolarHBondContact CD-O 3.44Å; R9-A174 HydrophobicContact CG-CB 4.18Å; K12-A174 HydrophobicContact CB-CB 3.99Å; K12-A174 WeakPolarHBondContact O-CB 3.21Å; K12-A174 PolarHBondContact O-N 2.8Å; A14-A174 HydrophobicContact CB-CB 4.09Å; Y84-A174 HydrophobicContact CD1-CB 3.59Å; Y84-A174 HydrophobicContact CE1-CB 3.63Å
175	T	78.7	Confident	78.6	Confident	73 Å²	73	57.1 Å²	57.1	45%	0.448	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-21.8	173.9	26	0	0	0	0	113.8	E173	E173-T175 WeakPolarHBondContact CB-OG1 3.33Å; E173-T175 PolarHBondContact O-N 2.76Å; E173-T175 VanDerWaalsContact O-N 3.15Å; E173-T175 PolarHBondContact OE2-OG1 3Å
176	D	81.7	Confident	76.3	Confident	62 Å²	62	60.5 Å²	60.5	33%	0.332	34%	0.336	S	S	.	.	S	Bend	trans	-60.9	135.6	-180	-61.4	-20.9	0	0	0	111	G172 E173 D178 M179 I180	G172-D176 WeakPolarHBondContact CA-OD2 3.28Å; E173-D176 PolarHBondContact N-OD2 2.96Å; E173-D176 WeakPolarHBondContact O-CB 3.37Å; E173-D176 PolarHBondContact O-N 3.5Å; D176-D178 PolarHBondContact O-N 2.83Å; D176-M179 HydrophobicContact CB-CB 4.05Å; D176-M179 HydrophobicContact CB-CG 3.77Å; D176-M179 WeakPolarHBondContact O-CA 3.37Å; D176-M179 PolarHBondContact O-N 2.86Å; D176-I180 WeakPolarHBondContact O-CG1 3.45Å; D176-I180 PolarHBondContact O-N 2.89Å
177	E	77.3	Confident	74	Confident	140 Å²	140	62.7 Å²	62.7	65%	0.654	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-36.9	-178.1	-173.3	56.3	-151.3	0	0	112	M179 I180	E177-M179 VanDerWaalsContact C-N 3.34Å; E177-M179 PolarHBondContact O-N 3.46Å; E177-I180 WeakPolarHBondContact O-CB 3.16Å; E177-I180 PolarHBondContact O-N 2.78Å
178	D	75.5	Confident	71.6	Confident	83 Å²	83	63.5 Å²	63.5	44%	0.444	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-42.4	171.9	-95.5	-48.8	0	0	0	113	K16 K170 D176 I180	K16-D178 WeakPolarHBondContact CE-O 3.47Å; K16-D178 PolarHBondContact NZ-O 2.8Å; K16-D178 IonicContact NZ-OD1 3.23Å; K170-D178 HydrophobicContact CD-CB 4.21Å; K170-D178 IonicContact NZ-OD2 3.53Å; K170-D178 PolarHBondContact NZ-OD2 3.48Å; D176-D178 PolarHBondContact O-N 2.83Å; D178-I180 VanDerWaalsContact C-N 3.25Å; D178-I180 PolarHBondContact O-N 2.91Å
179	M	83.5	Confident	69.4	Low	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-17.5	-175.3	-57.9	-49.4	-70.6	0	0	111.9	A14 K16 T82 Y84 K170 E173 D176 E177 S181	A14-M179 HydrophobicContact CB-CB 3.87Å; A14-M179 HydrophobicContact CB-CE 3.49Å; A14-M179 VanDerWaalsContact CB-CE 3.49Å; A14-M179 HydrophobicContact CB-CG 4.26Å; A14-M179 VanDerWaalsContact O-CE 3.3Å; A14-M179 WeakPolarHBondContact O-CE 3.37Å; K16-M179 HydrophobicContact CD-SD 4.45Å; K16-M179 HydrophobicContact CG-CE 4.15Å; K16-M179 HydrophobicContact CG-SD 4.21Å; T82-M179 HydrophobicContact CG2-CE 3.88Å; T82-M179 WeakPolarHBondContact CG2-O 3.37Å; Y84-M179 PolarHBondContact OH-O 3.36Å; K170-M179 HydrophobicContact CB-SD 4.31Å; K170-M179 HydrophobicContact CD-SD 4.27Å; K170-M179 HydrophobicContact CG-SD 3.93Å; E173-M179 VanDerWaalsContact O-CB 3.24Å; E173-M179 WeakPolarHBondContact O-CB 3.32Å; E173-M179 WeakPolarHBondContact O-CG 3.48Å; D176-M179 HydrophobicContact CB-CB 4.05Å; D176-M179 HydrophobicContact CB-CG 3.77Å; D176-M179 WeakPolarHBondContact O-CA 3.37Å; D176-M179 PolarHBondContact O-N 2.86Å; E177-M179 VanDerWaalsContact C-N 3.34Å; E177-M179 PolarHBondContact O-N 3.46Å; M179-S181 PolarHBondContact O-N 2.78Å
180	I	68.1	Low	67.4	Low	18 Å²	18	71 Å²	71	9%	0.092	38%	0.383	C	S	.	.	S	Bend	trans	-70	108.3	165.2	-64.8	172.8	0	0	0	108.9	M1 D176 E177 D178 I182	M1-I180 HydrophobicContact CE-CG2 3.65Å; D176-I180 WeakPolarHBondContact O-CG1 3.45Å; D176-I180 PolarHBondContact O-N 2.89Å; E177-I180 WeakPolarHBondContact O-CB 3.16Å; E177-I180 PolarHBondContact O-N 2.78Å; D178-I180 VanDerWaalsContact C-N 3.25Å; D178-I180 PolarHBondContact O-N 2.91Å; I180-I182 PolarHBondContact O-N 2.6Å; I180-I182 VanDerWaalsContact O-N 3.09Å
181	S	59.6	Low	65.2	Low	26 Å²	26	72.5 Å²	72.5	18%	0.182	40%	0.4	C	S	.	.			trans	-61	119.9	179.1	-45	0	0	0	0	111.2	T82 M179 A183 S184	T82-S181 PolarHBondContact OG1-OG 2.85Å; T82-S181 VanDerWaalsContact OG1-OG 3.1Å; M179-S181 PolarHBondContact O-N 2.78Å; S181-A183 PolarHBondContact O-N 3.39Å; S181-S184 WeakPolarHBondContact O-CA 3.5Å; S181-S184 WeakPolarHBondContact O-CB 3.35Å; S181-S184 PolarHBondContact O-N 2.82Å; S181-S184 PolarHBondContact O-OG 3.45Å
182	I	55.3	Low	62.7	Low	121 Å²	121	71.7 Å²	71.7	62%	0.621	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-50	-33.6	175.2	-61.4	168.2	0	0	0	112.3	I180 S184 L185 M186	I180-I182 PolarHBondContact O-N 2.6Å; I180-I182 VanDerWaalsContact O-N 3.09Å; I182-S184 PolarHBondContact O-N 2.93Å; I182-S184 VanDerWaalsContact O-N 3.1Å; I182-L185 WeakPolarHBondContact O-CA 3.23Å; I182-L185 WeakPolarHBondContact O-CB 3.48Å; I182-L185 PolarHBondContact O-N 3.43Å; I182-M186 HydrophobicContact CG2-CG 4.44Å; I182-M186 PolarHBondContact O-N 2.86Å; I182-M186 VanDerWaalsContact O-N 3.09Å
183	A	52.7	Low	60.2	Low	33 Å²	33	75.8 Å²	75.8	27%	0.273	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-57.8	-23.9	173	0	0	0	0	0	114.2	S181 S187	S181-A183 PolarHBondContact O-N 3.39Å; A183-S187 PolarHBondContact O-N 3.38Å; A183-S187 PolarHBondContact O-OG 3.15Å
184	S	53	Low	57.9	Low	14 Å²	14	78.8 Å²	78.8	10%	0.098	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-75.9	-24.3	172.2	-54.7	0	0	0	0	113	S181 I182	S181-S184 WeakPolarHBondContact O-CA 3.5Å; S181-S184 WeakPolarHBondContact O-CB 3.35Å; S181-S184 PolarHBondContact O-N 2.82Å; S181-S184 PolarHBondContact O-OG 3.45Å; I182-S184 PolarHBondContact O-N 2.93Å; I182-S184 VanDerWaalsContact O-N 3.1Å
185	L	50.3	Low	55.8	Low	103 Å²	103	85.6 Å²	85.6	54%	0.539	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-52.2	172.7	-158.9	72.8	0	0	0	109.3	I182 S187 L188	I182-L185 WeakPolarHBondContact O-CA 3.23Å; I182-L185 WeakPolarHBondContact O-CB 3.48Å; I182-L185 PolarHBondContact O-N 3.43Å; L185-S187 PolarHBondContact O-N 3.19Å; L185-L188 PolarHBondContact O-N 3.44Å
186	M	48.4	Very low	54	Low	120 Å²	120	89.1 Å²	89.1	59%	0.591	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-0.8	176.6	-54.7	-168.6	103.4	0	0	115.1	I182 L188 S189	I182-M186 HydrophobicContact CG2-CG 4.44Å; I182-M186 PolarHBondContact O-N 2.86Å; I182-M186 VanDerWaalsContact O-N 3.09Å; M186-L188 VanDerWaalsContact C-N 3.27Å; M186-S189 PolarHBondContact O-OG 3.47Å
187	S	47.9	Very low	51.7	Low	45 Å²	45	89.4 Å²	89.4	32%	0.315	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-5.8	171.1	-64.7	0	0	0	0	113.3	A183 L185	A183-S187 PolarHBondContact O-N 3.38Å; A183-S187 PolarHBondContact O-OG 3.15Å; L185-S187 PolarHBondContact O-N 3.19Å
188	L	44.2	Very low	49.8	Very low	70 Å²	70	88.4 Å²	88.4	37%	0.366	52%	0.518	S	S	.	.	S	Bend	trans	-99.5	-29.9	-178.1	-63.7	158.7	0	0	0	112.3	M1 L185 M186 R190 T191	M1-L188 HydrophobicContact CB-CD1 4.41Å; M1-L188 VanDerWaalsContact N-CD1 3.25Å; L185-L188 PolarHBondContact O-N 3.44Å; M186-L188 VanDerWaalsContact C-N 3.27Å; L188-R190 PolarHBondContact O-N 2.88Å; L188-R190 VanDerWaalsContact O-N 3.13Å; L188-T191 PolarHBondContact O-N 3.22Å; L188-T191 VanDerWaalsContact O-N 3.13Å; L188-T191 PolarHBondContact O-OG1 2.94Å
189	S	48.4	Very low	47.7	Very low	90 Å²	90	88.2 Å²	88.2	63%	0.629	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-7.8	-179.6	49.1	0	0	0	0	114.3	M186	M186-S189 PolarHBondContact O-OG 3.47Å
190	R	50	Low	45.6	Very low	201 Å²	201	94.4 Å²	94.4	76%	0.758	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	0.9	173.9	-56.9	-174.3	-160.6	-122	-1	113.9	L188	L188-R190 PolarHBondContact O-N 2.88Å; L188-R190 VanDerWaalsContact O-N 3.13Å
191	T	45.4	Very low	44.3	Very low	116 Å²	116	99.7 Å²	99.7	71%	0.712	61%	0.606	S	S	*	*	S	Bend	trans	-124.8	19	179.8	62.8	0	0	0	0	112.5	L188	L188-T191 PolarHBondContact O-N 3.22Å; L188-T191 VanDerWaalsContact O-N 3.13Å; L188-T191 PolarHBondContact O-OG1 2.94Å
192	G	37.8	Very low	43.4	Very low	49 Å²	49	106.2 Å²	106.2	51%	0.505	64%	0.637	S	S	.	*			trans	-118.2	-3.8	-173.2	0	0	0	0	0	115.9	F194	G192-F194 VanDerWaalsContact C-N 3.35Å; G192-F194 PolarHBondContact O-N 3.45Å
193	S	37.9	Very low	42.9	Very low	109 Å²	109	106.5 Å²	106.5	76%	0.762	64%	0.64	S	S	*	*			trans	-92.9	63	178.3	-174.8	0	0	0	0	111.4	N195	S193-N195 PolarHBondContact O-N 3.15Å; S193-N195 VanDerWaalsContact O-N 3.12Å
194	F	37.2	Very low	42.2	Very low	182 Å²	182	111.7 Å²	111.7	80%	0.798	66%	0.663	S	S	*	*			trans	-82.1	61.7	161.9	56.3	-84.8	0	0	0	109.2	G192 V196	G192-F194 VanDerWaalsContact C-N 3.35Å; G192-F194 PolarHBondContact O-N 3.45Å; F194-V196 PolarHBondContact O-N 3.49Å
195	N	39.8	Very low	41.5	Very low	143 Å²	143	119 Å²	119	77%	0.765	70%	0.7	S	S	*	*			trans	-71.1	119	172.6	-139.8	44.8	0	0	0	107.8	S193 G197	S193-N195 PolarHBondContact O-N 3.15Å; S193-N195 VanDerWaalsContact O-N 3.12Å; N195-G197 PolarHBondContact O-N 2.97Å; N195-G197 VanDerWaalsContact O-N 3.14Å
196	V	39.7	Very low	40.6	Very low	147 Å²	147	118 Å²	118	89%	0.891	71%	0.714	S	S	*	*	S	Bend	trans	-63.3	113.5	175.2	174.3	0	0	0	0	107.7	F194	F194-V196 PolarHBondContact O-N 3.49Å
197	G	34.3	Very low	39.9	Very low	67 Å²	67	115.5 Å²	115.5	69%	0.691	72%	0.719	S	S	*	*	S	Bend	trans	124.3	62.9	179.3	0	0	0	0	0	115.4	N195	N195-G197 PolarHBondContact O-N 2.97Å; N195-G197 VanDerWaalsContact O-N 3.14Å
198	S	36.6	Very low	39.4	Very low	120 Å²	120	120.2 Å²	120.2	84%	0.839	75%	0.746	S	S	*	*			trans	170.1	93.7	142.5	-100.9	0	0	0	0	109.1
199	G	32.3	Very low	39	Very low	79 Å²	79	121.1 Å²	121.1	81%	0.814	76%	0.764	S	S	*	*			trans	-79.7	120.1	174.6	0	0	0	0	0	111.4
200	V	39.4	Very low	38.5	Very low	129 Å²	129	120.6 Å²	120.6	78%	0.782	76%	0.764	S	S	*	*			trans	-136.3	97.4	153.4	-177	0	0	0	0	108.1	I202	V200-I202 HydrophobicContact CG1-CG1 4.28Å
201	T	40.6	Very low	37.9	Very low	130 Å²	130	120.7 Å²	120.7	80%	0.798	77%	0.771	S	S	*	*			trans	-79.8	113.8	168.5	45.5	0	0	0	0	109	N203	T201-N203 VanDerWaalsContact C-N 3.29Å; T201-N203 PolarHBondContact O-N 3.34Å; T201-N203 VanDerWaalsContact O-N 3.15Å
202	I	41.5	Very low	37.3	Very low	162 Å²	162	120 Å²	120	83%	0.831	77%	0.771	S	S	*	*			trans	-87.4	79.7	168.3	-55.6	-179.5	0	0	0	108.1	V200	V200-I202 HydrophobicContact CG1-CG1 4.28Å
203	N	42.8	Very low	37.4	Very low	128 Å²	128	123.4 Å²	123.4	68%	0.684	78%	0.784	S	S	*	*			trans	-138.1	130.6	160.9	-122.7	78.1	0	0	0	107	T201	T201-N203 VanDerWaalsContact C-N 3.29Å; T201-N203 PolarHBondContact O-N 3.34Å; T201-N203 VanDerWaalsContact O-N 3.15Å
204	D	39.1	Very low	37.2	Very low	142 Å²	142	124.5 Å²	124.5	76%	0.759	79%	0.786	S	S	*	*	S	Bend	trans	67.5	122.8	168.9	-63.1	-59.6	0	0	0	120.7
205	L	38.2	Very low	37.5	Very low	168 Å²	168	122.6 Å²	122.6	88%	0.88	79%	0.79	S	S	*	*			trans	69.6	94.3	131.4	-154.8	71	0	0	0	120.1
206	G	32.2	Very low	37.4	Very low	80 Å²	80	119.9 Å²	119.9	83%	0.825	79%	0.787	S	S	*	*				61.8	115.7	124.3	0	0	0	0	0	120.8
207	G	32.7	Very low	37.1	Very low	68 Å²	68	123.9 Å²	123.9	70%	0.701	79%	0.786	S	S	*	*			trans	126.6	125	144.7	0	0	0	0	0	117.2
208	V	36.7	Very low	37.3	Very low	145 Å²	145	128.9 Å²	128.9	88%	0.879	80%	0.796	S	S	*	*			trans	60.3	131	146.8	-59	0	0	0	0	122.3
209	A	36.8	Very low	37.2	Very low	89 Å²	89	127.1 Å²	127.1	74%	0.736	79%	0.789	S	S	*	*			trans	59.7	118.4	152.2	0	0	0	0	0	118.4
210	A	37.2	Very low	37.5	Very low	78 Å²	78	132.3 Å²	132.3	65%	0.645	79%	0.792	S	S	*	*				59.3	130.5	91.2	0	0	0	0	0	113
211	F	38.2	Very low	37.5	Very low	203 Å²	203	130.9 Å²	130.9	89%	0.89	78%	0.784	S	S	*	*			cis	-149	167	39	-69.2	-94.6	0	0	0	113
212	S	32.3	Very low	37.2	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	78%	0.782	S	S	*	*			trans	-120.8	142.5	159.8	171.3	0	0	0	0	108.7
213	P	40.7	Very low	37.1	Very low	121 Å²	121	130.8 Å²	130.8	79%	0.786	78%	0.78	S	S	*	*			trans	-109.8	120.9	159.5	31.9	-20.7	0	0	0	110.9
214	T	34	Very low	36.9	Very low	131 Å²	131	133.6 Å²	133.6	80%	0.804	79%	0.786	S	S	*	*			trans	-90	136.7	162	-52.7	0	0	0	0	108.2
215	T	41.6	Very low	36.7	Very low	143 Å²	143	133.8 Å²	133.8	88%	0.877	79%	0.787	S	S	*	*			trans	-152.3	150.6	155.4	-17.6	0	0	0	0	109.9
216	A	38	Very low	36.5	Very low	85 Å²	85	130.4 Å²	130.4	70%	0.702	78%	0.778	S	S	*	*			trans	-120.1	177.9	-163.5	0	0	0	0	0	112.4
217	R	34.8	Very low	36.8	Very low	232 Å²	232	134.4 Å²	134.4	88%	0.875	78%	0.775	S	S	*	*			trans	98.1	142.2	144.3	-101.5	-178.2	-174.3	-177.9	1.7	120
218	L	38.4	Very low	36.9	Very low	171 Å²	171	136.4 Å²	136.4	90%	0.895	78%	0.778	S	S	*	*			trans	90.4	140.2	155.8	-67	155.8	0	0	0	117.3
219	A	33.9	Very low	37	Very low	84 Å²	84	138.2 Å²	138.2	69%	0.694	77%	0.774	S	S	*	*			trans	-112.8	157.3	-170.4	0	0	0	0	0	109.6
220	H	38.8	Very low	37	Very low	187 Å²	187	138.3 Å²	138.3	87%	0.866	77%	0.769	S	S	*	*			trans	-157.6	154.6	138.9	-113.1	-76.9	0	0	0	111.8
221	T	39.6	Very low	37.2	Very low	100 Å²	100	140.9 Å²	140.9	61%	0.613	77%	0.772	S	S	*	*			trans	-48	145.6	180	42.5	0	0	0	0	117.6
222	D	34.3	Very low	37.5	Very low	142 Å²	142	135 Å²	135	76%	0.759	76%	0.756	S	S	*	*			trans	41.1	117.7	134.8	-46	-34.1	0	0	0	120
223	D	38.3	Very low	38.3	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	75%	0.748	S	S	*	*				-171.7	164.9	105.8	-110.1	-28.2	0	0	0	114.9
224	F	39.2	Very low	38.5	Very low	187 Å²	187	136 Å²	136	82%	0.82	74%	0.743	S	S	*	*			trans	-53.7	136.6	-178.1	-62.3	-106.2	0	0	0	115.5
225	N	35.1	Very low	39.2	Very low	147 Å²	147	137 Å²	137	79%	0.786	74%	0.738	S	S	*	*				-168.4	157.2	104.3	-122.9	-37.3	0	0	0	115.7
226	S	33.7	Very low	40.1	Very low	97 Å²	97	133.9 Å²	133.9	68%	0.678	72%	0.719	S	S	*	*			trans	-83.8	129.3	-177	56.3	0	0	0	0	113.9
227	H	37.6	Very low	41.4	Very low	164 Å²	164	134.5 Å²	134.5	76%	0.759	71%	0.711	S	S	*	*			trans	-129.5	98.4	157.9	-79.3	-64.8	0	0	0	111.6	F229	H227-F229 HydrophobicContact CB-CE2 4.11Å; H227-F229 PolarHBondContact O-N 3.38Å
228	S	35.4	Very low	42.9	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	70%	0.698	S	S	*	*			trans	-71.8	106.2	166.9	167.4	0	0	0	0	109.7	S230	S228-S230 PolarHBondContact O-N 3.4Å
229	F	40	Very low	44.6	Very low	184 Å²	184	123.9 Å²	123.9	81%	0.807	68%	0.677	S	S	*	*			trans	-81.5	111.5	168.3	-78.7	-80.8	0	0	0	110.6	H227 N231	H227-F229 HydrophobicContact CB-CE2 4.11Å; H227-F229 PolarHBondContact O-N 3.38Å; F229-N231 PolarHBondContact O-N 3.04Å
230	S	36.3	Very low	46.4	Very low	90 Å²	90	124.4 Å²	124.4	63%	0.629	67%	0.665	S	S	*	*			trans	-66.6	112.3	-175.3	-54	0	0	0	0	112.6	S228 S232	S228-S230 PolarHBondContact O-N 3.4Å; S230-S232 PolarHBondContact O-N 2.97Å
231	N	40.7	Very low	47.9	Very low	132 Å²	132	120.6 Å²	120.6	71%	0.706	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	21.3	172.2	-82.1	-33.3	0	0	0	113.9	F229 T233	F229-N231 PolarHBondContact O-N 3.04Å; N231-T233 PolarHBondContact O-N 2.79Å
232	S	44.9	Very low	49.5	Very low	79 Å²	79	118.8 Å²	118.8	55%	0.552	64%	0.639	S	S	*	*	H	α-helix	trans	-73.3	-18.3	-167	48.5	0	0	0	0	115	S230 T236	S230-S232 PolarHBondContact O-N 2.97Å; S232-T236 PolarHBondContact O-OG1 3.38Å
233	T	48.3	Very low	51.3	Low	91 Å²	91	114.6 Å²	114.6	56%	0.558	63%	0.625	S	S	*	*	H	α-helix	trans	-78.4	-33.9	-176.8	-33.3	0	0	0	0	113	N231 H235 T236 D237	N231-T233 PolarHBondContact O-N 2.79Å; T233-H235 VanDerWaalsContact C-N 3.31Å; T233-H235 PolarHBondContact O-N 3.01Å; T233-T236 PolarHBondContact O-N 3.23Å; T233-D237 PolarHBondContact O-N 3.04Å
234	F	45.6	Very low	53	Low	153 Å²	153	112.9 Å²	112.9	67%	0.671	61%	0.61	S	S	*	*	H	α-helix	trans	-68.3	-27.5	-175.3	-65.4	-71.6	0	0	0	113.9	L238	F234-L238 WeakPolarHBondContact O-CB 3.29Å; F234-L238 PolarHBondContact O-N 2.88Å
235	H	48.7	Very low	54.3	Low	153 Å²	153	109.1 Å²	109.1	71%	0.708	60%	0.598	S	S	*	*	H	α-helix	trans	-79.1	-31.4	-179.3	-144.4	-78.5	0	0	0	111.9	T233 S239	T233-H235 VanDerWaalsContact C-N 3.31Å; T233-H235 PolarHBondContact O-N 3.01Å; H235-S239 WeakPolarHBondContact O-CB 3.44Å; H235-S239 PolarHBondContact O-N 3.36Å; H235-S239 PolarHBondContact O-OG 3.16Å
236	T	60.1	Low	55.8	Low	78 Å²	78	108.1 Å²	108.1	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-65.6	-53.6	176.6	-31.8	0	0	0	0	110.3	S232 T233 L238 S239 E240	S232-T236 PolarHBondContact O-OG1 3.38Å; T233-T236 PolarHBondContact O-N 3.23Å; T236-L238 VanDerWaalsContact C-N 3.32Å; T236-L238 PolarHBondContact O-N 3.34Å; T236-S239 PolarHBondContact O-N 2.69Å; T236-S239 VanDerWaalsContact O-N 3.1Å; T236-S239 PolarHBondContact O-OG 2.87Å; T236-E240 PolarHBondContact O-N 2.85Å
237	D	65.5	Low	57.1	Low	98 Å²	98	106.8 Å²	106.8	52%	0.524	58%	0.579	S	S	.	*	H	α-helix	trans	-60.2	-40.5	-179.3	-67.8	-2.3	0	0	0	112.3	T233 E240 L241	T233-D237 PolarHBondContact O-N 3.04Å; D237-E240 PolarHBondContact O-N 3.03Å; D237-L241 VanDerWaalsContact O-CB 3.29Å; D237-L241 WeakPolarHBondContact O-CB 3.34Å; D237-L241 PolarHBondContact O-N 2.93Å
238	L	67.1	Low	57.7	Low	114 Å²	114	105 Å²	105	60%	0.597	58%	0.575	S	S	*	*	H	α-helix	trans	-68.8	-37.7	177.8	-144	175.8	0	0	0	111.2	F234 T236 T242	F234-L238 WeakPolarHBondContact O-CB 3.29Å; F234-L238 PolarHBondContact O-N 2.88Å; T236-L238 VanDerWaalsContact C-N 3.32Å; T236-L238 PolarHBondContact O-N 3.34Å; L238-T242 VanDerWaalsContact O-CB 3.3Å; L238-T242 WeakPolarHBondContact O-CB 3.37Å; L238-T242 PolarHBondContact O-N 3.13Å; L238-T242 PolarHBondContact O-OG1 3.36Å
239	S	72.9	Confident	58.4	Low	65 Å²	65	108 Å²	108	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-66.7	-40.4	173.9	75.5	0	0	0	0	112.1	H235 T236 T242 A243	H235-S239 WeakPolarHBondContact O-CB 3.44Å; H235-S239 PolarHBondContact O-N 3.36Å; H235-S239 PolarHBondContact O-OG 3.16Å; T236-S239 PolarHBondContact O-N 2.69Å; T236-S239 VanDerWaalsContact O-N 3.1Å; T236-S239 PolarHBondContact O-OG 2.87Å; S239-T242 PolarHBondContact O-N 2.88Å; S239-A243 WeakPolarHBondContact O-CB 3.3Å; S239-A243 PolarHBondContact O-N 3.36Å
240	E	72.3	Confident	58.7	Low	95 Å²	95	109.5 Å²	109.5	44%	0.444	58%	0.577	S	S	.	*	H	α-helix	trans	-68.6	-39.8	178.2	-162.9	-169.2	141.3	0	0	111.6	T236 D237 A243 K244	T236-E240 PolarHBondContact O-N 2.85Å; D237-E240 PolarHBondContact O-N 3.03Å; E240-A243 PolarHBondContact O-N 2.85Å; E240-K244 HydrophobicContact CG-CD 4.43Å; E240-K244 WeakPolarHBondContact O-CB 3.28Å; E240-K244 VanDerWaalsContact O-CG 3.3Å; E240-K244 WeakPolarHBondContact O-CG 3.41Å; E240-K244 PolarHBondContact O-N 3.29Å; E240-K244 VanDerWaalsContact OE1-CE 3.24Å; E240-K244 WeakPolarHBondContact OE1-CE 3.3Å; E240-K244 IonicContact OE1-NZ 2.57Å; E240-K244 PolarHBondContact OE1-NZ 2.93Å
241	L	69.8	Low	58.9	Low	108 Å²	108	115.2 Å²	115.2	57%	0.565	58%	0.584	S	S	*	*	H	α-helix	trans	-70	-34.5	176.3	-148.8	157.4	0	0	0	111.3	D237 K244 L245	D237-L241 VanDerWaalsContact O-CB 3.29Å; D237-L241 WeakPolarHBondContact O-CB 3.34Å; D237-L241 PolarHBondContact O-N 2.93Å; L241-K244 PolarHBondContact O-N 3.48Å; L241-L245 HydrophobicContact CD2-CD1 3.95Å; L241-L245 HydrophobicContact CD2-CG 4.31Å; L241-L245 WeakPolarHBondContact O-CG 3.33Å; L241-L245 PolarHBondContact O-N 3.32Å
242	T	73.6	Confident	58.8	Low	62 Å²	62	116.4 Å²	116.4	38%	0.38	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-44.3	171.9	-57.3	0	0	0	0	111.6	L238 S239 L245 Q246	L238-T242 VanDerWaalsContact O-CB 3.3Å; L238-T242 WeakPolarHBondContact O-CB 3.37Å; L238-T242 PolarHBondContact O-N 3.13Å; L238-T242 PolarHBondContact O-OG1 3.36Å; S239-T242 PolarHBondContact O-N 2.88Å; T242-L245 PolarHBondContact O-N 2.92Å; T242-Q246 PolarHBondContact O-N 3.08Å
243	A	72.2	Confident	58.6	Low	54 Å²	54	120.8 Å²	120.8	45%	0.446	60%	0.601	S	S	.	*	H	α-helix	trans	-63.3	-40.7	174.8	0	0	0	0	0	111.8	S239 E240 L245 Q246 S247	S239-A243 WeakPolarHBondContact O-CB 3.3Å; S239-A243 PolarHBondContact O-N 3.36Å; E240-A243 PolarHBondContact O-N 2.85Å; A243-L245 PolarHBondContact O-N 2.9Å; A243-Q246 PolarHBondContact O-N 3.12Å; A243-S247 WeakPolarHBondContact O-CB 3.5Å; A243-S247 PolarHBondContact O-N 3.2Å
244	K	74.9	Confident	58.1	Low	110 Å²	110	122.3 Å²	122.3	48%	0.478	61%	0.606	S	S	.	*	H	α-helix	trans	-60.1	-43.7	172.8	-80	167.3	171.7	168.5	0	111.7	E240 L241 S247 L248	E240-K244 HydrophobicContact CG-CD 4.43Å; E240-K244 WeakPolarHBondContact O-CB 3.28Å; E240-K244 VanDerWaalsContact O-CG 3.3Å; E240-K244 WeakPolarHBondContact O-CG 3.41Å; E240-K244 PolarHBondContact O-N 3.29Å; E240-K244 VanDerWaalsContact OE1-CE 3.24Å; E240-K244 WeakPolarHBondContact OE1-CE 3.3Å; E240-K244 IonicContact OE1-NZ 2.57Å; E240-K244 PolarHBondContact OE1-NZ 2.93Å; L241-K244 PolarHBondContact O-N 3.48Å; K244-S247 PolarHBondContact O-N 3.29Å; K244-S247 PolarHBondContact O-OG 3.05Å; K244-L248 PolarHBondContact O-N 2.76Å; K244-L248 VanDerWaalsContact O-N 3.14Å
245	L	66.1	Low	57.5	Low	109 Å²	109	121 Å²	121	57%	0.571	61%	0.613	S	S	*	*	H	α-helix	trans	-64.5	-43.7	175.4	-74.2	170.1	0	0	0	112.7	L241 T242 A243 S247 L248 E249	L241-L245 HydrophobicContact CD2-CD1 3.95Å; L241-L245 HydrophobicContact CD2-CG 4.31Å; L241-L245 WeakPolarHBondContact O-CG 3.33Å; L241-L245 PolarHBondContact O-N 3.32Å; T242-L245 PolarHBondContact O-N 2.92Å; A243-L245 PolarHBondContact O-N 2.9Å; L245-S247 VanDerWaalsContact C-N 3.29Å; L245-S247 PolarHBondContact O-N 3.14Å; L245-L248 WeakPolarHBondContact O-CB 3.42Å; L245-L248 PolarHBondContact O-N 2.79Å; L245-E249 PolarHBondContact O-N 3.35Å
246	Q	65.9	Low	57.1	Low	125 Å²	125	121.2 Å²	121.2	58%	0.584	62%	0.618	S	S	*	*	H	α-helix	trans	-65.1	-31	174.6	-72.9	-179.2	-23.9	0	0	112.8	T242 A243 L248 E249	T242-Q246 PolarHBondContact O-N 3.08Å; A243-Q246 PolarHBondContact O-N 3.12Å; Q246-L248 VanDerWaalsContact C-N 3.33Å; Q246-E249 PolarHBondContact O-N 2.92Å
247	S	60.5	Low	56.2	Low	69 Å²	69	123 Å²	123	48%	0.483	63%	0.629	S	S	.	*	H	α-helix	trans	-70.4	-27.9	174.6	79	0	0	0	0	113.2	A243 K244 L245	A243-S247 WeakPolarHBondContact O-CB 3.5Å; A243-S247 PolarHBondContact O-N 3.2Å; K244-S247 PolarHBondContact O-N 3.29Å; K244-S247 PolarHBondContact O-OG 3.05Å; L245-S247 VanDerWaalsContact C-N 3.29Å; L245-S247 PolarHBondContact O-N 3.14Å
248	L	50.9	Low	54.6	Low	127 Å²	127	126.8 Å²	126.8	67%	0.665	64%	0.643	S	S	*	*	H	α-helix	trans	-76.3	-22.7	175.3	-95.8	145.5	0	0	0	113	K244 L245 Q246 R250	K244-L248 PolarHBondContact O-N 2.76Å; K244-L248 VanDerWaalsContact O-N 3.14Å; L245-L248 WeakPolarHBondContact O-CB 3.42Å; L245-L248 PolarHBondContact O-N 2.79Å; Q246-L248 VanDerWaalsContact C-N 3.33Å; L248-R250 VanDerWaalsContact C-N 3.28Å; L248-R250 PolarHBondContact O-N 2.96Å
249	E	51.1	Low	53.1	Low	171 Å²	171	127 Å²	127	80%	0.799	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-2.6	175.3	-158.8	164.6	-155.7	0	0	113	L245 Q246	L245-E249 PolarHBondContact O-N 3.35Å; Q246-E249 PolarHBondContact O-N 2.92Å
250	R	46.2	Very low	51.3	Low	216 Å²	216	129.3 Å²	129.3	82%	0.815	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	15.1	-173.7	-79.3	-169.3	172.7	-165.6	-0.4	116.7	L248	L248-R250 VanDerWaalsContact C-N 3.28Å; L248-R250 PolarHBondContact O-N 2.96Å
251	R	40	Very low	49.6	Very low	210 Å²	210	132.7 Å²	132.7	79%	0.792	69%	0.687	S	S	*	*			trans	-97.7	87.6	168.7	-73	-177.7	171.5	153.8	-1.2	109.6
252	Q	39.3	Very low	47.7	Very low	157 Å²	157	137.1 Å²	137.1	73%	0.734	70%	0.702	S	S	*	*				74.6	103.6	96.3	-79.6	-179.6	-30.6	0	0	113.6
253	I	40	Very low	45.6	Very low	171 Å²	171	138.1 Å²	138.1	88%	0.877	72%	0.716	S	S	*	*			trans	-119.1	124.4	148.7	-64.1	173.3	0	0	0	104.3
254	D	37.5	Very low	43.5	Very low	124 Å²	124	143.6 Å²	143.6	66%	0.663	74%	0.738	S	S	*	*			trans	-77.6	140.7	-163.3	-55.4	-61.3	0	0	0	114.4
255	P	33.9	Very low	41.5	Very low	124 Å²	124	142 Å²	142	81%	0.805	75%	0.754	S	S	*	*			trans	-107.7	104.9	161.3	33.7	-22.7	0	0	0	111
256	L	39.3	Very low	39.6	Very low	158 Å²	158	145 Å²	145	83%	0.827	77%	0.77	S	S	*	*			trans	-102.2	104.7	176	-88	171.3	0	0	0	113.1
257	V	41.5	Very low	37.9	Very low	117 Å²	117	148.3 Å²	148.3	71%	0.709	78%	0.783	S	S	*	*			trans	42.8	95.8	132.6	-171.5	0	0	0	0	119.1
258	E	31.8	Very low	36.4	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	78%	0.782	S	S	*	*				38.6	115.3	114.5	-163.2	168	-137.6	0	0	121.1
259	S	35.8	Very low	35.3	Very low	118 Å²	118	148.8 Å²	148.8	83%	0.825	79%	0.786	S	S	*	*			trans	-170.1	133.3	133.9	41.5	0	0	0	0	112.1
260	P	33.8	Very low	34.4	Very low	115 Å²	115	151.4 Å²	151.4	75%	0.747	79%	0.79	S	S	*	*			trans	-123.8	120.6	179.8	37	-23.8	0	0	0	115.3
261	I	37.5	Very low	33.7	Very low	165 Å²	165	145.6 Å²	145.6	85%	0.846	78%	0.783	S	S	*	*			trans	-144	103.4	166.9	-52.9	-180	0	0	0	106.7
262	K	30.2	Very low	33.2	Very low	202 Å²	202	140.8 Å²	140.8	88%	0.878	78%	0.781	S	S	*	*				64.6	132.6	82.4	-85.2	-169	176.6	-178.5	0	116.6
263	A	29.5	Very low	33	Very low	82 Å²	82	140.8 Å²	140.8	68%	0.678	78%	0.781	S	S	*	*			trans	89.2	107.7	154.2	0	0	0	0	0	120.2
264	N	27.1	Very low	33	Very low	169 Å²	169	139 Å²	139	90%	0.904	77%	0.773	S	S	*	*				65.4	127.5	127.3	-54.5	-3.5	0	0	0	120.9
265	G	33.6	Very low	32.7	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	77%	0.771	S	S	*	*			trans	167.7	78.1	164.4	0	0	0	0	0	114.7
266	N	26.2	Very low	32.5	Very low	171 Å²	171	137.9 Å²	137.9	91%	0.914	76%	0.76	S	S	*	*			trans	-72.6	130.9	163.3	-72.4	-2.7	0	0	0	110.1
267	F	29.8	Very low	32.4	Very low	194 Å²	194	136.2 Å²	136.2	85%	0.851	76%	0.762	S	S	*	*			trans	-174	96.2	146.6	-139.8	-114.4	0	0	0	107.8
268	S	29.9	Very low	32.1	Very low	68 Å²	68	139.6 Å²	139.6	48%	0.476	77%	0.767	S	S	.	*				64	124	87.7	71.8	0	0	0	0	116
269	D	26.7	Very low	32.3	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	77%	0.769	S	S	*	*			trans	43.7	122.2	143.3	-53.3	-22.6	0	0	0	121.1
270	Y	33.4	Very low	32.2	Very low	226 Å²	226	139.7 Å²	139.7	89%	0.886	76%	0.762	S	S	*	*				-165.4	100.5	127.3	-88.6	-69.6	0	0	0	105.5
271	S	30.2	Very low	32.4	Very low	94 Å²	94	140.7 Å²	140.7	66%	0.657	76%	0.761	S	S	*	*				60.7	111	85.9	-66.9	0	0	0	0	114.3
272	S	31	Very low	32.2	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	75%	0.754	S	S	*	*			trans	63.6	143.1	131.5	71.8	0	0	0	0	118.4
273	E	34.4	Very low	32.2	Very low	157 Å²	157	133.7 Å²	133.7	73%	0.734	74%	0.741	S	S	*	*				-177	162.4	59.1	-121.6	-174.8	172.1	0	0	110.2
274	L	39.1	Very low	32.7	Very low	134 Å²	134	135 Å²	135	70%	0.702	75%	0.745	S	S	*	*			trans	62.1	150.9	145.2	-62.9	167.9	0	0	0	121
275	D	31.7	Very low	33.1	Very low	115 Å²	115	135.6 Å²	135.6	62%	0.615	74%	0.74	S	S	*	*			cis	-166.1	168.6	-29.4	-151.1	-8.6	0	0	0	111.3
276	N	31.2	Very low	33.2	Very low	109 Å²	109	139 Å²	139	58%	0.583	74%	0.739	S	S	*	*			trans	47.7	122.3	151.2	-71.4	-48.6	0	0	0	122.8
277	S	37.1	Very low	33.6	Very low	124 Å²	124	139 Å²	139	87%	0.867	73%	0.734	S	S	*	*				-174.2	151.9	94.2	-83.2	0	0	0	0	115.3
278	K	34.9	Very low	33.9	Very low	187 Å²	187	136.5 Å²	136.5	81%	0.813	73%	0.73	S	S	*	*			trans	-112.9	158.1	-168.4	-61.2	165	177.3	165.5	0	113.9
279	K	36.2	Very low	34.2	Very low	198 Å²	198	137.8 Å²	137.8	86%	0.861	74%	0.739	S	S	*	*			trans	169.2	123.1	135.1	-92.2	160.4	-176.4	-178.9	0	108.1
280	S	32.6	Very low	34.4	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	74%	0.743	S	S	*	*				67.9	126	51.5	-155.3	0	0	0	0	111.9
281	L	37.5	Very low	34.1	Very low	136 Å²	136	132.9 Å²	132.9	71%	0.712	74%	0.735	S	S	*	*				-158.6	149.2	61.2	-111.7	89.7	0	0	0	114.5
282	N	34.2	Very low	34.1	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	74%	0.735	S	S	*	*			trans	46.6	161.5	130.5	-61.5	10.1	0	0	0	123.7
283	S	31	Very low	34	Very low	88 Å²	88	133.6 Å²	133.6	62%	0.615	74%	0.735	S	S	*	*			cis	176.9	166	-30.3	62.7	0	0	0	0	109.5
284	S	38.7	Very low	34.1	Very low	109 Å²	109	131.2 Å²	131.2	76%	0.762	73%	0.731	S	S	*	*			trans	78.1	152.4	159.3	-61.7	0	0	0	0	119.2
285	K	35.7	Very low	33.8	Very low	183 Å²	183	131.4 Å²	131.4	80%	0.796	73%	0.733	S	S	*	*			cis	-175.5	147.9	-29.5	-151	178.2	-171.2	-176.6	0	108.4
286	N	36.5	Very low	34	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	73%	0.734	S	S	*	*			trans	142.5	145.2	140	-72.2	-8.3	0	0	0	114.9
287	Q	34.6	Very low	34.3	Very low	173 Å²	173	133.3 Å²	133.3	81%	0.808	74%	0.74	S	S	*	*			trans	-110.2	163	177.9	-61.5	170.8	-38.6	0	0	108.5
288	D	35.3	Very low	34.3	Very low	140 Å²	140	134.3 Å²	134.3	75%	0.749	74%	0.735	S	S	*	*				159.6	140.6	108	-87.2	-39.3	0	0	0	116.6
289	S	36	Very low	34.3	Very low	95 Å²	95	131 Å²	131	66%	0.664	74%	0.735	S	S	*	*			trans	66.5	112.4	141.5	66.4	0	0	0	0	124.5
290	L	30.5	Very low	34.2	Very low	157 Å²	157	130.8 Å²	130.8	82%	0.822	73%	0.734	S	S	*	*				74.8	125.8	116.7	-71.4	165.5	0	0	0	124
291	S	28.5	Very low	34.5	Very low	105 Å²	105	131 Å²	131	73%	0.734	73%	0.734	S	S	*	*			trans	68	150.8	135.2	66.9	0	0	0	0	120.2
292	S	29.2	Very low	34.3	Very low	94 Å²	94	130 Å²	130	66%	0.657	74%	0.735	S	S	*	*			cis	178.8	158.5	-17.9	56.1	0	0	0	0	109.5
293	T	28.4	Very low	34.3	Very low	124 Å²	124	131.4 Å²	131.4	76%	0.761	74%	0.741	S	S	*	*			trans	75.4	136.3	149	-46.2	0	0	0	0	114.8
294	V	36.7	Very low	34.2	Very low	106 Å²	106	132.9 Å²	132.9	64%	0.642	75%	0.749	S	S	*	*			cis	-169.8	174.4	-1.3	-96.4	0	0	0	0	110.7
295	D	33.2	Very low	33.7	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	75%	0.747	S	S	*	*			trans	67.9	149.8	148.9	-58.1	-21.1	0	0	0	119.4
296	D	35.3	Very low	33.4	Very low	121 Å²	121	134.2 Å²	134.2	65%	0.647	75%	0.754	S	S	*	*			cis	-157.5	167.4	0.4	-144.2	1.2	0	0	0	113.8
297	M	38.8	Very low	32.8	Very low	143 Å²	143	130.6 Å²	130.6	70%	0.704	75%	0.752	S	S	*	*			trans	40.2	150.8	145.6	-70.8	-58.7	141.8	0	0	122.8
298	L	35.8	Very low	32.7	Very low	145 Å²	145	131.7 Å²	131.7	76%	0.759	75%	0.754	S	S	*	*			cis	-173.6	163.7	-5.6	174.7	60.9	0	0	0	110.3
299	S	36.3	Very low	32.2	Very low	117 Å²	117	130.8 Å²	130.8	82%	0.818	75%	0.754	S	S	*	*			trans	100.9	164	157.6	83.3	0	0	0	0	119.7
300	K	33.3	Very low	31.9	Very low	195 Å²	195	134.6 Å²	134.6	85%	0.848	76%	0.763	S	S	*	*			trans	-137.2	-163.4	-136.8	-153.9	-168.7	176.3	176.2	0	113
301	P	39.2	Very low	31.9	Very low	104 Å²	104	132.1 Å²	132.1	68%	0.675	76%	0.757	S	S	*	*				-90.9	-164.3	-125.4	45.4	-27.8	0	0	0	114
302	P	34.5	Very low	31.8	Very low	115 Å²	115	135.5 Å²	135.5	75%	0.747	77%	0.766	S	S	*	*			cis	-140.2	-165.1	11	43.4	-20.9	0	0	0	118
303	I	33.2	Very low	32.1	Very low	159 Å²	159	136.5 Å²	136.5	82%	0.815	77%	0.773	S	S	*	*			trans	-59.1	144.2	-171.3	-50.3	154.4	0	0	0	113.8
304	P	29.2	Very low	32.3	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	78%	0.779	S	S	*	*				-137.5	153.3	114.5	35.6	-23.5	0	0	0	114.8
305	S	28.3	Very low	32	Very low	105 Å²	105	134.2 Å²	134.2	73%	0.734	78%	0.776	S	S	*	*			trans	-65.9	138.2	173.6	52.8	0	0	0	0	113.6
306	F	28.3	Very low	32	Very low	214 Å²	214	136.8 Å²	136.8	94%	0.939	79%	0.789	S	S	*	*			trans	-152.8	130.1	148.9	-123.8	-84	0	0	0	111.7
307	G	25.5	Very low	32	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	80%	0.795	S	S	*	*			trans	-79.2	146.8	-177.1	0	0	0	0	0	113.1
308	K	30.8	Very low	31.9	Very low	196 Å²	196	137 Å²	137	85%	0.852	79%	0.79	S	S	*	*			trans	-147.4	107.9	167.8	-152.6	161.4	-172.4	171.4	0	113.2
309	T	25.3	Very low	32.4	Very low	120 Å²	120	135.9 Å²	135.9	74%	0.736	78%	0.783	S	S	*	*			trans	49.7	100.2	139.5	-42.1	0	0	0	0	118.8
310	M	30.7	Very low	33.1	Very low	176 Å²	176	133.6 Å²	133.6	87%	0.867	77%	0.767	S	S	*	*			trans	-90.1	142.2	152.9	-89.1	-74.8	152.8	0	0	110.4
311	P	29.8	Very low	34.6	Very low	105 Å²	105	128 Å²	128	68%	0.682	75%	0.749	S	S	*	*			trans	-78.9	136.5	-167.3	30.4	-34.5	0	0	0	113.1	S313	P311-S313 PolarHBondContact O-N 2.76Å
312	N	25.3	Very low	36.4	Very low	175 Å²	175	127.2 Å²	127.2	94%	0.936	74%	0.737	S	S	*	*			trans	-65.9	103.2	169.1	-83.6	-43.6	0	0	0	110.5
313	S	36.9	Very low	38.8	Very low	115 Å²	115	123 Å²	123	80%	0.804	71%	0.71	S	S	*	*			trans	-108.4	103.9	167.9	-174.9	0	0	0	0	109.9	P311 G315	P311-S313 PolarHBondContact O-N 2.76Å; S313-G315 PolarHBondContact O-N 2.87Å
314	S	32	Very low	41.4	Very low	126 Å²	126	119.8 Å²	119.8	88%	0.881	69%	0.688	S	S	*	*			trans	-73.8	107.6	177.4	51.9	0	0	0	0	111.2
315	G	31.2	Very low	44.3	Very low	57 Å²	57	120.1 Å²	120.1	59%	0.588	67%	0.674	S	S	*	*			trans	-156.3	124.4	174.5	0	0	0	0	0	111.9	S313 K317	S313-G315 PolarHBondContact O-N 2.87Å; G315-K317 PolarHBondContact O-N 3.08Å; G315-K317 VanDerWaalsContact O-N 3.11Å
316	L	32.5	Very low	47.3	Very low	191 Å²	191	117 Å²	117	100%	1	65%	0.649	S	S	*	*			trans	-59	110.6	177.9	-65.2	161.8	0	0	0	110
317	K	35.7	Very low	50.4	Low	178 Å²	178	106.8 Å²	106.8	77%	0.774	61%	0.605	S	S	*	*			trans	-116.9	143.7	173.2	-75.6	-176.7	177.9	177.5	0	110.5	G315	G315-K317 PolarHBondContact O-N 3.08Å; G315-K317 VanDerWaalsContact O-N 3.11Å
318	P	35.2	Very low	53.6	Low	92 Å²	92	104.6 Å²	104.6	60%	0.597	58%	0.575	S	S	*	*			trans	-79.3	157.6	-159.6	31.3	-36.8	0	0	0	114	S320 T321	P318-S320 PolarHBondContact O-N 3.49Å; P318-S320 PolarHBondContact O-OG 3.02Å; P318-T321 PolarHBondContact O-N 3.34Å; P318-T321 VanDerWaalsContact O-N 3.12Å; P318-T321 PolarHBondContact O-OG1 2.97Å
319	I	46.4	Very low	56.5	Low	120 Å²	120	98 Å²	98	62%	0.615	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.7	-27.4	-172.9	-130.7	76.5	0	0	0	115.6	T321 Q322 I499	I319-T321 VanDerWaalsContact C-N 3.26Å; I319-T321 PolarHBondContact O-N 2.84Å; I319-Q322 PolarHBondContact O-N 2.64Å; I319-I499 HydrophobicContact CD1-CD1 4.18Å; I319-I499 HydrophobicContact CD1-CG2 4.14Å
320	S	52.3	Low	59.8	Low	69 Å²	69	92.5 Å²	92.5	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-56	-34.7	178.6	54.8	0	0	0	0	113.7	P318 Q322 S323 R324	P318-S320 PolarHBondContact O-N 3.49Å; P318-S320 PolarHBondContact O-OG 3.02Å; S320-Q322 VanDerWaalsContact C-N 3.3Å; S320-Q322 PolarHBondContact O-N 3.09Å; S320-S323 PolarHBondContact O-OG 3.01Å; S320-R324 PolarHBondContact O-N 2.81Å
321	T	64.9	Low	62.7	Low	78 Å²	78	84.1 Å²	84.1	48%	0.479	47%	0.473	S	S	.	.	H	α-helix	trans	-67.3	-29.2	-175.2	57	0	0	0	0	113.2	P318 I319 Y325	P318-T321 PolarHBondContact O-N 3.34Å; P318-T321 VanDerWaalsContact O-N 3.12Å; P318-T321 PolarHBondContact O-OG1 2.97Å; I319-T321 VanDerWaalsContact C-N 3.26Å; I319-T321 PolarHBondContact O-N 2.84Å; T321-Y325 WeakPolarHBondContact O-CB 3.24Å; T321-Y325 PolarHBondContact O-N 3Å
322	Q	76.8	Confident	65.8	Low	88 Å²	88	82.8 Å²	82.8	41%	0.411	46%	0.458	S	S	.	.	H	α-helix	trans	-71.9	-42.7	-177.8	-170.5	60	41	0	0	111.9	I319 S320 Y325 D326 L501	I319-Q322 PolarHBondContact O-N 2.64Å; S320-Q322 VanDerWaalsContact C-N 3.3Å; S320-Q322 PolarHBondContact O-N 3.09Å; Q322-Y325 PolarHBondContact O-N 3.38Å; Q322-D326 PolarHBondContact O-N 3.46Å; Q322-L501 HydrophobicContact CG-CD2 4.14Å
323	S	84.9	Confident	69	Low	27 Å²	27	76.9 Å²	76.9	19%	0.189	43%	0.426	C	S	.	.	H	α-helix	trans	-61.1	-44	175.8	63.1	0	0	0	0	112.3	S320 Y325 D326 L327	S320-S323 PolarHBondContact O-OG 3.01Å; S323-Y325 PolarHBondContact O-N 3.3Å; S323-D326 PolarHBondContact O-N 2.75Å; S323-L327 WeakPolarHBondContact O-CB 3.41Å; S323-L327 PolarHBondContact O-N 3.37Å
324	R	88.3	Confident	71.6	Confident	90 Å²	90	71.4 Å²	71.4	34%	0.34	39%	0.388	S	S	.	.	H	α-helix	trans	-60.4	-44	175	-176.8	177.1	177.1	164.8	3.5	111.9	S320 L328 L346 M416	S320-R324 PolarHBondContact O-N 2.81Å; R324-L328 WeakPolarHBondContact O-CB 3.48Å; R324-L328 PolarHBondContact O-N 2.95Å; R324-L346 HydrophobicContact CG-CD1 3.99Å; R324-M416 HydrophobicContact CB-CE 3.84Å; R324-M416 HydrophobicContact CB-SD 3.87Å; R324-M416 HydrophobicContact CG-CE 4.46Å; R324-M416 HydrophobicContact CG-SD 3.93Å
325	Y	89.2	Confident	74.4	Confident	127 Å²	127	65.6 Å²	65.6	50%	0.498	35%	0.347	S	S	.	.	H	α-helix	trans	-67.8	-42.8	-179.4	-178.3	-94.6	0	0	0	112.4	T321 Q322 S323 L328 L329	T321-Y325 WeakPolarHBondContact O-CB 3.24Å; T321-Y325 PolarHBondContact O-N 3Å; Q322-Y325 PolarHBondContact O-N 3.38Å; S323-Y325 PolarHBondContact O-N 3.3Å; Y325-L328 PolarHBondContact O-N 3.42Å; Y325-L329 WeakPolarHBondContact O-CB 3.3Å; Y325-L329 PolarHBondContact O-N 3.1Å
326	D	91	Very high	77.2	Confident	40 Å²	40	71.1 Å²	71.1	21%	0.214	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-42.5	176.9	-176.2	76.1	0	0	0	112.2	Q322 S323 L329 W330 R423 C453	Q322-D326 PolarHBondContact O-N 3.46Å; S323-D326 PolarHBondContact O-N 2.75Å; D326-L329 PolarHBondContact O-N 2.82Å; D326-W330 WeakPolarHBondContact O-CB 3.27Å; D326-W330 PolarHBondContact O-N 3.21Å; D326-R423 IonicContact OD2-CZ 2.74Å; D326-R423 VanDerWaalsContact OD2-CZ 3.26Å; D326-R423 IonicContact OD2-NH1 2.68Å; D326-R423 PolarHBondContact OD2-NH1 3.08Å; D326-R423 IonicContact OD2-NH2 2.67Å; D326-R423 PolarHBondContact OD2-NH2 3.18Å; D326-C453 PolarHBondContact OD1-SG 3.49Å
327	L	92.9	Very high	79.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.2	-40.8	175.6	-178.5	59.5	0	0	0	112.4	S323 W330 C331 L346 M416 L419	S323-L327 WeakPolarHBondContact O-CB 3.41Å; S323-L327 PolarHBondContact O-N 3.37Å; L327-W330 HydrophobicContact CD1-CE3 3.98Å; L327-W330 HydrophobicContact CD1-CZ3 4.5Å; L327-W330 PolarHBondContact O-N 3.05Å; L327-C331 PolarHBondContact O-N 2.87Å; L327-C331 PolarHBondContact O-SG 3.46Å; L327-L346 HydrophobicContact CB-CD1 4.12Å; L327-L346 HydrophobicContact CD2-CD1 3.77Å; L327-L346 HydrophobicContact CG-CD1 3.95Å; L327-M416 HydrophobicContact CD2-CB 4.16Å; L327-M416 HydrophobicContact CD2-CG 4.15Å; L327-L419 HydrophobicContact CD1-CB 4.13Å; L327-L419 HydrophobicContact CD2-CB 3.88Å; L327-L419 HydrophobicContact CG-CB 4.37Å
328	L	93.2	Very high	82.5	Confident	26 Å²	26	58.7 Å²	58.7	14%	0.136	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-46.6	175.4	-178.7	66.2	0	0	0	111.5	R324 Y325 W330 C331 Q332 I343 D345 L346	R324-L328 WeakPolarHBondContact O-CB 3.48Å; R324-L328 PolarHBondContact O-N 2.95Å; Y325-L328 PolarHBondContact O-N 3.42Å; L328-W330 VanDerWaalsContact C-N 3.35Å; L328-W330 PolarHBondContact O-N 3.48Å; L328-C331 PolarHBondContact O-N 3.36Å; L328-Q332 WeakPolarHBondContact O-CG 3.3Å; L328-Q332 PolarHBondContact O-N 2.73Å; L328-I343 HydrophobicContact CD1-CG2 3.73Å; L328-D345 WeakPolarHBondContact CD1-O 3.42Å; L328-L346 HydrophobicContact CB-CD2 4.15Å; L328-L346 HydrophobicContact CB-CG 4.3Å; L328-L346 HydrophobicContact CD1-CD2 3.79Å; L328-L346 HydrophobicContact CD1-CG 4.18Å
329	L	92.2	Very high	84.7	Confident	57 Å²	57	61.7 Å²	61.7	30%	0.298	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-41.3	178	-176.6	63.7	0	0	0	111.8	Y325 D326 Q332 L333	Y325-L329 WeakPolarHBondContact O-CB 3.3Å; Y325-L329 PolarHBondContact O-N 3.1Å; D326-L329 PolarHBondContact O-N 2.82Å; L329-Q332 PolarHBondContact O-N 2.99Å; L329-L333 WeakPolarHBondContact O-CB 3.31Å; L329-L333 PolarHBondContact O-N 3.27Å
330	W	93.4	Very high	86.5	Confident	5 Å²	5	62.4 Å²	62.4	2%	0.019	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-46.6	174.1	174.9	81.7	0	0	0	112	D326 L327 L328 Q332 L333 V334 I359 F363 I422 R423	D326-W330 WeakPolarHBondContact O-CB 3.27Å; D326-W330 PolarHBondContact O-N 3.21Å; L327-W330 HydrophobicContact CD1-CE3 3.98Å; L327-W330 HydrophobicContact CD1-CZ3 4.5Å; L327-W330 PolarHBondContact O-N 3.05Å; L328-W330 VanDerWaalsContact C-N 3.35Å; L328-W330 PolarHBondContact O-N 3.48Å; W330-Q332 PolarHBondContact O-N 3.3Å; W330-L333 PolarHBondContact O-N 3.47Å; W330-V334 HydrophobicContact CD2-CG2 4.19Å; W330-V334 HydrophobicContact CG-CG2 4.49Å; W330-V334 HydrophobicContact CZ2-CG2 3.95Å; W330-V334 WeakPolarHBondContact O-CG2 3.25Å; W330-V334 PolarHBondContact O-N 2.91Å; W330-I359 HydrophobicContact CH2-CG2 3.65Å; W330-I359 HydrophobicContact CZ3-CD1 4.33Å; W330-I359 HydrophobicContact CZ3-CG2 4.16Å; W330-F363 AromaticContact CZ2-CE2 3.96Å; W330-F363 HydrophobicContact CZ2-CE2 3.96Å; W330-F363 HydrophobicContact CZ2-CZ 4.29Å; W330-I422 HydrophobicContact CH2-CG2 4.48Å; W330-R423 HydrophobicContact CD2-CB 4.17Å; W330-R423 HydrophobicContact CD2-CG 3.82Å; W330-R423 HydrophobicContact CE3-CB 4.07Å; W330-R423 HydrophobicContact CE3-CG 4.2Å; W330-R423 HydrophobicContact CG-CG 4.33Å; W330-R423 HydrophobicContact CH2-CB 3.6Å; W330-R423 HydrophobicContact CH2-CG 4.16Å; W330-R423 HydrophobicContact CZ2-CB 3.69Å; W330-R423 HydrophobicContact CZ2-CG 3.76Å; W330-R423 HydrophobicContact CZ3-CB 3.8Å; W330-R423 HydrophobicContact CZ3-CG 4.37Å
331	C	93.5	Very high	88.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.9	-49.4	177.6	-63.5	0	0	0	0	111.1	L327 L328 L333 V334 T335 I343 F350 I359	L327-C331 PolarHBondContact O-N 2.87Å; L327-C331 PolarHBondContact O-SG 3.46Å; L328-C331 PolarHBondContact O-N 3.36Å; C331-L333 VanDerWaalsContact C-N 3.28Å; C331-L333 PolarHBondContact O-N 3.31Å; C331-V334 PolarHBondContact O-N 2.95Å; C331-T335 PolarHBondContact O-N 3.01Å; C331-T335 PolarHBondContact O-OG1 3.4Å; C331-I343 HydrophobicContact CB-CD1 3.79Å; C331-I343 HydrophobicContact CB-CG2 4.29Å; C331-F350 HydrophobicContact CB-CZ 4.18Å; C331-I359 HydrophobicContact CB-CD1 4.24Å
332	Q	93.5	Very high	89.3	Confident	77 Å²	77	64 Å²	64	36%	0.36	31%	0.314	S	S	.	.	H	α-helix	trans	-58.1	-38.1	178.1	-74	173.3	-21.4	0	0	113.1	L328 L329 W330 K336 I343	L328-Q332 WeakPolarHBondContact O-CG 3.3Å; L328-Q332 PolarHBondContact O-N 2.73Å; L329-Q332 PolarHBondContact O-N 2.99Å; W330-Q332 PolarHBondContact O-N 3.3Å; Q332-K336 PolarHBondContact O-N 3.22Å; Q332-I343 HydrophobicContact CG-CB 4.11Å; Q332-I343 VanDerWaalsContact CG-O 3.31Å; Q332-I343 WeakPolarHBondContact CG-O 3.38Å; Q332-I343 PolarHBondContact NE2-O 3.39Å
333	L	91.9	Very high	90	Very high	51 Å²	51	60.1 Å²	60.1	27%	0.267	30%	0.296	S	S	.	.	H	α-helix	trans	-73.3	-46	-178.7	-164.7	165.6	0	0	0	110.8	L329 W330 C331 T335 K336 I449	L329-L333 WeakPolarHBondContact O-CB 3.31Å; L329-L333 PolarHBondContact O-N 3.27Å; W330-L333 PolarHBondContact O-N 3.47Å; C331-L333 VanDerWaalsContact C-N 3.28Å; C331-L333 PolarHBondContact O-N 3.31Å; L333-T335 VanDerWaalsContact C-N 3.32Å; L333-T335 PolarHBondContact O-N 3Å; L333-K336 WeakPolarHBondContact O-CB 3.3Å; L333-K336 PolarHBondContact O-N 3.45Å; L333-I449 HydrophobicContact CD1-CG1 3.96Å; L333-I449 HydrophobicContact CD2-CD1 3.47Å; L333-I449 VanDerWaalsContact CD2-CD1 3.47Å; L333-I449 HydrophobicContact CD2-CG1 3.46Å; L333-I449 VanDerWaalsContact CD2-CG1 3.46Å; L333-I449 HydrophobicContact CG-CG1 4.36Å
334	V	91.8	Very high	90.3	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-38.1	176.1	170.9	0	0	0	0	111.8	W330 C331 K336 I359 H362 F363	W330-V334 HydrophobicContact CD2-CG2 4.19Å; W330-V334 HydrophobicContact CG-CG2 4.49Å; W330-V334 HydrophobicContact CZ2-CG2 3.95Å; W330-V334 WeakPolarHBondContact O-CG2 3.25Å; W330-V334 PolarHBondContact O-N 2.91Å; C331-V334 PolarHBondContact O-N 2.95Å; V334-K336 VanDerWaalsContact C-N 3.33Å; V334-K336 PolarHBondContact O-N 3.07Å; V334-I359 HydrophobicContact CG1-CB 4.32Å; V334-I359 HydrophobicContact CG1-CG1 4.12Å; V334-I359 HydrophobicContact CG1-CG2 4.31Å; V334-H362 HydrophobicContact CG1-CB 3.8Å; V334-H362 PolarHBondContact O-ND1 3.36Å; V334-F363 HydrophobicContact CG1-CE2 3.87Å; V334-F363 HydrophobicContact CG2-CE2 4.08Å; V334-F363 HydrophobicContact CG2-CZ 4.15Å
335	T	91.8	Very high	90.5	Very high	4 Å²	4	60.8 Å²	60.8	3%	0.025	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	9.5	177.7	67.9	0	0	0	0	114.4	C331 L333 S337 Y338 I341 I343 A358 I359	C331-T335 PolarHBondContact O-N 3.01Å; C331-T335 PolarHBondContact O-OG1 3.4Å; L333-T335 VanDerWaalsContact C-N 3.32Å; L333-T335 PolarHBondContact O-N 3Å; T335-S337 PolarHBondContact O-N 3.31Å; T335-Y338 PolarHBondContact O-N 2.9Å; T335-I341 HydrophobicContact CG2-CG2 4.4Å; T335-I343 HydrophobicContact CG2-CD1 3.77Å; T335-I343 WeakPolarHBondContact OG1-CD1 3.46Å; T335-A358 HydrophobicContact CG2-CB 4.01Å; T335-I359 HydrophobicContact CG2-CD1 4.39Å; T335-I359 HydrophobicContact CG2-CG1 3.6Å
336	K	89.3	Confident	90.6	Very high	173 Å²	173	54.7 Å²	54.7	75%	0.752	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.2	-175.6	-172	-177.6	173.9	-165.8	0	113.6	Q332 L333 V334 Y338	Q332-K336 PolarHBondContact O-N 3.22Å; L333-K336 WeakPolarHBondContact O-CB 3.3Å; L333-K336 PolarHBondContact O-N 3.45Å; V334-K336 VanDerWaalsContact C-N 3.33Å; V334-K336 PolarHBondContact O-N 3.07Å; K336-Y338 VanDerWaalsContact C-N 3.29Å; K336-Y338 PolarHBondContact O-N 3.36Å
337	S	88.4	Confident	90.6	Very high	82 Å²	82	53.6 Å²	53.6	57%	0.573	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	3.7	179	55.8	0	0	0	0	114.7	T335	T335-S337 PolarHBondContact O-N 3.31Å
338	Y	91.1	Very high	90.5	Very high	27 Å²	27	57.2 Å²	57.2	11%	0.106	30%	0.301	C	S	.	.			trans	-120.9	100.6	-174.9	-56.3	-93	0	0	0	110.8	T335 K336 N340 I341 A358 H361 H362 Y370	T335-Y338 PolarHBondContact O-N 2.9Å; K336-Y338 VanDerWaalsContact C-N 3.29Å; K336-Y338 PolarHBondContact O-N 3.36Å; Y338-N340 PolarHBondContact O-N 3.17Å; Y338-N340 VanDerWaalsContact O-N 3.1Å; Y338-I341 PolarHBondContact O-N 3.19Å; Y338-I341 VanDerWaalsContact O-N 3.13Å; Y338-A358 HydrophobicContact CD1-CB 4.1Å; Y338-A358 HydrophobicContact CD2-CB 3.79Å; Y338-A358 HydrophobicContact CE1-CB 4.11Å; Y338-A358 HydrophobicContact CE2-CB 3.8Å; Y338-A358 HydrophobicContact CG-CB 3.93Å; Y338-A358 PolarHBondContact OH-O 3.48Å; Y338-H361 AromaticContact CE1-ND1 3.59Å; Y338-H361 AromaticContact CZ-ND1 3.65Å; Y338-H361 PolarHBondContact OH-ND1 3.21Å; Y338-H362 HydrophobicContact CE2-CB 4.43Å; Y338-H362 PolarHBondContact OH-N 2.99Å; Y338-Y370 AromaticContact CD1-CD1 3.88Å; Y338-Y370 HydrophobicContact CD1-CD1 3.88Å; Y338-Y370 HydrophobicContact CD1-CD2 4.37Å; Y338-Y370 AromaticContact CD1-CE1 3.51Å; Y338-Y370 HydrophobicContact CD1-CE1 3.51Å; Y338-Y370 HydrophobicContact CD1-CE2 4.04Å; Y338-Y370 HydrophobicContact CD1-CG 4.3Å; Y338-Y370 AromaticContact CD1-CZ 3.61Å; Y338-Y370 AromaticContact CE1-CD1 3.96Å; Y338-Y370 HydrophobicContact CE1-CD1 3.96Å; Y338-Y370 HydrophobicContact CE1-CD2 4.12Å; Y338-Y370 HydrophobicContact CE1-CE1 4.06Å; Y338-Y370 HydrophobicContact CE1-CE2 4.22Å; Y338-Y370 HydrophobicContact CE1-CG 4Å
339	D	82.8	Confident	90.5	Very high	154 Å²	154	56.9 Å²	56.9	82%	0.824	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.9	-175	-63.7	-39.4	0	0	0	113.8	I341	D339-I341 PolarHBondContact O-N 3.35Å
340	N	82.8	Confident	90.5	Very high	135 Å²	135	54.1 Å²	54.1	72%	0.722	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	3.7	-177.5	-64.3	-18.4	0	0	0	114.3	Y338	Y338-N340 PolarHBondContact O-N 3.17Å; Y338-N340 VanDerWaalsContact O-N 3.1Å
341	I	87.5	Confident	90.4	Very high	16 Å²	16	56.1 Å²	56.1	8%	0.082	30%	0.295	C	S	.	.			trans	-126.9	123.7	-174.5	-66.8	171.5	0	0	0	111.8	T335 Y338 D339 I343 L354 A355 A358 Y370	T335-I341 HydrophobicContact CG2-CG2 4.4Å; Y338-I341 PolarHBondContact O-N 3.19Å; Y338-I341 VanDerWaalsContact O-N 3.13Å; D339-I341 PolarHBondContact O-N 3.35Å; I341-I343 HydrophobicContact CG2-CD1 4.21Å; I341-I343 HydrophobicContact CG2-CG1 3.73Å; I341-L354 HydrophobicContact CD1-CB 4.15Å; I341-L354 WeakPolarHBondContact CD1-O 3.31Å; I341-L354 HydrophobicContact CG1-CB 4.25Å; I341-A355 HydrophobicContact CG2-CB 4.36Å; I341-A358 HydrophobicContact CD1-CB 3.25Å; I341-Y370 HydrophobicContact CD1-CE2 4.18Å; I341-Y370 WeakPolarHBondContact CD1-OH 3.03Å
342	Q	88.6	Confident	90.2	Very high	165 Å²	165	58.5 Å²	58.5	77%	0.771	31%	0.308	S	S	*	.			trans	-125.3	102.5	172.5	-63.3	-175.4	13.9	0	0	110.5	T344	Q342-T344 PolarHBondContact O-N 3.46Å
343	I	91.6	Very high	90.1	Very high	7 Å²	7	54.9 Å²	54.9	4%	0.036	29%	0.291	C	S	.	.			trans	-88.6	108.2	178.8	-52.7	-177.1	0	0	0	109.1	L328 C331 Q332 T335 I341 D345 F350 A355	L328-I343 HydrophobicContact CD1-CG2 3.73Å; C331-I343 HydrophobicContact CB-CD1 3.79Å; C331-I343 HydrophobicContact CB-CG2 4.29Å; Q332-I343 HydrophobicContact CG-CB 4.11Å; Q332-I343 VanDerWaalsContact CG-O 3.31Å; Q332-I343 WeakPolarHBondContact CG-O 3.38Å; Q332-I343 PolarHBondContact NE2-O 3.39Å; T335-I343 HydrophobicContact CG2-CD1 3.77Å; T335-I343 WeakPolarHBondContact OG1-CD1 3.46Å; I341-I343 HydrophobicContact CG2-CD1 4.21Å; I341-I343 HydrophobicContact CG2-CG1 3.73Å; I343-D345 VanDerWaalsContact CG2-O 3.26Å; I343-D345 WeakPolarHBondContact CG2-O 3.49Å; I343-F350 HydrophobicContact CD1-CE1 4.42Å; I343-F350 HydrophobicContact CD1-CE2 4.45Å; I343-F350 HydrophobicContact CD1-CZ 3.89Å; I343-F350 HydrophobicContact CG2-CE2 3.66Å; I343-F350 HydrophobicContact CG2-CZ 4.06Å; I343-A355 HydrophobicContact CD1-CB 4.13Å; I343-A355 HydrophobicContact CG1-CB 4.37Å
344	T	91.8	Very high	90.2	Very high	103 Å²	103	52.9 Å²	52.9	63%	0.632	28%	0.281	S	S	*	.			trans	-111.5	-25.1	178.9	57.7	0	0	0	0	112.4	Q342 S349	Q342-T344 PolarHBondContact O-N 3.46Å; T344-S349 PolarHBondContact N-OG 3.41Å; T344-S349 PolarHBondContact OG1-OG 3.43Å
345	D	91.9	Very high	90.4	Very high	27 Å²	27	52.9 Å²	52.9	14%	0.144	28%	0.281	C	S	.	.	S	Bend	trans	-131.9	-175.4	170.8	82.1	1.4	0	0	0	112.1	L328 I343 T347 T348 S349	L328-D345 WeakPolarHBondContact CD1-O 3.42Å; I343-D345 VanDerWaalsContact CG2-O 3.26Å; I343-D345 WeakPolarHBondContact CG2-O 3.49Å; D345-T347 WeakPolarHBondContact OD1-CA 3.36Å; D345-T347 PolarHBondContact OD1-N 3.4Å; D345-T347 WeakPolarHBondContact OD2-CB 3.38Å; D345-T347 PolarHBondContact OD2-OG1 3.26Å; D345-T348 VanDerWaalsContact CG-N 3.28Å; D345-T348 PolarHBondContact OD1-N 2.85Å; D345-T348 PolarHBondContact OD2-N 3.42Å; D345-T348 PolarHBondContact OD2-OG1 2.93Å; D345-T348 VanDerWaalsContact OD2-OG1 3.06Å; D345-S349 PolarHBondContact N-OG 3.02Å; D345-S349 WeakPolarHBondContact OD1-CB 3.2Å; D345-S349 PolarHBondContact OD1-N 3.4Å; D345-S349 PolarHBondContact OD1-OG 2.99Å
346	L	92.2	Very high	90.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	-110.3	28.6	174.7	-62.1	-176.5	0	0	0	111	R324 L327 L328 F350 L412 M415 M416 L419	R324-L346 HydrophobicContact CG-CD1 3.99Å; L327-L346 HydrophobicContact CB-CD1 4.12Å; L327-L346 HydrophobicContact CD2-CD1 3.77Å; L327-L346 HydrophobicContact CG-CD1 3.95Å; L328-L346 HydrophobicContact CB-CD2 4.15Å; L328-L346 HydrophobicContact CB-CG 4.3Å; L328-L346 HydrophobicContact CD1-CD2 3.79Å; L328-L346 HydrophobicContact CD1-CG 4.18Å; L346-F350 HydrophobicContact CD2-CE2 3.91Å; L346-F350 HydrophobicContact CD2-CZ 4.44Å; L346-L412 HydrophobicContact CB-CD1 4.05Å; L346-M415 WeakPolarHBondContact O-CB 3.44Å; L346-M416 HydrophobicContact CB-CG 4.48Å; L346-M416 HydrophobicContact CD1-CG 3.68Å; L346-M416 HydrophobicContact CD1-SD 4.31Å; L346-L419 HydrophobicContact CB-CD1 4.48Å; L346-L419 HydrophobicContact CD2-CD1 3.94Å
347	T	91.1	Very high	90.7	Very high	17 Å²	17	44.5 Å²	44.5	10%	0.104	24%	0.244	C	C	.	.	S	Bend	trans	-141.7	-77.7	-170.7	27.8	0	0	0	0	111.8	D345 P410 L412 M415	D345-T347 WeakPolarHBondContact OD1-CA 3.36Å; D345-T347 PolarHBondContact OD1-N 3.4Å; D345-T347 WeakPolarHBondContact OD2-CB 3.38Å; D345-T347 PolarHBondContact OD2-OG1 3.26Å; T347-P410 WeakPolarHBondContact CG2-O 3.26Å; T347-L412 HydrophobicContact CG2-CB 3.98Å; T347-L412 HydrophobicContact CG2-CD1 4.01Å; T347-M415 HydrophobicContact CG2-CG 4.48Å
348	T	90.9	Very high	91	Very high	76 Å²	76	40.6 Å²	40.6	47%	0.466	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-73.6	-34.1	-178	63	0	0	0	0	112.6	D345 F350 Q351	D345-T348 VanDerWaalsContact CG-N 3.28Å; D345-T348 PolarHBondContact OD1-N 2.85Å; D345-T348 PolarHBondContact OD2-N 3.42Å; D345-T348 PolarHBondContact OD2-OG1 2.93Å; D345-T348 VanDerWaalsContact OD2-OG1 3.06Å; T348-F350 PolarHBondContact O-N 2.98Å; T348-Q351 PolarHBondContact O-N 3.06Å; T348-Q351 VanDerWaalsContact O-N 3.12Å
349	S	91.8	Very high	91.2	Very high	18 Å²	18	39.3 Å²	39.3	13%	0.126	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-60.7	-15.9	177.3	-63.3	0	0	0	0	114.4	T344 D345	T344-S349 PolarHBondContact N-OG 3.41Å; T344-S349 PolarHBondContact OG1-OG 3.43Å; D345-S349 PolarHBondContact N-OG 3.02Å; D345-S349 WeakPolarHBondContact OD1-CB 3.2Å; D345-S349 PolarHBondContact OD1-N 3.4Å; D345-S349 PolarHBondContact OD1-OG 2.99Å
350	F	93	Very high	91.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-104.1	-5.7	-179.1	-74.9	-92.4	0	0	0	113.9	C331 I343 L346 T348 N352 G353 A355 F356 I359 M415 L419	C331-F350 HydrophobicContact CB-CZ 4.18Å; I343-F350 HydrophobicContact CD1-CE1 4.42Å; I343-F350 HydrophobicContact CD1-CE2 4.45Å; I343-F350 HydrophobicContact CD1-CZ 3.89Å; I343-F350 HydrophobicContact CG2-CE2 3.66Å; I343-F350 HydrophobicContact CG2-CZ 4.06Å; L346-F350 HydrophobicContact CD2-CE2 3.91Å; L346-F350 HydrophobicContact CD2-CZ 4.44Å; T348-F350 PolarHBondContact O-N 2.98Å; F350-N352 PolarHBondContact O-N 2.9Å; F350-G353 PolarHBondContact O-N 3.49Å; F350-G353 VanDerWaalsContact O-N 3.14Å; F350-A355 HydrophobicContact CD1-CB 3.53Å; F350-A355 HydrophobicContact CE1-CB 3.66Å; F350-A355 HydrophobicContact CG-CB 4.13Å; F350-A355 HydrophobicContact CZ-CB 4.36Å; F350-F356 HydrophobicContact CB-CD2 4.42Å; F350-F356 HydrophobicContact CB-CE2 3.81Å; F350-F356 HydrophobicContact CB-CZ 4.14Å; F350-F356 HydrophobicContact CD1-CD1 4.04Å; F350-F356 HydrophobicContact CD1-CD2 4.05Å; F350-F356 AromaticContact CD1-CE1 3.9Å; F350-F356 HydrophobicContact CD1-CE1 3.9Å; F350-F356 AromaticContact CD1-CE2 3.92Å; F350-F356 HydrophobicContact CD1-CE2 3.92Å; F350-F356 HydrophobicContact CD1-CG 4.12Å; F350-F356 AromaticContact CD1-CZ 3.85Å; F350-F356 HydrophobicContact CD1-CZ 3.85Å; F350-F356 HydrophobicContact CE1-CD1 4.39Å; F350-F356 HydrophobicContact CE1-CE1 4.38Å; F350-F356 HydrophobicContact CG-CE2 4.3Å; F350-F356 HydrophobicContact CG-CZ 4.29Å; F350-I359 HydrophobicContact CE1-CD1 3.91Å; F350-I359 HydrophobicContact CZ-CD1 4.27Å; F350-M415 HydrophobicContact CB-CE 3.37Å; F350-M415 HydrophobicContact CD2-CE 4.41Å; F350-M415 HydrophobicContact CG-CE 3.94Å; F350-L419 HydrophobicContact CD1-CD2 4.17Å; F350-L419 HydrophobicContact CD2-CD1 4.42Å; F350-L419 HydrophobicContact CE1-CD1 4.06Å; F350-L419 HydrophobicContact CE1-CD2 3.51Å; F350-L419 HydrophobicContact CE1-CG 4.41Å; F350-L419 HydrophobicContact CE2-CD1 3.89Å; F350-L419 HydrophobicContact CZ-CD1 3.68Å; F350-L419 HydrophobicContact CZ-CD2 3.86Å; F350-L419 HydrophobicContact CZ-CG 4.45Å
351	Q	90.7	Very high	92.2	Very high	46 Å²	46	27.8 Å²	27.8	22%	0.215	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-21.8	-175.4	-65.4	-171.6	-45.9	0	0	113.9	T348 G353 P378 V403 S405	T348-Q351 PolarHBondContact O-N 3.06Å; T348-Q351 VanDerWaalsContact O-N 3.12Å; Q351-G353 VanDerWaalsContact C-N 3.27Å; Q351-G353 PolarHBondContact O-N 2.8Å; Q351-P378 WeakPolarHBondContact O-CB 3.43Å; Q351-V403 WeakPolarHBondContact CG-O 3.09Å; Q351-S405 PolarHBondContact NE2-O 3.29Å
352	N	90.2	Very high	92.4	Very high	51 Å²	51	30.3 Å²	30.3	27%	0.273	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.3	177.4	69.1	1	0	0	0	113.7	F350 L354 N381	F350-N352 PolarHBondContact O-N 2.9Å; N352-L354 PolarHBondContact O-N 3.36Å; N352-L354 PolarHBondContact OD1-N 3.19Å; N352-L354 VanDerWaalsContact OD1-N 3.1Å; N352-N381 PolarHBondContact O-ND2 2.87Å
353	G	91.7	Very high	92.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	71.2	-20.4	-175.7	0	0	0	0	0	115.9	F350 Q351 A355 F356 C357 C382	F350-G353 PolarHBondContact O-N 3.49Å; F350-G353 VanDerWaalsContact O-N 3.14Å; Q351-G353 VanDerWaalsContact C-N 3.27Å; Q351-G353 PolarHBondContact O-N 2.8Å; G353-A355 VanDerWaalsContact C-N 3.34Å; G353-A355 PolarHBondContact O-N 3.36Å; G353-F356 PolarHBondContact O-N 2.96Å; G353-C357 PolarHBondContact O-N 3.12Å; G353-C357 VanDerWaalsContact O-N 3.15Å; G353-C357 PolarHBondContact O-SG 3.26Å; G353-C382 WeakPolarHBondContact CA-SG 3.19Å
354	L	93.6	Very high	92.4	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.047	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-39.6	-178.6	-64.7	179.1	0	0	0	112.1	I341 N352 F356 C357 A358 L373	I341-L354 HydrophobicContact CD1-CB 4.15Å; I341-L354 WeakPolarHBondContact CD1-O 3.31Å; I341-L354 HydrophobicContact CG1-CB 4.25Å; N352-L354 PolarHBondContact O-N 3.36Å; N352-L354 PolarHBondContact OD1-N 3.19Å; N352-L354 VanDerWaalsContact OD1-N 3.1Å; L354-F356 VanDerWaalsContact C-N 3.29Å; L354-F356 PolarHBondContact O-N 3.35Å; L354-C357 WeakPolarHBondContact O-CB 3.43Å; L354-C357 PolarHBondContact O-N 3.12Å; L354-C357 VanDerWaalsContact O-N 3.09Å; L354-A358 PolarHBondContact O-N 3.18Å; L354-L373 HydrophobicContact CD2-CB 3.72Å; L354-L373 HydrophobicContact CD2-CD1 4.47Å
355	A	94.6	Very high	92.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.9	-36.8	176.7	0	0	0	0	0	113	I341 I343 F350 G353 I359	I341-A355 HydrophobicContact CG2-CB 4.36Å; I343-A355 HydrophobicContact CD1-CB 4.13Å; I343-A355 HydrophobicContact CG1-CB 4.37Å; F350-A355 HydrophobicContact CD1-CB 3.53Å; F350-A355 HydrophobicContact CE1-CB 3.66Å; F350-A355 HydrophobicContact CG-CB 4.13Å; F350-A355 HydrophobicContact CZ-CB 4.36Å; G353-A355 VanDerWaalsContact C-N 3.34Å; G353-A355 PolarHBondContact O-N 3.36Å; A355-I359 WeakPolarHBondContact O-CD1 3.47Å; A355-I359 VanDerWaalsContact O-CG1 3.26Å; A355-I359 WeakPolarHBondContact O-CG1 3.32Å; A355-I359 PolarHBondContact O-N 2.87Å
356	F	94.7	Very high	92.2	Very high	1 Å²	1	28.8 Å²	28.8	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-70.2	-40	173.2	-69.4	-68.9	0	0	0	112	F350 G353 L354 L360 A385 F386 L398 V403 M415 Y418 L419 I422	F350-F356 HydrophobicContact CB-CD2 4.42Å; F350-F356 HydrophobicContact CB-CE2 3.81Å; F350-F356 HydrophobicContact CB-CZ 4.14Å; F350-F356 HydrophobicContact CD1-CD1 4.04Å; F350-F356 HydrophobicContact CD1-CD2 4.05Å; F350-F356 AromaticContact CD1-CE1 3.9Å; F350-F356 HydrophobicContact CD1-CE1 3.9Å; F350-F356 AromaticContact CD1-CE2 3.92Å; F350-F356 HydrophobicContact CD1-CE2 3.92Å; F350-F356 HydrophobicContact CD1-CG 4.12Å; F350-F356 AromaticContact CD1-CZ 3.85Å; F350-F356 HydrophobicContact CD1-CZ 3.85Å; F350-F356 HydrophobicContact CE1-CD1 4.39Å; F350-F356 HydrophobicContact CE1-CE1 4.38Å; F350-F356 HydrophobicContact CG-CE2 4.3Å; F350-F356 HydrophobicContact CG-CZ 4.29Å; G353-F356 PolarHBondContact O-N 2.96Å; L354-F356 VanDerWaalsContact C-N 3.29Å; L354-F356 PolarHBondContact O-N 3.35Å; F356-L360 WeakPolarHBondContact O-CG 3.17Å; F356-L360 PolarHBondContact O-N 3.38Å; F356-A385 HydrophobicContact CB-CB 3.61Å; F356-F386 HydrophobicContact CD1-CE1 4.28Å; F356-F386 AromaticContact CD2-CE1 3.92Å; F356-F386 HydrophobicContact CD2-CE1 3.92Å; F356-F386 HydrophobicContact CD2-CZ 4.44Å; F356-F386 HydrophobicContact CE1-CE1 4.32Å; F356-F386 AromaticContact CE2-CE1 3.96Å; F356-F386 HydrophobicContact CE2-CE1 3.96Å; F356-F386 HydrophobicContact CE2-CZ 4.12Å; F356-F386 HydrophobicContact CG-CE1 4.08Å; F356-F386 HydrophobicContact CZ-CE1 4.16Å; F356-F386 HydrophobicContact CZ-CZ 4.36Å; F356-L398 HydrophobicContact CZ-CD1 4.36Å; F356-V403 HydrophobicContact CE2-CG1 4.19Å; F356-M415 HydrophobicContact CE2-CE 4.07Å; F356-M415 HydrophobicContact CZ-CE 3.62Å; F356-M415 HydrophobicContact CZ-SD 4.27Å; F356-Y418 HydrophobicContact CD1-CD1 4.5Å; F356-Y418 HydrophobicContact CD1-CE1 4.3Å; F356-Y418 AromaticContact CE1-CD1 3.78Å; F356-Y418 HydrophobicContact CE1-CD1 3.78Å; F356-Y418 AromaticContact CE1-CE1 3.99Å; F356-Y418 HydrophobicContact CE1-CE1 3.99Å; F356-Y418 HydrophobicContact CZ-CD1 4.31Å; F356-L419 HydrophobicContact CD1-CD2 4.01Å; F356-L419 HydrophobicContact CE1-CD2 3.59Å; F356-L419 HydrophobicContact CE1-CG 4.19Å; F356-I422 HydrophobicContact CD1-CD1 4.13Å
357	C	94.2	Very high	92	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-47.1	178.7	-60.8	0	0	0	0	111.5	G353 L354 L360 H361 I368 Y370 L373 N381	G353-C357 PolarHBondContact O-N 3.12Å; G353-C357 VanDerWaalsContact O-N 3.15Å; G353-C357 PolarHBondContact O-SG 3.26Å; L354-C357 WeakPolarHBondContact O-CB 3.43Å; L354-C357 PolarHBondContact O-N 3.12Å; L354-C357 VanDerWaalsContact O-N 3.09Å; C357-L360 PolarHBondContact O-N 3.01Å; C357-H361 VanDerWaalsContact O-CB 3.28Å; C357-H361 WeakPolarHBondContact O-CB 3.41Å; C357-H361 PolarHBondContact O-N 2.74Å; C357-I368 HydrophobicContact CB-CD1 4.47Å; C357-I368 HydrophobicContact CB-CG2 4.27Å; C357-Y370 HydrophobicContact CB-CD2 4.34Å; C357-Y370 HydrophobicContact CB-CE2 4.48Å; C357-L373 HydrophobicContact CB-CD1 3.56Å; C357-N381 PolarHBondContact SG-O 3.4Å
358	A	94.3	Very high	92	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-40.4	179	0	0	0	0	0	113.5	T335 Y338 I341 L354 L360 H361 H362 Y370	T335-A358 HydrophobicContact CG2-CB 4.01Å; Y338-A358 HydrophobicContact CD1-CB 4.1Å; Y338-A358 HydrophobicContact CD2-CB 3.79Å; Y338-A358 HydrophobicContact CE1-CB 4.11Å; Y338-A358 HydrophobicContact CE2-CB 3.8Å; Y338-A358 HydrophobicContact CG-CB 3.93Å; Y338-A358 PolarHBondContact OH-O 3.48Å; I341-A358 HydrophobicContact CD1-CB 3.25Å; L354-A358 PolarHBondContact O-N 3.18Å; A358-L360 VanDerWaalsContact C-N 3.31Å; A358-L360 PolarHBondContact O-N 2.81Å; A358-H361 PolarHBondContact O-N 2.65Å; A358-H362 WeakPolarHBondContact O-CB 3.44Å; A358-H362 PolarHBondContact O-N 2.88Å; A358-Y370 HydrophobicContact CB-CD2 4.37Å; A358-Y370 HydrophobicContact CB-CE2 3.74Å
359	I	94.4	Very high	92.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-42.9	175.1	-71.3	171.1	0	0	0	110.5	W330 C331 V334 T335 F350 A355 F363 L419 I422	W330-I359 HydrophobicContact CH2-CG2 3.65Å; W330-I359 HydrophobicContact CZ3-CD1 4.33Å; W330-I359 HydrophobicContact CZ3-CG2 4.16Å; C331-I359 HydrophobicContact CB-CD1 4.24Å; V334-I359 HydrophobicContact CG1-CB 4.32Å; V334-I359 HydrophobicContact CG1-CG1 4.12Å; V334-I359 HydrophobicContact CG1-CG2 4.31Å; T335-I359 HydrophobicContact CG2-CD1 4.39Å; T335-I359 HydrophobicContact CG2-CG1 3.6Å; F350-I359 HydrophobicContact CE1-CD1 3.91Å; F350-I359 HydrophobicContact CZ-CD1 4.27Å; A355-I359 WeakPolarHBondContact O-CD1 3.47Å; A355-I359 VanDerWaalsContact O-CG1 3.26Å; A355-I359 WeakPolarHBondContact O-CG1 3.32Å; A355-I359 PolarHBondContact O-N 2.87Å; I359-F363 VanDerWaalsContact O-CD2 3.31Å; I359-F363 WeakPolarHBondContact O-CD2 3.4Å; I359-L419 HydrophobicContact CD1-CD2 4.29Å; I359-I422 HydrophobicContact CG2-CG2 3.81Å
360	L	93.1	Very high	92	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-72	-42	178.3	-71.7	169.1	0	0	0	112.1	F356 C357 A358 H362 F363 F364 I368 A385 V388 A389 L392 I422	F356-L360 WeakPolarHBondContact O-CG 3.17Å; F356-L360 PolarHBondContact O-N 3.38Å; C357-L360 PolarHBondContact O-N 3.01Å; A358-L360 VanDerWaalsContact C-N 3.31Å; A358-L360 PolarHBondContact O-N 2.81Å; L360-H362 VanDerWaalsContact C-N 3.3Å; L360-H362 PolarHBondContact O-N 3.2Å; L360-F363 PolarHBondContact O-N 3.16Å; L360-F364 PolarHBondContact O-N 3.16Å; L360-I368 HydrophobicContact CB-CD1 3.49Å; L360-I368 VanDerWaalsContact CB-CD1 3.49Å; L360-I368 HydrophobicContact CD1-CD1 4.12Å; L360-I368 HydrophobicContact CG-CD1 4.47Å; L360-A385 HydrophobicContact CD1-CB 4.08Å; L360-A385 VanDerWaalsContact CD1-O 3.23Å; L360-A385 WeakPolarHBondContact CD1-O 3.31Å; L360-V388 HydrophobicContact CD1-CB 4.48Å; L360-V388 HydrophobicContact CD1-CG1 4.41Å; L360-A389 HydrophobicContact CD1-CB 4.2Å; L360-A389 HydrophobicContact CD2-CB 4.5Å; L360-L392 HydrophobicContact CD2-CD1 4.19Å; L360-I422 HydrophobicContact CD2-CG2 4.15Å
361	H	93.4	Very high	91.8	Very high	45 Å²	45	43.9 Å²	43.9	21%	0.208	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-35.7	177.5	-177.6	-106.8	0	0	0	112.4	Y338 C357 A358 F363 F364 P365 I368	Y338-H361 AromaticContact CE1-ND1 3.59Å; Y338-H361 AromaticContact CZ-ND1 3.65Å; Y338-H361 PolarHBondContact OH-ND1 3.21Å; C357-H361 VanDerWaalsContact O-CB 3.28Å; C357-H361 WeakPolarHBondContact O-CB 3.41Å; C357-H361 PolarHBondContact O-N 2.74Å; A358-H361 PolarHBondContact O-N 2.65Å; H361-F363 VanDerWaalsContact C-N 3.26Å; H361-F363 PolarHBondContact O-N 3.5Å; H361-F364 CarbonylContact O-C 3.44Å; H361-F364 PolarHBondContact O-N 2.85Å; H361-P365 WeakPolarHBondContact O-CA 3.49Å; H361-P365 WeakPolarHBondContact O-CD 3.07Å; H361-P365 VanDerWaalsContact O-N 3.11Å; H361-I368 HydrophobicContact CB-CB 4.38Å; H361-I368 PolarHBondContact CD2-O 3.04Å
362	H	92.2	Very high	91.7	Very high	69 Å²	69	45.4 Å²	45.4	32%	0.319	23%	0.234	S	C	.	.	H	α-helix	trans	-60.3	-31.9	176.3	-177.3	91.4	0	0	0	113.6	V334 Y338 A358 L360	V334-H362 HydrophobicContact CG1-CB 3.8Å; V334-H362 PolarHBondContact O-ND1 3.36Å; Y338-H362 HydrophobicContact CE2-CB 4.43Å; Y338-H362 PolarHBondContact OH-N 2.99Å; A358-H362 WeakPolarHBondContact O-CB 3.44Å; A358-H362 PolarHBondContact O-N 2.88Å; L360-H362 VanDerWaalsContact C-N 3.3Å; L360-H362 PolarHBondContact O-N 3.2Å
363	F	91.4	Very high	91.7	Very high	33 Å²	33	44.6 Å²	44.6	15%	0.145	23%	0.229	C	C	.	.	H	α-helix	trans	-101.2	-20.5	177.1	-65.5	-79.9	0	0	0	113.5	W330 V334 I359 L360 H361 C426 T430 L446	W330-F363 AromaticContact CZ2-CE2 3.96Å; W330-F363 HydrophobicContact CZ2-CE2 3.96Å; W330-F363 HydrophobicContact CZ2-CZ 4.29Å; V334-F363 HydrophobicContact CG1-CE2 3.87Å; V334-F363 HydrophobicContact CG2-CE2 4.08Å; V334-F363 HydrophobicContact CG2-CZ 4.15Å; I359-F363 VanDerWaalsContact O-CD2 3.31Å; I359-F363 WeakPolarHBondContact O-CD2 3.4Å; L360-F363 PolarHBondContact O-N 3.16Å; H361-F363 VanDerWaalsContact C-N 3.26Å; H361-F363 PolarHBondContact O-N 3.5Å; F363-C426 HydrophobicContact CB-CB 4.37Å; F363-C426 HydrophobicContact CD1-CB 3.89Å; F363-C426 HydrophobicContact CD2-CB 3.51Å; F363-C426 WeakPolarHBondContact CD2-SG 3.35Å; F363-C426 HydrophobicContact CE1-CB 3.99Å; F363-C426 HydrophobicContact CE2-CB 3.63Å; F363-C426 HydrophobicContact CG-CB 3.66Å; F363-C426 HydrophobicContact CZ-CB 3.87Å; F363-T430 HydrophobicContact CD1-CG2 4.11Å; F363-T430 HydrophobicContact CE1-CG2 4.25Å; F363-L446 HydrophobicContact CE1-CD1 4.21Å
364	F	89.6	Confident	91.6	Very high	31 Å²	31	46.8 Å²	46.8	14%	0.136	24%	0.244	C	C	.	.			trans	-142.4	68.6	-174.2	-52.3	-70.7	0	0	0	110.7	L360 H361 D366 R367 L392 F425	L360-F364 PolarHBondContact O-N 3.16Å; H361-F364 CarbonylContact O-C 3.44Å; H361-F364 PolarHBondContact O-N 2.85Å; F364-D366 VanDerWaalsContact C-N 3.29Å; F364-D366 PolarHBondContact O-N 3.15Å; F364-R367 HydrophobicContact CB-CB 4.14Å; F364-R367 HydrophobicContact CB-CG 3.93Å; F364-R367 PolarHBondContact O-N 3.35Å; F364-R367 VanDerWaalsContact O-N 3.15Å; F364-L392 HydrophobicContact CD1-CD2 4.27Å; F364-L392 HydrophobicContact CD2-CD1 3.57Å; F364-L392 HydrophobicContact CD2-CD2 4.48Å; F364-L392 HydrophobicContact CE1-CD2 4.31Å; F364-L392 HydrophobicContact CE2-CD1 3.77Å; F364-L392 HydrophobicContact CG-CD1 4.11Å; F364-L392 HydrophobicContact CG-CD2 4.37Å; F364-L392 HydrophobicContact CZ-CD1 4.46Å; F364-L392 HydrophobicContact CZ-CD2 4.43Å; F364-F425 HydrophobicContact CE1-CE1 4.44Å; F364-F425 HydrophobicContact CE2-CD1 4.11Å; F364-F425 AromaticContact CE2-CE1 3.81Å; F364-F425 HydrophobicContact CE2-CE1 3.81Å; F364-F425 HydrophobicContact CZ-CD1 4.1Å; F364-F425 AromaticContact CZ-CE1 3.51Å; F364-F425 HydrophobicContact CZ-CE1 3.51Å
365	P	89.6	Confident	91.3	Very high	69 Å²	69	49.9 Å²	49.9	45%	0.448	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-56.8	-44.4	-177.3	20.8	-31.7	0	0	0	111.6	H361 R367 I368	H361-P365 WeakPolarHBondContact O-CA 3.49Å; H361-P365 WeakPolarHBondContact O-CD 3.07Å; H361-P365 VanDerWaalsContact O-N 3.11Å; P365-R367 PolarHBondContact O-N 2.7Å; P365-I368 PolarHBondContact O-N 3.13Å
366	D	89.2	Confident	91	Very high	136 Å²	136	57.4 Å²	57.4	73%	0.727	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-59.5	5.3	176.8	-46.2	-11.7	0	0	0	116.5	F364	F364-D366 VanDerWaalsContact C-N 3.29Å; F364-D366 PolarHBondContact O-N 3.15Å
367	R	89.2	Confident	90.8	Very high	142 Å²	142	61.9 Å²	61.9	54%	0.536	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-119.9	-14.9	-176.2	-63.2	-63.9	179.9	-83	-5.4	114.2	F364 P365 V388	F364-R367 HydrophobicContact CB-CB 4.14Å; F364-R367 HydrophobicContact CB-CG 3.93Å; F364-R367 PolarHBondContact O-N 3.35Å; F364-R367 VanDerWaalsContact O-N 3.15Å; P365-R367 PolarHBondContact O-N 2.7Å; R367-V388 HydrophobicContact CB-CG1 3.82Å
368	I	90.7	Very high	90.7	Very high	5 Å²	5	63.4 Å²	63.4	3%	0.026	34%	0.336	C	S	.	.			trans	-140.6	114.2	-177.6	-62.8	-179.9	0	0	0	107.7	C357 L360 H361 P365 Y370 L373 L384 V388	C357-I368 HydrophobicContact CB-CD1 4.47Å; C357-I368 HydrophobicContact CB-CG2 4.27Å; L360-I368 HydrophobicContact CB-CD1 3.49Å; L360-I368 VanDerWaalsContact CB-CD1 3.49Å; L360-I368 HydrophobicContact CD1-CD1 4.12Å; L360-I368 HydrophobicContact CG-CD1 4.47Å; H361-I368 HydrophobicContact CB-CB 4.38Å; H361-I368 PolarHBondContact CD2-O 3.04Å; P365-I368 PolarHBondContact O-N 3.13Å; I368-Y370 VanDerWaalsContact C-N 3.32Å; I368-Y370 PolarHBondContact O-N 3.14Å; I368-L373 HydrophobicContact CG2-CD1 3.94Å; I368-L384 HydrophobicContact CG2-CD2 4.46Å; I368-V388 HydrophobicContact CD1-CB 4.43Å; I368-V388 HydrophobicContact CD1-CG1 4.26Å; I368-V388 HydrophobicContact CD1-CG2 4.46Å; I368-V388 HydrophobicContact CG1-CB 4.4Å; I368-V388 HydrophobicContact CG1-CG1 4.2Å; I368-V388 HydrophobicContact CG1-CG2 3.97Å
369	D	91.8	Very high	90.7	Very high	106 Å²	106	66.3 Å²	66.3	57%	0.567	35%	0.351	S	S	*	.			trans	-71.8	91.8	165.5	178.3	-10.5	0	0	0	108.1	D371 S372	D369-D371 PolarHBondContact OD1-N 3.48Å; D369-S372 PolarHBondContact O-OG 3.46Å; D369-S372 PolarHBondContact OD1-N 3.2Å; D369-S372 VanDerWaalsContact OD1-N 3.15Å
370	Y	90.5	Very high	90.6	Very high	23 Å²	23	71.6 Å²	71.6	9%	0.09	38%	0.376	C	S	.	.	S	Bend	trans	-70.4	-34.4	-173.7	-177.1	-89.6	0	0	0	112.5	Y338 I341 C357 A358 I368 S372 L373	Y338-Y370 AromaticContact CD1-CD1 3.88Å; Y338-Y370 HydrophobicContact CD1-CD1 3.88Å; Y338-Y370 HydrophobicContact CD1-CD2 4.37Å; Y338-Y370 AromaticContact CD1-CE1 3.51Å; Y338-Y370 HydrophobicContact CD1-CE1 3.51Å; Y338-Y370 HydrophobicContact CD1-CE2 4.04Å; Y338-Y370 HydrophobicContact CD1-CG 4.3Å; Y338-Y370 AromaticContact CD1-CZ 3.61Å; Y338-Y370 AromaticContact CE1-CD1 3.96Å; Y338-Y370 HydrophobicContact CE1-CD1 3.96Å; Y338-Y370 HydrophobicContact CE1-CD2 4.12Å; Y338-Y370 HydrophobicContact CE1-CE1 4.06Å; Y338-Y370 HydrophobicContact CE1-CE2 4.22Å; Y338-Y370 HydrophobicContact CE1-CG 4Å; I341-Y370 HydrophobicContact CD1-CE2 4.18Å; I341-Y370 WeakPolarHBondContact CD1-OH 3.03Å; C357-Y370 HydrophobicContact CB-CD2 4.34Å; C357-Y370 HydrophobicContact CB-CE2 4.48Å; A358-Y370 HydrophobicContact CB-CD2 4.37Å; A358-Y370 HydrophobicContact CB-CE2 3.74Å; I368-Y370 VanDerWaalsContact C-N 3.32Å; I368-Y370 PolarHBondContact O-N 3.14Å; Y370-S372 PolarHBondContact O-N 3.24Å; Y370-L373 HydrophobicContact CD2-CD1 4.18Å; Y370-L373 WeakPolarHBondContact O-CB 3.26Å; Y370-L373 PolarHBondContact O-N 3.02Å; Y370-L373 VanDerWaalsContact O-N 3.09Å
371	D	88.6	Confident	90.7	Very high	153 Å²	153	71.7 Å²	71.7	82%	0.818	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-24.2	-177.1	-62.8	-32	0	0	0	112.2	D369 L373	D369-D371 PolarHBondContact OD1-N 3.48Å; D371-L373 VanDerWaalsContact C-N 3.26Å; D371-L373 PolarHBondContact O-N 3.35Å
372	S	89.2	Confident	90.7	Very high	78 Å²	78	69.6 Å²	69.6	55%	0.545	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.9	171.7	76.4	0	0	0	0	115.2	D369 Y370	D369-S372 PolarHBondContact O-OG 3.46Å; D369-S372 PolarHBondContact OD1-N 3.2Å; D369-S372 VanDerWaalsContact OD1-N 3.15Å; Y370-S372 PolarHBondContact O-N 3.24Å
373	L	90.4	Very high	90.8	Very high	34 Å²	34	71.5 Å²	71.5	18%	0.178	37%	0.371	C	S	.	.			trans	-90.6	130.6	-169.2	-57.6	178.2	0	0	0	113.4	L354 C357 I368 Y370 D371 L384	L354-L373 HydrophobicContact CD2-CB 3.72Å; L354-L373 HydrophobicContact CD2-CD1 4.47Å; C357-L373 HydrophobicContact CB-CD1 3.56Å; I368-L373 HydrophobicContact CG2-CD1 3.94Å; Y370-L373 HydrophobicContact CD2-CD1 4.18Å; Y370-L373 WeakPolarHBondContact O-CB 3.26Å; Y370-L373 PolarHBondContact O-N 3.02Å; Y370-L373 VanDerWaalsContact O-N 3.09Å; D371-L373 VanDerWaalsContact C-N 3.26Å; D371-L373 PolarHBondContact O-N 3.35Å; L373-L384 HydrophobicContact CD2-CD2 3.79Å
374	S	88.6	Confident	90.9	Very high	45 Å²	45	72.5 Å²	72.5	32%	0.315	38%	0.377	S	S	.	.			trans	-111	144.9	175.3	171.4	0	0	0	0	111.9	E376 N377 N381	S374-E376 PolarHBondContact O-N 3.17Å; S374-E376 PolarHBondContact OG-N 3.14Å; S374-N377 PolarHBondContact O-N 2.95Å; S374-N381 PolarHBondContact O-ND2 3.08Å
375	S	88.8	Confident	91.2	Very high	74 Å²	74	71 Å²	71	52%	0.517	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.8	173.9	57	0	0	0	0	113.6	N377	S375-N377 VanDerWaalsContact C-N 3.3Å; S375-N377 PolarHBondContact O-N 2.84Å
376	E	87.5	Confident	91.4	Very high	158 Å²	158	67.8 Å²	67.8	74%	0.738	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.2	-178.5	-61.6	-177.3	156.5	0	0	113.5	S374 P378	S374-E376 PolarHBondContact O-N 3.17Å; S374-E376 PolarHBondContact OG-N 3.14Å; E376-P378 WeakPolarHBondContact O-CD 3.37Å
377	N	90.9	Very high	91.6	Very high	95 Å²	95	64.2 Å²	64.2	51%	0.508	33%	0.331	S	S	.	.			trans	-112.5	53.9	-176	-69.7	-52.2	0	0	0	113.5	S374 S375 L379 Q380 N381	S374-N377 PolarHBondContact O-N 2.95Å; S375-N377 VanDerWaalsContact C-N 3.3Å; S375-N377 PolarHBondContact O-N 2.84Å; N377-L379 VanDerWaalsContact C-N 3.29Å; N377-L379 PolarHBondContact O-N 3.35Å; N377-L379 VanDerWaalsContact O-N 3.17Å; N377-Q380 HydrophobicContact CB-CB 4.26Å; N377-Q380 PolarHBondContact O-N 3.26Å; N377-N381 VanDerWaalsContact O-CG 3.3Å; N377-N381 PolarHBondContact O-N 2.88Å; N377-N381 PolarHBondContact O-OD1 3.39Å
378	P	91.6	Very high	91.9	Very high	32 Å²	32	58 Å²	58	21%	0.208	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-33.1	-168.7	27.8	-37.5	0	0	0	113.7	Q351 E376 C382 V404	Q351-P378 WeakPolarHBondContact O-CB 3.43Å; E376-P378 WeakPolarHBondContact O-CD 3.37Å; P378-C382 WeakPolarHBondContact O-CB 3.32Å; P378-C382 PolarHBondContact O-N 3.41Å; P378-C382 PolarHBondContact O-SG 3.05Å; P378-V404 HydrophobicContact CB-CG1 3.71Å; P378-V404 HydrophobicContact CB-CG2 4.1Å; P378-V404 HydrophobicContact CG-CG1 3.55Å; P378-V404 WeakPolarHBondContact O-CG2 3.3Å
379	L	93.1	Very high	92	Very high	62 Å²	62	57.7 Å²	57.7	33%	0.325	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-38.1	176.1	-174.7	63.3	0	0	0	112.2	N377 R383 P400 V404	N377-L379 VanDerWaalsContact C-N 3.29Å; N377-L379 PolarHBondContact O-N 3.35Å; N377-L379 VanDerWaalsContact O-N 3.17Å; L379-R383 WeakPolarHBondContact O-CB 3.18Å; L379-R383 VanDerWaalsContact O-CG 3.25Å; L379-R383 WeakPolarHBondContact O-CG 3.43Å; L379-R383 PolarHBondContact O-N 2.96Å; L379-R383 VanDerWaalsContact O-N 3.09Å; L379-P400 HydrophobicContact CD1-CB 3.83Å; L379-V404 HydrophobicContact CB-CG1 4.43Å
380	Q	93.6	Very high	92	Very high	112 Å²	112	55 Å²	55	52%	0.523	30%	0.296	S	S	.	.	H	α-helix	trans	-74.5	-40.9	178.6	-172.4	60.1	15.4	0	0	111	N377 C382 R383 L384	N377-Q380 HydrophobicContact CB-CB 4.26Å; N377-Q380 PolarHBondContact O-N 3.26Å; Q380-C382 PolarHBondContact O-N 3.44Å; Q380-R383 PolarHBondContact O-N 3.23Å; Q380-L384 WeakPolarHBondContact O-CB 3.47Å; Q380-L384 PolarHBondContact O-N 2.98Å
381	N	94.5	Very high	92.1	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-58.6	-48.8	175.3	-59.9	-13.9	0	0	0	111.3	N352 C357 S374 N377 R383 L384 A385	N352-N381 PolarHBondContact O-ND2 2.87Å; C357-N381 PolarHBondContact SG-O 3.4Å; S374-N381 PolarHBondContact O-ND2 3.08Å; N377-N381 VanDerWaalsContact O-CG 3.3Å; N377-N381 PolarHBondContact O-N 2.88Å; N377-N381 PolarHBondContact O-OD1 3.39Å; N381-R383 PolarHBondContact O-N 3.14Å; N381-L384 PolarHBondContact O-N 3.34Å; N381-A385 WeakPolarHBondContact O-CB 3.49Å; N381-A385 PolarHBondContact O-N 2.9Å
382	C	93.6	Very high	92.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-41.8	176.1	-75	0	0	0	0	112.5	G353 P378 Q380 F386 P400 V404	G353-C382 WeakPolarHBondContact CA-SG 3.19Å; P378-C382 WeakPolarHBondContact O-CB 3.32Å; P378-C382 PolarHBondContact O-N 3.41Å; P378-C382 PolarHBondContact O-SG 3.05Å; Q380-C382 PolarHBondContact O-N 3.44Å; C382-F386 HydrophobicContact CB-CZ 4.44Å; C382-F386 WeakPolarHBondContact O-CB 3.44Å; C382-F386 VanDerWaalsContact O-CD1 3.27Å; C382-F386 WeakPolarHBondContact O-CD1 3.36Å; C382-F386 WeakPolarHBondContact O-CG 3.14Å; C382-F386 PolarHBondContact O-N 3.08Å; C382-P400 HydrophobicContact CB-CB 3.88Å; C382-V404 HydrophobicContact CB-CG2 4.11Å; C382-V404 VanDerWaalsContact SG-CG2 3.6Å
383	R	94.2	Very high	92.1	Very high	109 Å²	109	55.8 Å²	55.8	41%	0.411	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-50.5	175	-79.1	171.8	178.8	-176.8	-0.4	111.7	L379 Q380 N381 A385 F386 D387 P400	L379-R383 WeakPolarHBondContact O-CB 3.18Å; L379-R383 VanDerWaalsContact O-CG 3.25Å; L379-R383 WeakPolarHBondContact O-CG 3.43Å; L379-R383 PolarHBondContact O-N 2.96Å; L379-R383 VanDerWaalsContact O-N 3.09Å; Q380-R383 PolarHBondContact O-N 3.23Å; N381-R383 PolarHBondContact O-N 3.14Å; R383-A385 PolarHBondContact O-N 3.23Å; R383-F386 PolarHBondContact O-N 3.19Å; R383-D387 WeakPolarHBondContact O-CB 3.4Å; R383-D387 VanDerWaalsContact O-CG 3.23Å; R383-D387 PolarHBondContact O-N 3.33Å; R383-P400 HydrophobicContact CB-CG 4.5Å; R383-P400 HydrophobicContact CG-CB 3.8Å; R383-P400 HydrophobicContact CG-CG 3.67Å
384	L	94.3	Very high	92.1	Very high	54 Å²	54	54.5 Å²	54.5	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-48.9	179.2	180	65.8	0	0	0	111.7	I368 L373 Q380 N381 F386 D387 V388	I368-L384 HydrophobicContact CG2-CD2 4.46Å; L373-L384 HydrophobicContact CD2-CD2 3.79Å; Q380-L384 WeakPolarHBondContact O-CB 3.47Å; Q380-L384 PolarHBondContact O-N 2.98Å; N381-L384 PolarHBondContact O-N 3.34Å; L384-F386 VanDerWaalsContact C-N 3.33Å; L384-F386 PolarHBondContact O-N 2.93Å; L384-D387 WeakPolarHBondContact O-CB 3.38Å; L384-D387 PolarHBondContact O-N 3.35Å; L384-V388 HydrophobicContact CD1-CG2 4.43Å; L384-V388 WeakPolarHBondContact O-CG2 3.45Å; L384-V388 PolarHBondContact O-N 2.98Å
385	A	94.4	Very high	92.1	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-42.8	178.1	0	0	0	0	0	112.2	F356 L360 N381 R383 V388 A389	F356-A385 HydrophobicContact CB-CB 3.61Å; L360-A385 HydrophobicContact CD1-CB 4.08Å; L360-A385 VanDerWaalsContact CD1-O 3.23Å; L360-A385 WeakPolarHBondContact CD1-O 3.31Å; N381-A385 WeakPolarHBondContact O-CB 3.49Å; N381-A385 PolarHBondContact O-N 2.9Å; R383-A385 PolarHBondContact O-N 3.23Å; A385-V388 PolarHBondContact O-N 3.45Å; A385-A389 VanDerWaalsContact O-CB 3.26Å; A385-A389 WeakPolarHBondContact O-CB 3.5Å; A385-A389 PolarHBondContact O-N 2.99Å
386	F	94.6	Very high	92	Very high	1 Å²	1	58.6 Å²	58.6	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-75	-27.9	-179.4	-60.2	0.6	0	0	0	111.7	F356 C382 R383 L384 S390 R396 L398 P400 V403 Y418	F356-F386 HydrophobicContact CD1-CE1 4.28Å; F356-F386 AromaticContact CD2-CE1 3.92Å; F356-F386 HydrophobicContact CD2-CE1 3.92Å; F356-F386 HydrophobicContact CD2-CZ 4.44Å; F356-F386 HydrophobicContact CE1-CE1 4.32Å; F356-F386 AromaticContact CE2-CE1 3.96Å; F356-F386 HydrophobicContact CE2-CE1 3.96Å; F356-F386 HydrophobicContact CE2-CZ 4.12Å; F356-F386 HydrophobicContact CG-CE1 4.08Å; F356-F386 HydrophobicContact CZ-CE1 4.16Å; F356-F386 HydrophobicContact CZ-CZ 4.36Å; C382-F386 HydrophobicContact CB-CZ 4.44Å; C382-F386 WeakPolarHBondContact O-CB 3.44Å; C382-F386 VanDerWaalsContact O-CD1 3.27Å; C382-F386 WeakPolarHBondContact O-CD1 3.36Å; C382-F386 WeakPolarHBondContact O-CG 3.14Å; C382-F386 PolarHBondContact O-N 3.08Å; R383-F386 PolarHBondContact O-N 3.19Å; L384-F386 VanDerWaalsContact C-N 3.33Å; L384-F386 PolarHBondContact O-N 2.93Å; F386-S390 WeakPolarHBondContact O-CB 3.31Å; F386-S390 PolarHBondContact O-N 2.94Å; F386-R396 PolarHBondContact O-NH1 3.43Å; F386-L398 HydrophobicContact CE2-CB 3.73Å; F386-L398 HydrophobicContact CZ-CB 4.05Å; F386-L398 HydrophobicContact CZ-CD1 4.2Å; F386-P400 HydrophobicContact CD2-CG 3.67Å; F386-P400 HydrophobicContact CE2-CG 3.95Å; F386-V403 HydrophobicContact CE2-CG2 4.45Å; F386-V403 HydrophobicContact CZ-CG2 4.24Å; F386-Y418 AromaticContact CD1-CE1 3.66Å; F386-Y418 HydrophobicContact CD1-CE1 3.66Å; F386-Y418 AromaticContact CD1-CZ 3.89Å; F386-Y418 WeakPolarHBondContact CD1-OH 3.46Å; F386-Y418 HydrophobicContact CE1-CD1 4.35Å; F386-Y418 AromaticContact CE1-CE1 3.51Å; F386-Y418 HydrophobicContact CE1-CE1 3.51Å; F386-Y418 HydrophobicContact CG-CE1 4.47Å; F386-Y418 HydrophobicContact CZ-CE1 4.19Å
387	D	94.1	Very high	92	Very high	61 Å²	61	54.1 Å²	54.1	33%	0.326	29%	0.285	S	S	.	.	H	α-helix	trans	-66	-47	171	-76.2	1.1	0	0	0	111.6	R383 L384 S390 K391 R396	R383-D387 WeakPolarHBondContact O-CB 3.4Å; R383-D387 VanDerWaalsContact O-CG 3.23Å; R383-D387 PolarHBondContact O-N 3.33Å; L384-D387 WeakPolarHBondContact O-CB 3.38Å; L384-D387 PolarHBondContact O-N 3.35Å; D387-S390 PolarHBondContact O-N 3.17Å; D387-K391 VanDerWaalsContact O-CG 3.31Å; D387-K391 WeakPolarHBondContact O-CG 3.29Å; D387-K391 PolarHBondContact O-N 3.04Å; D387-R396 IonicContact OD1-CZ 3.57Å; D387-R396 IonicContact OD1-NH1 3.01Å; D387-R396 PolarHBondContact OD1-NH1 2.95Å; D387-R396 IonicContact OD1-NH2 3.43Å; D387-R396 PolarHBondContact OD1-NH2 3.46Å
388	V	93.9	Very high	91.9	Very high	10 Å²	10	50.5 Å²	50.5	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-48.4	176.8	171.6	0	0	0	0	110.6	L360 R367 I368 L384 A385 S390 K391 L392	L360-V388 HydrophobicContact CD1-CB 4.48Å; L360-V388 HydrophobicContact CD1-CG1 4.41Å; R367-V388 HydrophobicContact CB-CG1 3.82Å; I368-V388 HydrophobicContact CD1-CB 4.43Å; I368-V388 HydrophobicContact CD1-CG1 4.26Å; I368-V388 HydrophobicContact CD1-CG2 4.46Å; I368-V388 HydrophobicContact CG1-CB 4.4Å; I368-V388 HydrophobicContact CG1-CG1 4.2Å; I368-V388 HydrophobicContact CG1-CG2 3.97Å; L384-V388 HydrophobicContact CD1-CG2 4.43Å; L384-V388 WeakPolarHBondContact O-CG2 3.45Å; L384-V388 PolarHBondContact O-N 2.98Å; A385-V388 PolarHBondContact O-N 3.45Å; V388-S390 VanDerWaalsContact C-N 3.3Å; V388-S390 PolarHBondContact O-N 3.33Å; V388-K391 PolarHBondContact O-N 3.3Å; V388-K391 VanDerWaalsContact O-N 3.14Å; V388-L392 HydrophobicContact CG1-CD1 3.86Å; V388-L392 HydrophobicContact CG1-CG 4.44Å; V388-L392 WeakPolarHBondContact O-CB 3.37Å; V388-L392 VanDerWaalsContact O-CG 3.29Å; V388-L392 WeakPolarHBondContact O-CG 3.24Å; V388-L392 PolarHBondContact O-N 3.48Å
389	A	93.2	Very high	91.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.1	-42.4	175.5	0	0	0	0	0	112.2	L360 A385 L392 G393 V394 Y418	L360-A389 HydrophobicContact CD1-CB 4.2Å; L360-A389 HydrophobicContact CD2-CB 4.5Å; A385-A389 VanDerWaalsContact O-CB 3.26Å; A385-A389 WeakPolarHBondContact O-CB 3.5Å; A385-A389 PolarHBondContact O-N 2.99Å; A389-L392 WeakPolarHBondContact O-CB 3.5Å; A389-L392 PolarHBondContact O-N 3.33Å; A389-G393 PolarHBondContact O-N 3.13Å; A389-V394 HydrophobicContact CB-CB 4.07Å; A389-V394 WeakPolarHBondContact O-CB 3.27Å; A389-V394 PolarHBondContact O-N 2.95Å; A389-Y418 WeakPolarHBondContact CB-OH 3.31Å
390	S	92.9	Very high	91.7	Very high	48 Å²	48	50.4 Å²	50.4	34%	0.336	26%	0.264	S	S	.	.	H	α-helix	trans	-66.4	-34.9	176.8	-175	0	0	0	0	113.4	F386 D387 V388 L392 G393 V394 R396	F386-S390 WeakPolarHBondContact O-CB 3.31Å; F386-S390 PolarHBondContact O-N 2.94Å; D387-S390 PolarHBondContact O-N 3.17Å; V388-S390 VanDerWaalsContact C-N 3.3Å; V388-S390 PolarHBondContact O-N 3.33Å; S390-L392 VanDerWaalsContact C-N 3.34Å; S390-G393 PolarHBondContact O-N 2.99Å; S390-V394 WeakPolarHBondContact CA-O 3.48Å; S390-R396 VanDerWaalsContact CB-NE 3.26Å; S390-R396 PolarHBondContact OG-NE 3.08Å
391	K	91.8	Very high	91.5	Very high	179 Å²	179	47.8 Å²	47.8	78%	0.778	26%	0.259	S	S	*	.	H	α-helix	trans	-71.6	-29.6	173.6	-73.7	170	-178.3	175.9	0	112.4	D387 V388	D387-K391 VanDerWaalsContact O-CG 3.31Å; D387-K391 WeakPolarHBondContact O-CG 3.29Å; D387-K391 PolarHBondContact O-N 3.04Å; V388-K391 PolarHBondContact O-N 3.3Å; V388-K391 VanDerWaalsContact O-N 3.14Å
392	L	89.1	Confident	91.2	Very high	38 Å²	38	53.7 Å²	53.7	20%	0.199	29%	0.286	C	S	.	.	H	α-helix	trans	-76.2	-23.5	175.6	-71.8	170.5	0	0	0	112.7	L360 F364 V388 A389 S390 F425	L360-L392 HydrophobicContact CD2-CD1 4.19Å; F364-L392 HydrophobicContact CD1-CD2 4.27Å; F364-L392 HydrophobicContact CD2-CD1 3.57Å; F364-L392 HydrophobicContact CD2-CD2 4.48Å; F364-L392 HydrophobicContact CE1-CD2 4.31Å; F364-L392 HydrophobicContact CE2-CD1 3.77Å; F364-L392 HydrophobicContact CG-CD1 4.11Å; F364-L392 HydrophobicContact CG-CD2 4.37Å; F364-L392 HydrophobicContact CZ-CD1 4.46Å; F364-L392 HydrophobicContact CZ-CD2 4.43Å; V388-L392 HydrophobicContact CG1-CD1 3.86Å; V388-L392 HydrophobicContact CG1-CG 4.44Å; V388-L392 WeakPolarHBondContact O-CB 3.37Å; V388-L392 VanDerWaalsContact O-CG 3.29Å; V388-L392 WeakPolarHBondContact O-CG 3.24Å; V388-L392 PolarHBondContact O-N 3.48Å; A389-L392 WeakPolarHBondContact O-CB 3.5Å; A389-L392 PolarHBondContact O-N 3.33Å; S390-L392 VanDerWaalsContact C-N 3.34Å; L392-F425 HydrophobicContact CB-CD1 4.35Å; L392-F425 HydrophobicContact CB-CE1 3.61Å; L392-F425 HydrophobicContact CB-CZ 3.73Å; L392-F425 HydrophobicContact CD1-CE1 4.18Å; L392-F425 HydrophobicContact CD2-CE1 4.11Å; L392-F425 HydrophobicContact CD2-CZ 4.31Å; L392-F425 HydrophobicContact CG-CE1 4.18Å; L392-F425 WeakPolarHBondContact O-CE2 3.5Å; L392-F425 WeakPolarHBondContact O-CZ 3.31Å
393	G	88.5	Confident	91	Very high	55 Å²	55	53.8 Å²	53.8	57%	0.567	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.2	3.9	177	0	0	0	0	0	114.9	A389 S390 P395	A389-G393 PolarHBondContact O-N 3.13Å; S390-G393 PolarHBondContact O-N 2.99Å; G393-P395 WeakPolarHBondContact O-CD 3.46Å
394	V	90	Very high	90.8	Very high	6 Å²	6	49.9 Å²	49.9	4%	0.036	28%	0.275	C	S	.	.			trans	-81	119.2	175	-178.3	0	0	0	0	109.5	A389 S390 Y418 Q421 I422 F425	A389-V394 HydrophobicContact CB-CB 4.07Å; A389-V394 WeakPolarHBondContact O-CB 3.27Å; A389-V394 PolarHBondContact O-N 2.95Å; S390-V394 WeakPolarHBondContact CA-O 3.48Å; V394-Y418 HydrophobicContact CG1-CD2 4.33Å; V394-Y418 HydrophobicContact CG1-CE2 3.76Å; V394-Q421 HydrophobicContact CG1-CB 3.89Å; V394-I422 HydrophobicContact CG1-CG1 4.22Å; V394-F425 HydrophobicContact CG2-CB 3.74Å; V394-F425 HydrophobicContact CG2-CD1 4.28Å; V394-F425 HydrophobicContact CG2-CD2 4.39Å; V394-F425 HydrophobicContact CG2-CG 3.85Å
395	P	88.5	Confident	90.4	Very high	82 Å²	82	49.1 Å²	49.1	53%	0.532	27%	0.274	S	S	.	.			trans	-64.9	139.9	-178.4	-22.6	34.6	0	0	0	113	G393 V397	G393-P395 WeakPolarHBondContact O-CD 3.46Å; P395-V397 PolarHBondContact O-N 3.03Å; P395-V397 VanDerWaalsContact O-N 3.17Å
396	R	87.7	Confident	89.6	Confident	123 Å²	123	59 Å²	59	46%	0.464	32%	0.316	S	S	.	.			trans	-72.8	108.7	173.9	-59.9	176.2	-169.7	-113.2	17.9	110.2	F386 D387 S390	F386-R396 PolarHBondContact O-NH1 3.43Å; D387-R396 IonicContact OD1-CZ 3.57Å; D387-R396 IonicContact OD1-NH1 3.01Å; D387-R396 PolarHBondContact OD1-NH1 2.95Å; D387-R396 IonicContact OD1-NH2 3.43Å; D387-R396 PolarHBondContact OD1-NH2 3.46Å; S390-R396 VanDerWaalsContact CB-NE 3.26Å; S390-R396 PolarHBondContact OG-NE 3.08Å
397	V	86.9	Confident	88.9	Confident	65 Å²	65	64.9 Å²	64.9	39%	0.394	36%	0.358	S	S	.	.			trans	-113.3	-1.8	174.5	-77	0	0	0	0	113.7	P395 Y418	P395-V397 PolarHBondContact O-N 3.03Å; P395-V397 VanDerWaalsContact O-N 3.17Å; V397-Y418 HydrophobicContact CG2-CD2 3.43Å; V397-Y418 VanDerWaalsContact CG2-CD2 3.43Å; V397-Y418 HydrophobicContact CG2-CE2 4.29Å; V397-Y418 HydrophobicContact CG2-CG 4.02Å
398	L	89.2	Confident	88.3	Confident	19 Å²	19	71 Å²	71	10%	0.099	38%	0.376	C	S	.	.	S	Bend	trans	-123.3	139.4	176.6	-60.4	178.6	0	0	0	110.4	F356 F386 V403 M415 Y418	F356-L398 HydrophobicContact CZ-CD1 4.36Å; F386-L398 HydrophobicContact CE2-CB 3.73Å; F386-L398 HydrophobicContact CZ-CB 4.05Å; F386-L398 HydrophobicContact CZ-CD1 4.2Å; L398-V403 HydrophobicContact CB-CG2 4.04Å; L398-V403 HydrophobicContact CD1-CG2 4.06Å; L398-M415 HydrophobicContact CD1-SD 3.69Å; L398-Y418 HydrophobicContact CD1-CD1 3.55Å; L398-Y418 HydrophobicContact CD1-CE1 4.36Å; L398-Y418 HydrophobicContact CD1-CG 3.86Å; L398-Y418 HydrophobicContact CG-CD1 4.25Å; L398-Y418 HydrophobicContact CG-CG 4.18Å
399	D	89.7	Confident	87.6	Confident	75 Å²	75	73.8 Å²	73.8	40%	0.401	40%	0.396	S	S	.	.			trans	-85.1	125.6	166.1	-174.4	-23.6	0	0	0	109.1	S401 E402 V403	D399-S401 PolarHBondContact O-N 2.91Å; D399-S401 VanDerWaalsContact O-N 3.09Å; D399-S401 WeakPolarHBondContact OD1-CB 3.3Å; D399-S401 PolarHBondContact OD1-N 3.43Å; D399-S401 PolarHBondContact OD1-OG 2.69Å; D399-E402 HydrophobicContact CB-CB 4.36Å; D399-E402 HydrophobicContact CB-CG 4.06Å; D399-E402 PolarHBondContact O-N 2.87Å; D399-E402 VanDerWaalsContact O-N 3.1Å; D399-V403 PolarHBondContact O-N 3.29Å
400	P	91.8	Very high	87.3	Confident	16 Å²	16	74.4 Å²	74.4	10%	0.104	40%	0.4	C	S	.	.	H	α-helix	trans	-48.3	-34	171.8	-29.6	36.4	0	0	0	114.2	L379 C382 R383 F386 V404	L379-P400 HydrophobicContact CD1-CB 3.83Å; C382-P400 HydrophobicContact CB-CB 3.88Å; R383-P400 HydrophobicContact CB-CG 4.5Å; R383-P400 HydrophobicContact CG-CB 3.8Å; R383-P400 HydrophobicContact CG-CG 3.67Å; F386-P400 HydrophobicContact CD2-CG 3.67Å; F386-P400 HydrophobicContact CE2-CG 3.95Å; P400-V404 WeakPolarHBondContact O-CB 3.41Å; P400-V404 WeakPolarHBondContact O-CG2 3.46Å; P400-V404 PolarHBondContact O-N 3.45Å; P400-V404 VanDerWaalsContact O-N 3.15Å
401	S	88.9	Confident	87	Confident	58 Å²	58	76 Å²	76	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-69.4	-37	-178	-38.3	0	0	0	0	112.3	D399	D399-S401 PolarHBondContact O-N 2.91Å; D399-S401 VanDerWaalsContact O-N 3.09Å; D399-S401 WeakPolarHBondContact OD1-CB 3.3Å; D399-S401 PolarHBondContact OD1-N 3.43Å; D399-S401 PolarHBondContact OD1-OG 2.69Å
402	E	87.6	Confident	86.9	Confident	128 Å²	128	70 Å²	70	60%	0.598	38%	0.381	S	S	*	.	H	α-helix	trans	-74.7	-38.9	177.2	-67.4	-172.6	153.8	0	0	111.7	D399 S405	D399-E402 HydrophobicContact CB-CB 4.36Å; D399-E402 HydrophobicContact CB-CG 4.06Å; D399-E402 PolarHBondContact O-N 2.87Å; D399-E402 VanDerWaalsContact O-N 3.1Å; E402-S405 PolarHBondContact O-N 3.47Å
403	V	89.3	Confident	86.8	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.012	40%	0.4	C	S	.	.	H	α-helix	trans	-65	-42.1	179.5	175.3	0	0	0	0	111.6	Q351 F356 F386 L398 D399 S405 M415	Q351-V403 WeakPolarHBondContact CG-O 3.09Å; F356-V403 HydrophobicContact CE2-CG1 4.19Å; F386-V403 HydrophobicContact CE2-CG2 4.45Å; F386-V403 HydrophobicContact CZ-CG2 4.24Å; L398-V403 HydrophobicContact CB-CG2 4.04Å; L398-V403 HydrophobicContact CD1-CG2 4.06Å; D399-V403 PolarHBondContact O-N 3.29Å; V403-S405 VanDerWaalsContact C-N 3.28Å; V403-S405 PolarHBondContact O-N 3.06Å; V403-M415 HydrophobicContact CG1-CE 4.5Å; V403-M415 HydrophobicContact CG1-SD 4.47Å; V403-M415 HydrophobicContact CG2-SD 4.21Å
404	V	90.9	Very high	86.9	Confident	26 Å²	26	73.1 Å²	73.1	16%	0.158	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-3.8	-174.5	174	0	0	0	0	112.8	P378 L379 C382 P400 K406	P378-V404 HydrophobicContact CB-CG1 3.71Å; P378-V404 HydrophobicContact CB-CG2 4.1Å; P378-V404 HydrophobicContact CG-CG1 3.55Å; P378-V404 WeakPolarHBondContact O-CG2 3.3Å; L379-V404 HydrophobicContact CB-CG1 4.43Å; C382-V404 HydrophobicContact CB-CG2 4.11Å; C382-V404 VanDerWaalsContact SG-CG2 3.6Å; P400-V404 WeakPolarHBondContact O-CB 3.41Å; P400-V404 WeakPolarHBondContact O-CG2 3.46Å; P400-V404 PolarHBondContact O-N 3.45Å; P400-V404 VanDerWaalsContact O-N 3.15Å; V404-K406 PolarHBondContact O-N 3.33Å; V404-K406 VanDerWaalsContact O-N 3.16Å
405	S	85.5	Confident	87	Confident	38 Å²	38	72.8 Å²	72.8	27%	0.266	39%	0.386	S	S	.	.			trans	-65	117.9	-172.3	105.1	0	0	0	0	112.1	Q351 E402 V403 S407 R408	Q351-S405 PolarHBondContact NE2-O 3.29Å; E402-S405 PolarHBondContact O-N 3.47Å; V403-S405 VanDerWaalsContact C-N 3.28Å; V403-S405 PolarHBondContact O-N 3.06Å; S405-S407 VanDerWaalsContact C-N 3.25Å; S405-S407 PolarHBondContact O-N 3.12Å; S405-R408 PolarHBondContact O-N 3.11Å; S405-R408 PolarHBondContact OG-N 3.22Å; S405-R408 PolarHBondContact OG-O 3.2Å
406	K	78.2	Confident	87.1	Confident	208 Å²	208	69.9 Å²	69.9	90%	0.904	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.9	179.8	-65.5	-176	179.6	-179.3	0	113.2	V404	V404-K406 PolarHBondContact O-N 3.33Å; V404-K406 VanDerWaalsContact O-N 3.16Å
407	S	78.6	Confident	87.2	Confident	125 Å²	125	64.8 Å²	64.8	87%	0.874	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-19.2	-178.1	-175.9	0	0	0	0	113.7	S405	S405-S407 VanDerWaalsContact C-N 3.25Å; S405-S407 PolarHBondContact O-N 3.12Å
408	R	82.6	Confident	87.5	Confident	190 Å²	190	61.8 Å²	61.8	72%	0.717	33%	0.33	S	S	*	.	S	Bend	trans	-150.3	122.2	-171.6	-177	179.3	178.7	-166.1	-1.7	109.8	S405	S405-R408 PolarHBondContact O-N 3.11Å; S405-R408 PolarHBondContact OG-N 3.22Å; S405-R408 PolarHBondContact OG-O 3.2Å
409	S	79.6	Confident	87.7	Confident	68 Å²	68	60.9 Å²	60.9	48%	0.476	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-62.7	142.3	170.2	45.6	0	0	0	0	110.6
410	P	86.1	Confident	87.8	Confident	13 Å²	13	58.1 Å²	58.1	8%	0.084	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-61.1	152.7	176.2	25.5	-34.2	0	0	0	110.8	T347 L412 M415	T347-P410 WeakPolarHBondContact CG2-O 3.26Å; P410-L412 PolarHBondContact O-N 3.36Å; P410-M415 HydrophobicContact CB-CG 3.73Å; P410-M415 HydrophobicContact CB-SD 3.74Å; P410-M415 HydrophobicContact CG-CE 4.12Å; P410-M415 HydrophobicContact CG-CG 3.8Å; P410-M415 HydrophobicContact CG-SD 3.77Å
411	D	87.5	Confident	87.7	Confident	83 Å²	83	58.3 Å²	58.3	44%	0.444	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-62.7	123.9	177	167.7	54.6	0	0	0	110.9	L413 S414 M415	D411-L413 VanDerWaalsContact C-N 3.27Å; D411-L413 PolarHBondContact O-N 2.79Å; D411-L413 PolarHBondContact OD1-N 3.15Å; D411-L413 WeakPolarHBondContact OD2-CB 3.4Å; D411-L413 PolarHBondContact OD2-N 3.33Å; D411-S414 WeakPolarHBondContact O-CB 3.41Å; D411-S414 PolarHBondContact O-N 2.93Å; D411-S414 WeakPolarHBondContact OD2-CB 3.49Å; D411-S414 PolarHBondContact OD2-N 3.48Å; D411-S414 PolarHBondContact OD2-OG 3.35Å; D411-M415 WeakPolarHBondContact O-CG 3.31Å; D411-M415 PolarHBondContact O-N 2.84Å
412	L	89.8	Confident	87.9	Confident	52 Å²	52	55.6 Å²	55.6	27%	0.272	29%	0.29	S	S	.	.	H	α-helix	trans	-56.2	-40.4	-178.4	174.1	71.1	0	0	0	112.4	L346 T347 P410 M415 M416	L346-L412 HydrophobicContact CB-CD1 4.05Å; T347-L412 HydrophobicContact CG2-CB 3.98Å; T347-L412 HydrophobicContact CG2-CD1 4.01Å; P410-L412 PolarHBondContact O-N 3.36Å; L412-M415 PolarHBondContact O-N 3.27Å; L412-M416 HydrophobicContact CD1-CG 4.12Å; L412-M416 HydrophobicContact CD1-SD 4.15Å; L412-M416 HydrophobicContact CG-CG 4.39Å; L412-M416 HydrophobicContact CG-SD 4.13Å; L412-M416 WeakPolarHBondContact O-CB 3.31Å; L412-M416 VanDerWaalsContact O-CG 3.31Å; L412-M416 WeakPolarHBondContact O-CG 3.33Å; L412-M416 PolarHBondContact O-N 3.39Å
413	L	87	Confident	88.1	Confident	111 Å²	111	50.4 Å²	50.4	58%	0.581	27%	0.265	S	S	*	.	H	α-helix	trans	-68.7	-40.9	-177.4	179.7	62.2	0	0	0	110.6	D411 T417	D411-L413 VanDerWaalsContact C-N 3.27Å; D411-L413 PolarHBondContact O-N 2.79Å; D411-L413 PolarHBondContact OD1-N 3.15Å; D411-L413 WeakPolarHBondContact OD2-CB 3.4Å; D411-L413 PolarHBondContact OD2-N 3.33Å; L413-T417 VanDerWaalsContact O-CB 3.31Å; L413-T417 WeakPolarHBondContact O-CB 3.39Å; L413-T417 PolarHBondContact O-N 3.29Å; L413-T417 PolarHBondContact O-OG1 3.18Å
414	S	89.2	Confident	88	Confident	47 Å²	47	50.7 Å²	50.7	33%	0.329	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-46.1	174.9	-56	0	0	0	0	111.5	D411 T417 Y418	D411-S414 WeakPolarHBondContact O-CB 3.41Å; D411-S414 PolarHBondContact O-N 2.93Å; D411-S414 WeakPolarHBondContact OD2-CB 3.49Å; D411-S414 PolarHBondContact OD2-N 3.48Å; D411-S414 PolarHBondContact OD2-OG 3.35Å; S414-T417 PolarHBondContact O-N 3.43Å; S414-Y418 PolarHBondContact O-N 3.43Å
415	M	92.2	Very high	87.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-49.9	174.9	-67	-66.3	-73.1	0	0	112.4	L346 T347 F350 F356 L398 V403 P410 D411 L412 T417 Y418 L419	L346-M415 WeakPolarHBondContact O-CB 3.44Å; T347-M415 HydrophobicContact CG2-CG 4.48Å; F350-M415 HydrophobicContact CB-CE 3.37Å; F350-M415 HydrophobicContact CD2-CE 4.41Å; F350-M415 HydrophobicContact CG-CE 3.94Å; F356-M415 HydrophobicContact CE2-CE 4.07Å; F356-M415 HydrophobicContact CZ-CE 3.62Å; F356-M415 HydrophobicContact CZ-SD 4.27Å; L398-M415 HydrophobicContact CD1-SD 3.69Å; V403-M415 HydrophobicContact CG1-CE 4.5Å; V403-M415 HydrophobicContact CG1-SD 4.47Å; V403-M415 HydrophobicContact CG2-SD 4.21Å; P410-M415 HydrophobicContact CB-CG 3.73Å; P410-M415 HydrophobicContact CB-SD 3.74Å; P410-M415 HydrophobicContact CG-CE 4.12Å; P410-M415 HydrophobicContact CG-CG 3.8Å; P410-M415 HydrophobicContact CG-SD 3.77Å; D411-M415 WeakPolarHBondContact O-CG 3.31Å; D411-M415 PolarHBondContact O-N 2.84Å; L412-M415 PolarHBondContact O-N 3.27Å; M415-T417 VanDerWaalsContact C-N 3.29Å; M415-T417 PolarHBondContact O-N 3.21Å; M415-Y418 PolarHBondContact O-N 2.82Å; M415-L419 WeakPolarHBondContact O-CB 3.39Å; M415-L419 WeakPolarHBondContact O-CG 3.39Å; M415-L419 PolarHBondContact O-N 2.68Å
416	M	91.6	Very high	87.9	Confident	21 Å²	21	49.5 Å²	49.5	10%	0.103	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-41	176.5	-78.3	-174	59.7	0	0	111.9	R324 L327 L346 L412 H420	R324-M416 HydrophobicContact CB-CE 3.84Å; R324-M416 HydrophobicContact CB-SD 3.87Å; R324-M416 HydrophobicContact CG-CE 4.46Å; R324-M416 HydrophobicContact CG-SD 3.93Å; L327-M416 HydrophobicContact CD2-CB 4.16Å; L327-M416 HydrophobicContact CD2-CG 4.15Å; L346-M416 HydrophobicContact CB-CG 4.48Å; L346-M416 HydrophobicContact CD1-CG 3.68Å; L346-M416 HydrophobicContact CD1-SD 4.31Å; L412-M416 HydrophobicContact CD1-CG 4.12Å; L412-M416 HydrophobicContact CD1-SD 4.15Å; L412-M416 HydrophobicContact CG-CG 4.39Å; L412-M416 HydrophobicContact CG-SD 4.13Å; L412-M416 WeakPolarHBondContact O-CB 3.31Å; L412-M416 VanDerWaalsContact O-CG 3.31Å; L412-M416 WeakPolarHBondContact O-CG 3.33Å; L412-M416 PolarHBondContact O-N 3.39Å; M416-H420 WeakPolarHBondContact O-CB 3.43Å; M416-H420 PolarHBondContact O-CD2 2.82Å; M416-H420 PolarHBondContact O-N 3.45Å
417	T	88.4	Confident	88	Confident	16 Å²	16	41 Å²	41	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-64.6	-43.4	179.8	-58.3	0	0	0	0	111.3	L413 S414 M415 H420 Q421 A511 L515	L413-T417 VanDerWaalsContact O-CB 3.31Å; L413-T417 WeakPolarHBondContact O-CB 3.39Å; L413-T417 PolarHBondContact O-N 3.29Å; L413-T417 PolarHBondContact O-OG1 3.18Å; S414-T417 PolarHBondContact O-N 3.43Å; M415-T417 VanDerWaalsContact C-N 3.29Å; M415-T417 PolarHBondContact O-N 3.21Å; T417-H420 PolarHBondContact O-N 2.95Å; T417-Q421 WeakPolarHBondContact O-CG 3.23Å; T417-Q421 PolarHBondContact O-N 3.39Å; T417-Q421 VanDerWaalsContact O-N 3.08Å; T417-A511 HydrophobicContact CG2-CB 4.4Å; T417-L515 HydrophobicContact CG2-CD1 4Å
418	Y	93.3	Very high	87.6	Confident	1 Å²	1	39.6 Å²	39.6	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-70.4	-43.1	179	-173.3	-121.4	0	0	0	112.9	F356 F386 A389 V394 V397 L398 S414 M415 H420 Q421 I422	F356-Y418 HydrophobicContact CD1-CD1 4.5Å; F356-Y418 HydrophobicContact CD1-CE1 4.3Å; F356-Y418 AromaticContact CE1-CD1 3.78Å; F356-Y418 HydrophobicContact CE1-CD1 3.78Å; F356-Y418 AromaticContact CE1-CE1 3.99Å; F356-Y418 HydrophobicContact CE1-CE1 3.99Å; F356-Y418 HydrophobicContact CZ-CD1 4.31Å; F386-Y418 AromaticContact CD1-CE1 3.66Å; F386-Y418 HydrophobicContact CD1-CE1 3.66Å; F386-Y418 AromaticContact CD1-CZ 3.89Å; F386-Y418 WeakPolarHBondContact CD1-OH 3.46Å; F386-Y418 HydrophobicContact CE1-CD1 4.35Å; F386-Y418 AromaticContact CE1-CE1 3.51Å; F386-Y418 HydrophobicContact CE1-CE1 3.51Å; F386-Y418 HydrophobicContact CG-CE1 4.47Å; F386-Y418 HydrophobicContact CZ-CE1 4.19Å; A389-Y418 WeakPolarHBondContact CB-OH 3.31Å; V394-Y418 HydrophobicContact CG1-CD2 4.33Å; V394-Y418 HydrophobicContact CG1-CE2 3.76Å; V397-Y418 HydrophobicContact CG2-CD2 3.43Å; V397-Y418 VanDerWaalsContact CG2-CD2 3.43Å; V397-Y418 HydrophobicContact CG2-CE2 4.29Å; V397-Y418 HydrophobicContact CG2-CG 4.02Å; L398-Y418 HydrophobicContact CD1-CD1 3.55Å; L398-Y418 HydrophobicContact CD1-CE1 4.36Å; L398-Y418 HydrophobicContact CD1-CG 3.86Å; L398-Y418 HydrophobicContact CG-CD1 4.25Å; L398-Y418 HydrophobicContact CG-CG 4.18Å; S414-Y418 PolarHBondContact O-N 3.43Å; M415-Y418 PolarHBondContact O-N 2.82Å; Y418-H420 VanDerWaalsContact C-N 3.25Å; Y418-H420 PolarHBondContact O-N 3.29Å; Y418-Q421 WeakPolarHBondContact O-CA 3.39Å; Y418-Q421 WeakPolarHBondContact O-CB 3.38Å; Y418-Q421 PolarHBondContact O-N 2.69Å; Y418-I422 HydrophobicContact CD1-CD1 4.05Å; Y418-I422 HydrophobicContact CE1-CD1 3.67Å; Y418-I422 HydrophobicContact CE1-CG1 4.46Å; Y418-I422 PolarHBondContact O-N 3.04Å
419	L	94	Very high	86.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-34.6	175.1	-72.6	171.4	0	0	0	112.2	L327 L346 F350 F356 I359 M415 I422 R423	L327-L419 HydrophobicContact CD1-CB 4.13Å; L327-L419 HydrophobicContact CD2-CB 3.88Å; L327-L419 HydrophobicContact CG-CB 4.37Å; L346-L419 HydrophobicContact CB-CD1 4.48Å; L346-L419 HydrophobicContact CD2-CD1 3.94Å; F350-L419 HydrophobicContact CD1-CD2 4.17Å; F350-L419 HydrophobicContact CD2-CD1 4.42Å; F350-L419 HydrophobicContact CE1-CD1 4.06Å; F350-L419 HydrophobicContact CE1-CD2 3.51Å; F350-L419 HydrophobicContact CE1-CG 4.41Å; F350-L419 HydrophobicContact CE2-CD1 3.89Å; F350-L419 HydrophobicContact CZ-CD1 3.68Å; F350-L419 HydrophobicContact CZ-CD2 3.86Å; F350-L419 HydrophobicContact CZ-CG 4.45Å; F356-L419 HydrophobicContact CD1-CD2 4.01Å; F356-L419 HydrophobicContact CE1-CD2 3.59Å; F356-L419 HydrophobicContact CE1-CG 4.19Å; I359-L419 HydrophobicContact CD1-CD2 4.29Å; M415-L419 WeakPolarHBondContact O-CB 3.39Å; M415-L419 WeakPolarHBondContact O-CG 3.39Å; M415-L419 PolarHBondContact O-N 2.68Å; L419-I422 PolarHBondContact O-N 3.2Å; L419-R423 WeakPolarHBondContact O-CB 3.49Å; L419-R423 PolarHBondContact O-N 3.5Å
420	H	92	Very high	85.3	Confident	17 Å²	17	35.1 Å²	35.1	8%	0.079	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-41.4	169.3	-78.5	-49.7	0	0	0	112.5	M416 T417 Y418 I422 R423 T424 Y504 L508	M416-H420 WeakPolarHBondContact O-CB 3.43Å; M416-H420 PolarHBondContact O-CD2 2.82Å; M416-H420 PolarHBondContact O-N 3.45Å; T417-H420 PolarHBondContact O-N 2.95Å; Y418-H420 VanDerWaalsContact C-N 3.25Å; Y418-H420 PolarHBondContact O-N 3.29Å; H420-I422 VanDerWaalsContact C-N 3.29Å; H420-I422 PolarHBondContact O-N 2.91Å; H420-R423 PolarHBondContact O-N 3.24Å; H420-T424 PolarHBondContact O-N 3.43Å; H420-T424 PolarHBondContact O-OG1 3.34Å; H420-Y504 VanDerWaalsContact C-OH 3.24Å; H420-Y504 WeakPolarHBondContact CA-OH 3.44Å; H420-Y504 HydrophobicContact CB-CE2 4.16Å; H420-Y504 WeakPolarHBondContact CB-OH 3.4Å; H420-Y504 AromaticContact CE1-CE2 3.82Å; H420-Y504 AromaticContact CG-CE2 3.86Å; H420-Y504 AromaticContact ND1-CE2 3.24Å; H420-Y504 WeakPolarHBondContact ND1-CE2 3.25Å; H420-Y504 AromaticContact ND1-CZ 3.69Å; H420-Y504 PolarHBondContact ND1-OH 3.14Å; H420-Y504 PolarHBondContact O-OH 3.44Å; H420-L508 HydrophobicContact CB-CD2 3.96Å
421	Q	90.1	Very high	83.7	Confident	20 Å²	20	40.9 Å²	40.9	9%	0.093	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-34.8	175.2	-67.4	172.1	15.4	0	0	113.2	V394 T417 Y418 T424 F425	V394-Q421 HydrophobicContact CG1-CB 3.89Å; T417-Q421 WeakPolarHBondContact O-CG 3.23Å; T417-Q421 PolarHBondContact O-N 3.39Å; T417-Q421 VanDerWaalsContact O-N 3.08Å; Y418-Q421 WeakPolarHBondContact O-CA 3.39Å; Y418-Q421 WeakPolarHBondContact O-CB 3.38Å; Y418-Q421 PolarHBondContact O-N 2.69Å; Q421-T424 VanDerWaalsContact C-OG1 3.26Å; Q421-T424 VanDerWaalsContact CA-OG1 3.31Å; Q421-T424 WeakPolarHBondContact CA-OG1 3.49Å; Q421-T424 PolarHBondContact O-OG1 3.23Å; Q421-F425 PolarHBondContact O-N 2.99Å
422	I	91.5	Very high	81.6	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-67.9	-49.2	171.7	-64.1	172.5	0	0	0	110.3	W330 F356 I359 L360 V394 Y418 L419 H420 T424 F425 C426	W330-I422 HydrophobicContact CH2-CG2 4.48Å; F356-I422 HydrophobicContact CD1-CD1 4.13Å; I359-I422 HydrophobicContact CG2-CG2 3.81Å; L360-I422 HydrophobicContact CD2-CG2 4.15Å; V394-I422 HydrophobicContact CG1-CG1 4.22Å; Y418-I422 HydrophobicContact CD1-CD1 4.05Å; Y418-I422 HydrophobicContact CE1-CD1 3.67Å; Y418-I422 HydrophobicContact CE1-CG1 4.46Å; Y418-I422 PolarHBondContact O-N 3.04Å; L419-I422 PolarHBondContact O-N 3.2Å; H420-I422 VanDerWaalsContact C-N 3.29Å; H420-I422 PolarHBondContact O-N 2.91Å; I422-T424 VanDerWaalsContact C-N 3.35Å; I422-T424 PolarHBondContact O-N 3.26Å; I422-F425 PolarHBondContact O-N 3.26Å; I422-F425 VanDerWaalsContact O-N 3.12Å; I422-C426 PolarHBondContact O-N 3.26Å; I422-C426 PolarHBondContact O-SG 3.47Å; I422-C426 VanDerWaalsContact O-SG 3.33Å
423	R	92.8	Very high	79.8	Confident	19 Å²	19	44.4 Å²	44.4	7%	0.072	22%	0.219	C	C	.	.	H	α-helix	trans	-59.9	-38	179.9	177.3	176.4	-178.6	-164.5	-2.4	113.5	D326 W330 L419 H420 C427 C453 Y504	D326-R423 IonicContact OD2-CZ 2.74Å; D326-R423 VanDerWaalsContact OD2-CZ 3.26Å; D326-R423 IonicContact OD2-NH1 2.68Å; D326-R423 PolarHBondContact OD2-NH1 3.08Å; D326-R423 IonicContact OD2-NH2 2.67Å; D326-R423 PolarHBondContact OD2-NH2 3.18Å; W330-R423 HydrophobicContact CD2-CB 4.17Å; W330-R423 HydrophobicContact CD2-CG 3.82Å; W330-R423 HydrophobicContact CE3-CB 4.07Å; W330-R423 HydrophobicContact CE3-CG 4.2Å; W330-R423 HydrophobicContact CG-CG 4.33Å; W330-R423 HydrophobicContact CH2-CB 3.6Å; W330-R423 HydrophobicContact CH2-CG 4.16Å; W330-R423 HydrophobicContact CZ2-CB 3.69Å; W330-R423 HydrophobicContact CZ2-CG 3.76Å; W330-R423 HydrophobicContact CZ3-CB 3.8Å; W330-R423 HydrophobicContact CZ3-CG 4.37Å; L419-R423 WeakPolarHBondContact O-CB 3.49Å; L419-R423 PolarHBondContact O-N 3.5Å; H420-R423 PolarHBondContact O-N 3.24Å; R423-C427 VanDerWaalsContact O-CB 3.3Å; R423-C427 WeakPolarHBondContact O-CB 3.26Å; R423-C427 PolarHBondContact O-N 2.99Å; R423-C427 VanDerWaalsContact O-N 3.12Å; R423-C427 PolarHBondContact O-SG 3.38Å; R423-C427 VanDerWaalsContact O-SG 3.35Å; R423-C453 PolarHBondContact NH2-SG 3.26Å; R423-Y504 WeakPolarHBondContact CB-OH 3.31Å; R423-Y504 HydrophobicContact CG-CE1 4.29Å
424	T	87.4	Confident	77.7	Confident	8 Å²	8	43.4 Å²	43.4	5%	0.049	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-56.2	170.8	26.7	0	0	0	0	110.7	H420 Q421 I422 C426 C427 E428 Y504 L508	H420-T424 PolarHBondContact O-N 3.43Å; H420-T424 PolarHBondContact O-OG1 3.34Å; Q421-T424 VanDerWaalsContact C-OG1 3.26Å; Q421-T424 VanDerWaalsContact CA-OG1 3.31Å; Q421-T424 WeakPolarHBondContact CA-OG1 3.49Å; Q421-T424 PolarHBondContact O-OG1 3.23Å; I422-T424 VanDerWaalsContact C-N 3.35Å; I422-T424 PolarHBondContact O-N 3.26Å; T424-C426 VanDerWaalsContact C-N 3.35Å; T424-C426 PolarHBondContact O-N 3.01Å; T424-C427 PolarHBondContact O-N 3.13Å; T424-E428 VanDerWaalsContact CB-OE1 3.3Å; T424-E428 WeakPolarHBondContact CB-OE1 3.33Å; T424-E428 WeakPolarHBondContact CG2-OE1 3.37Å; T424-E428 VanDerWaalsContact O-CB 3.3Å; T424-E428 WeakPolarHBondContact O-CB 3.38Å; T424-E428 VanDerWaalsContact O-CG 3.27Å; T424-E428 WeakPolarHBondContact O-CG 3.21Å; T424-E428 PolarHBondContact O-N 2.97Å; T424-Y504 HydrophobicContact CG2-CD1 4.14Å; T424-Y504 HydrophobicContact CG2-CE1 3.42Å; T424-Y504 VanDerWaalsContact CG2-CE1 3.42Å; T424-L508 HydrophobicContact CG2-CD1 3.16Å; T424-L508 HydrophobicContact CG2-CD2 3.73Å; T424-L508 HydrophobicContact CG2-CG 4.06Å
425	F	87.5	Confident	75.5	Confident	38 Å²	38	49.6 Å²	49.6	17%	0.167	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-44.9	-171.7	-179.1	-93	0	0	0	111.9	F364 L392 V394 Q421 I422 R429	F364-F425 HydrophobicContact CE1-CE1 4.44Å; F364-F425 HydrophobicContact CE2-CD1 4.11Å; F364-F425 AromaticContact CE2-CE1 3.81Å; F364-F425 HydrophobicContact CE2-CE1 3.81Å; F364-F425 HydrophobicContact CZ-CD1 4.1Å; F364-F425 AromaticContact CZ-CE1 3.51Å; F364-F425 HydrophobicContact CZ-CE1 3.51Å; L392-F425 HydrophobicContact CB-CD1 4.35Å; L392-F425 HydrophobicContact CB-CE1 3.61Å; L392-F425 HydrophobicContact CB-CZ 3.73Å; L392-F425 HydrophobicContact CD1-CE1 4.18Å; L392-F425 HydrophobicContact CD2-CE1 4.11Å; L392-F425 HydrophobicContact CD2-CZ 4.31Å; L392-F425 HydrophobicContact CG-CE1 4.18Å; L392-F425 WeakPolarHBondContact O-CE2 3.5Å; L392-F425 WeakPolarHBondContact O-CZ 3.31Å; V394-F425 HydrophobicContact CG2-CB 3.74Å; V394-F425 HydrophobicContact CG2-CD1 4.28Å; V394-F425 HydrophobicContact CG2-CD2 4.39Å; V394-F425 HydrophobicContact CG2-CG 3.85Å; Q421-F425 PolarHBondContact O-N 2.99Å; I422-F425 PolarHBondContact O-N 3.26Å; I422-F425 VanDerWaalsContact O-N 3.12Å; F425-R429 PolarHBondContact O-N 3.47Å
426	C	86.8	Confident	72.7	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-46.6	176.5	-62.5	0	0	0	0	112.1	F363 I422 T424 T430	F363-C426 HydrophobicContact CB-CB 4.37Å; F363-C426 HydrophobicContact CD1-CB 3.89Å; F363-C426 HydrophobicContact CD2-CB 3.51Å; F363-C426 WeakPolarHBondContact CD2-SG 3.35Å; F363-C426 HydrophobicContact CE1-CB 3.99Å; F363-C426 HydrophobicContact CE2-CB 3.63Å; F363-C426 HydrophobicContact CG-CB 3.66Å; F363-C426 HydrophobicContact CZ-CB 3.87Å; I422-C426 PolarHBondContact O-N 3.26Å; I422-C426 PolarHBondContact O-SG 3.47Å; I422-C426 VanDerWaalsContact O-SG 3.33Å; T424-C426 VanDerWaalsContact C-N 3.35Å; T424-C426 PolarHBondContact O-N 3.01Å; C426-T430 PolarHBondContact O-N 3.48Å
427	C	79.7	Confident	70	Confident	29 Å²	29	59.6 Å²	59.6	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-79.5	-17.9	-177.3	-65.1	0	0	0	0	114.9	R423 T424 T430	R423-C427 VanDerWaalsContact O-CB 3.3Å; R423-C427 WeakPolarHBondContact O-CB 3.26Å; R423-C427 PolarHBondContact O-N 2.99Å; R423-C427 VanDerWaalsContact O-N 3.12Å; R423-C427 PolarHBondContact O-SG 3.38Å; R423-C427 VanDerWaalsContact O-SG 3.35Å; T424-C427 PolarHBondContact O-N 3.13Å; C427-T430 PolarHBondContact O-OG1 3.02Å
428	E	69.5	Low	67.2	Low	97 Å²	97	64.9 Å²	64.9	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-76.7	-38	172	-78.5	164	-149.6	0	0	110.9	T424 N432	T424-E428 VanDerWaalsContact CB-OE1 3.3Å; T424-E428 WeakPolarHBondContact CB-OE1 3.33Å; T424-E428 WeakPolarHBondContact CG2-OE1 3.37Å; T424-E428 VanDerWaalsContact O-CB 3.3Å; T424-E428 WeakPolarHBondContact O-CB 3.38Å; T424-E428 VanDerWaalsContact O-CG 3.27Å; T424-E428 WeakPolarHBondContact O-CG 3.21Å; T424-E428 PolarHBondContact O-N 2.97Å; E428-N432 PolarHBondContact O-ND2 3.39Å
429	R	59.3	Low	64.1	Low	139 Å²	139	69.7 Å²	69.7	53%	0.525	37%	0.368	S	S	.	.	H	α-helix	trans	-79.6	-32.4	-175.3	-160	169.5	-173.4	84.7	5.1	113.9	F425 K431 N432 I433	F425-R429 PolarHBondContact O-N 3.47Å; R429-K431 VanDerWaalsContact C-N 3.29Å; R429-K431 PolarHBondContact O-N 2.97Å; R429-N432 PolarHBondContact O-N 3.4Å; R429-I433 HydrophobicContact CG-CD1 4.27Å; R429-I433 WeakPolarHBondContact O-CG1 3.27Å; R429-I433 PolarHBondContact O-N 2.97Å
430	T	55.4	Low	60.9	Low	25 Å²	25	75.1 Å²	75.1	15%	0.153	40%	0.401	C	S	.	.	H	α-helix	trans	-57.3	-44.5	174.7	53.3	0	0	0	0	111.4	F363 C426 C427 N432 I433 D434 L446	F363-T430 HydrophobicContact CD1-CG2 4.11Å; F363-T430 HydrophobicContact CE1-CG2 4.25Å; C426-T430 PolarHBondContact O-N 3.48Å; C427-T430 PolarHBondContact O-OG1 3.02Å; T430-N432 PolarHBondContact O-N 3.37Å; T430-I433 PolarHBondContact O-N 2.66Å; T430-D434 PolarHBondContact O-N 3.48Å; T430-L446 HydrophobicContact CG2-CD2 3.79Å
431	K	51.9	Low	58.3	Low	134 Å²	134	80.5 Å²	80.5	58%	0.583	43%	0.43	S	S	*	.	H	α-helix	trans	-59.7	-15.4	174.9	-63.3	178.7	-177.9	179.5	0	115.4	R429	R429-K431 VanDerWaalsContact C-N 3.29Å; R429-K431 PolarHBondContact O-N 2.97Å
432	N	44.2	Very low	55.9	Low	126 Å²	126	85.9 Å²	85.9	67%	0.674	46%	0.459	S	S	*	.	H	α-helix	trans	-103	-7.5	178.3	-74.3	-85.2	0	0	0	112.7	E428 R429 T430	E428-N432 PolarHBondContact O-ND2 3.39Å; R429-N432 PolarHBondContact O-N 3.4Å; T430-N432 PolarHBondContact O-N 3.37Å
433	I	51.5	Low	53.3	Low	82 Å²	82	89.5 Å²	89.5	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-93.3	-32	176.7	-67	167.5	0	0	0	110.1	R429 T430 E435 N436	R429-I433 HydrophobicContact CG-CD1 4.27Å; R429-I433 WeakPolarHBondContact O-CG1 3.27Å; R429-I433 PolarHBondContact O-N 2.97Å; T430-I433 PolarHBondContact O-N 2.66Å; I433-E435 PolarHBondContact O-N 2.93Å; I433-N436 PolarHBondContact O-N 3.19Å; I433-N436 VanDerWaalsContact O-N 3.09Å
434	D	42.6	Very low	50.9	Low	90 Å²	90	95.5 Å²	95.5	48%	0.481	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.2	-176.8	-63.1	-31	0	0	0	115.6	T430	T430-D434 PolarHBondContact O-N 3.48Å
435	E	43	Very low	48.8	Very low	178 Å²	178	99.2 Å²	99.2	83%	0.832	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-5.3	174.2	-65.2	-136.4	146.2	0	0	114.5	I433	I433-E435 PolarHBondContact O-N 2.93Å
436	N	34.4	Very low	46.6	Very low	159 Å²	159	98.8 Å²	98.8	85%	0.85	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.9	8.9	-171	-97.3	-36.4	0	0	0	117.3	I433	I433-N436 PolarHBondContact O-N 3.19Å; I433-N436 VanDerWaalsContact O-N 3.09Å
437	S	35.3	Very low	44.3	Very low	71 Å²	71	103 Å²	103	50%	0.497	56%	0.556	S	S	.	*			trans	-145.8	119.4	175.2	56.1	0	0	0	0	114.2	C439	S437-C439 PolarHBondContact O-N 2.84Å
438	S	28.6	Very low	42.4	Very low	128 Å²	128	102.5 Å²	102.5	90%	0.895	56%	0.556	S	S	*	*			trans	-85.2	97.6	174.9	57.4	0	0	0	0	112
439	C	28.4	Very low	41.4	Very low	102 Å²	102	98.4 Å²	98.4	69%	0.689	54%	0.537	S	S	*	.			trans	-144.8	144	160.7	54.3	0	0	0	0	111.3	S437	S437-C439 PolarHBondContact O-N 2.84Å
440	T	28	Very low	40.7	Very low	113 Å²	113	94.5 Å²	94.5	69%	0.693	53%	0.526	S	S	*	.			trans	-97.7	153.5	-159.5	45.5	0	0	0	0	114.3
441	N	36.9	Very low	40	Very low	130 Å²	130	98.9 Å²	98.9	70%	0.695	55%	0.545	S	S	*	.	S	Bend	trans	96.3	-33.4	159.3	-51.5	-33.8	0	0	0	119	N443	N441-N443 VanDerWaalsContact C-N 3.32Å; N441-N443 PolarHBondContact O-N 3.34Å
442	D	38.9	Very low	39.5	Very low	133 Å²	133	98.5 Å²	98.5	71%	0.711	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.3	-178.3	-66.1	-32.8	0	0	0	114.1	L444 V445 L446	D442-L444 PolarHBondContact O-N 3.46Å; D442-L444 VanDerWaalsContact O-N 3.08Å; D442-V445 PolarHBondContact O-N 3.27Å; D442-L446 PolarHBondContact O-N 2.87Å
443	N	37.6	Very low	39.1	Very low	77 Å²	77	94.7 Å²	94.7	41%	0.412	53%	0.528	S	S	.	.	H	α-helix	trans	-61.2	-19.6	-179.7	-72	-11.4	0	0	0	114.1	N441 N447	N441-N443 VanDerWaalsContact C-N 3.32Å; N441-N443 PolarHBondContact O-N 3.34Å; N443-N447 VanDerWaalsContact O-CB 3.26Å; N443-N447 WeakPolarHBondContact O-CB 3.44Å; N443-N447 VanDerWaalsContact O-CG 3.31Å; N443-N447 PolarHBondContact O-N 2.84Å; N443-N447 PolarHBondContact O-ND2 3.21Å
444	L	42.3	Very low	38.4	Very low	145 Å²	145	95.5 Å²	95.5	76%	0.759	54%	0.539	S	S	*	.	H	α-helix	trans	-70	-35.8	174.4	-87.4	160.6	0	0	0	112.7	D442 G448	D442-L444 PolarHBondContact O-N 3.46Å; D442-L444 VanDerWaalsContact O-N 3.08Å; L444-G448 PolarHBondContact O-N 3.29Å; L444-G448 VanDerWaalsContact O-N 3.08Å
445	V	43.6	Very low	38	Very low	86 Å²	86	95.4 Å²	95.4	52%	0.521	54%	0.538	S	S	.	.	H	α-helix	trans	-73.2	-42.9	176.6	-176.8	0	0	0	0	109.7	D442 G448 I449	D442-V445 PolarHBondContact O-N 3.27Å; V445-G448 CarbonylContact O-C 3.49Å; V445-G448 WeakPolarHBondContact O-CA 3.14Å; V445-G448 PolarHBondContact O-N 3.06Å; V445-I449 HydrophobicContact CG1-CD1 4.12Å; V445-I449 VanDerWaalsContact O-CG1 3.3Å; V445-I449 WeakPolarHBondContact O-CG1 3.43Å; V445-I449 PolarHBondContact O-N 3.16Å
446	L	40.3	Very low	37.3	Very low	30 Å²	30	93.7 Å²	93.7	16%	0.157	53%	0.528	C	S	.	.	H	α-helix	trans	-68.4	-42.7	-178.2	-152.1	81.3	0	0	0	112.9	F363 T430 D442 G448 I449 I450	F363-L446 HydrophobicContact CE1-CD1 4.21Å; T430-L446 HydrophobicContact CG2-CD2 3.79Å; D442-L446 PolarHBondContact O-N 2.87Å; L446-G448 VanDerWaalsContact C-N 3.31Å; L446-G448 PolarHBondContact O-N 2.97Å; L446-I449 HydrophobicContact CD1-CD1 4.36Å; L446-I449 WeakPolarHBondContact O-CB 3.37Å; L446-I449 PolarHBondContact O-N 3.03Å; L446-I450 WeakPolarHBondContact O-CG1 3.33Å; L446-I450 PolarHBondContact O-N 3.47Å
447	N	38.2	Very low	37.1	Very low	88 Å²	88	89.8 Å²	89.8	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-38.7	171.4	-73.8	-40.9	0	0	0	111.1	N443 I449 I450 E451	N443-N447 VanDerWaalsContact O-CB 3.26Å; N443-N447 WeakPolarHBondContact O-CB 3.44Å; N443-N447 VanDerWaalsContact O-CG 3.31Å; N443-N447 PolarHBondContact O-N 2.84Å; N443-N447 PolarHBondContact O-ND2 3.21Å; N447-I449 VanDerWaalsContact C-N 3.33Å; N447-I449 PolarHBondContact O-N 3.46Å; N447-I450 PolarHBondContact O-N 2.99Å; N447-E451 VanDerWaalsContact O-CB 3.32Å; N447-E451 WeakPolarHBondContact O-CB 3.19Å; N447-E451 WeakPolarHBondContact O-CG 3.5Å; N447-E451 PolarHBondContact O-N 3.41Å
448	G	40.4	Very low	36.8	Very low	20 Å²	20	91.9 Å²	91.9	21%	0.206	52%	0.516	C	S	.	.	H	α-helix	trans	-58.3	-38.7	170.9	0	0	0	0	0	114	L444 V445 L446 Q452	L444-G448 PolarHBondContact O-N 3.29Å; L444-G448 VanDerWaalsContact O-N 3.08Å; V445-G448 CarbonylContact O-C 3.49Å; V445-G448 WeakPolarHBondContact O-CA 3.14Å; V445-G448 PolarHBondContact O-N 3.06Å; L446-G448 VanDerWaalsContact C-N 3.31Å; L446-G448 PolarHBondContact O-N 2.97Å; G448-Q452 WeakPolarHBondContact O-CB 3.42Å; G448-Q452 WeakPolarHBondContact O-CG 3.34Å; G448-Q452 PolarHBondContact O-N 3.26Å
449	I	48.6	Very low	37.1	Very low	10 Å²	10	93.7 Å²	93.7	5%	0.051	52%	0.515	C	S	.	.	H	α-helix	trans	-67.6	-44.8	175.8	-67.9	160.9	0	0	0	111.1	L333 V445 L446 N447 C453	L333-I449 HydrophobicContact CD1-CG1 3.96Å; L333-I449 HydrophobicContact CD2-CD1 3.47Å; L333-I449 VanDerWaalsContact CD2-CD1 3.47Å; L333-I449 HydrophobicContact CD2-CG1 3.46Å; L333-I449 VanDerWaalsContact CD2-CG1 3.46Å; L333-I449 HydrophobicContact CG-CG1 4.36Å; V445-I449 HydrophobicContact CG1-CD1 4.12Å; V445-I449 VanDerWaalsContact O-CG1 3.3Å; V445-I449 WeakPolarHBondContact O-CG1 3.43Å; V445-I449 PolarHBondContact O-N 3.16Å; L446-I449 HydrophobicContact CD1-CD1 4.36Å; L446-I449 WeakPolarHBondContact O-CB 3.37Å; L446-I449 PolarHBondContact O-N 3.03Å; N447-I449 VanDerWaalsContact C-N 3.33Å; N447-I449 PolarHBondContact O-N 3.46Å; I449-C453 WeakPolarHBondContact O-CB 3.37Å; I449-C453 PolarHBondContact O-N 3.18Å; I449-C453 VanDerWaalsContact O-N 3.16Å
450	I	45	Very low	37.2	Very low	58 Å²	58	93.5 Å²	93.5	30%	0.297	52%	0.515	S	S	.	.	H	α-helix	trans	-67.6	-43.3	-179.3	-66.5	166.9	0	0	0	110.2	L446 N447 C454	L446-I450 WeakPolarHBondContact O-CG1 3.33Å; L446-I450 PolarHBondContact O-N 3.47Å; N447-I450 PolarHBondContact O-N 2.99Å; I450-C454 VanDerWaalsContact O-CB 3.31Å; I450-C454 WeakPolarHBondContact O-CB 3.28Å; I450-C454 PolarHBondContact O-N 3.09Å; I450-C454 VanDerWaalsContact O-N 3.15Å; I450-C454 PolarHBondContact O-SG 3.26Å
451	E	39.5	Very low	37.6	Very low	116 Å²	116	96.2 Å²	96.2	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-70	-43.5	176.9	-72	-169.1	153.9	0	0	112.8	N447 C453 C454 I455	N447-E451 VanDerWaalsContact O-CB 3.32Å; N447-E451 WeakPolarHBondContact O-CB 3.19Å; N447-E451 WeakPolarHBondContact O-CG 3.5Å; N447-E451 PolarHBondContact O-N 3.41Å; E451-C453 VanDerWaalsContact C-N 3.3Å; E451-C453 PolarHBondContact O-N 2.87Å; E451-C454 CarbonylContact O-C 3.57Å; E451-C454 PolarHBondContact O-N 3.46Å; E451-C454 VanDerWaalsContact O-N 3.13Å; E451-I455 HydrophobicContact CB-CD1 3.95Å; E451-I455 HydrophobicContact CG-CD1 4.05Å; E451-I455 WeakPolarHBondContact O-CA 3.43Å; E451-I455 VanDerWaalsContact O-CB 3.25Å; E451-I455 WeakPolarHBondContact O-CB 3.42Å; E451-I455 VanDerWaalsContact O-CG1 3.3Å; E451-I455 WeakPolarHBondContact O-CG1 3.47Å; E451-I455 PolarHBondContact O-N 3.17Å
452	Q	41.5	Very low	37.5	Very low	127 Å²	127	95.9 Å²	95.9	59%	0.593	52%	0.522	S	S	*	.	H	α-helix	trans	-69.5	-26.2	-179.6	-71.6	178.8	14.4	0	0	113.5	G448	G448-Q452 WeakPolarHBondContact O-CB 3.42Å; G448-Q452 WeakPolarHBondContact O-CG 3.34Å; G448-Q452 PolarHBondContact O-N 3.26Å
453	C	37.5	Very low	37	Very low	45 Å²	45	96.7 Å²	96.7	30%	0.304	53%	0.527	S	S	.	.	H	α-helix	trans	-81.2	-22.4	171.1	-73.8	0	0	0	0	113.5	D326 R423 I449 E451	D326-C453 PolarHBondContact OD1-SG 3.49Å; R423-C453 PolarHBondContact NH2-SG 3.26Å; I449-C453 WeakPolarHBondContact O-CB 3.37Å; I449-C453 PolarHBondContact O-N 3.18Å; I449-C453 VanDerWaalsContact O-N 3.16Å; E451-C453 VanDerWaalsContact C-N 3.3Å; E451-C453 PolarHBondContact O-N 2.87Å
454	C	34.8	Very low	36.8	Very low	99 Å²	99	101.3 Å²	101.3	67%	0.669	55%	0.546	S	S	*	.	H	α-helix	trans	-100.5	-19.9	179.1	-73.1	0	0	0	0	114.6	I450 E451	I450-C454 VanDerWaalsContact O-CB 3.31Å; I450-C454 WeakPolarHBondContact O-CB 3.28Å; I450-C454 PolarHBondContact O-N 3.09Å; I450-C454 VanDerWaalsContact O-N 3.15Å; I450-C454 PolarHBondContact O-SG 3.26Å; E451-C454 CarbonylContact O-C 3.57Å; E451-C454 PolarHBondContact O-N 3.46Å; E451-C454 VanDerWaalsContact O-N 3.13Å
455	I	34.3	Very low	36.3	Very low	88 Å²	88	99.4 Å²	99.4	45%	0.451	55%	0.545	S	S	.	.			trans	-119.4	72.4	-170	-48	177.4	0	0	0	111.1	E451	E451-I455 HydrophobicContact CB-CD1 3.95Å; E451-I455 HydrophobicContact CG-CD1 4.05Å; E451-I455 WeakPolarHBondContact O-CA 3.43Å; E451-I455 VanDerWaalsContact O-CB 3.25Å; E451-I455 WeakPolarHBondContact O-CB 3.42Å; E451-I455 VanDerWaalsContact O-CG1 3.3Å; E451-I455 WeakPolarHBondContact O-CG1 3.47Å; E451-I455 PolarHBondContact O-N 3.17Å
456	K	29.8	Very low	35.5	Very low	143 Å²	143	103.4 Å²	103.4	62%	0.622	56%	0.562	S	S	*	*			trans	-111.9	33.8	154.1	-75.3	-176.6	-179	169.1	0	112.2
457	T	28.6	Very low	34.9	Very low	77 Å²	77	109.7 Å²	109.7	47%	0.472	59%	0.59	S	S	.	*	S	Bend	trans	-132.7	99.6	166.5	54.1	0	0	0	0	112.2	K498	T457-K498 HydrophobicContact CG2-CD 4.13Å
458	N	30.5	Very low	34.4	Very low	115 Å²	115	112.3 Å²	112.3	62%	0.615	60%	0.6	S	S	*	*			trans	79.4	107.1	170.2	-40.4	-19.4	0	0	0	113.3	K498	N458-K498 PolarHBondContact OD1-NZ 3.39Å
459	N	33.4	Very low	33.9	Very low	166 Å²	166	118.4 Å²	118.4	89%	0.888	63%	0.628	S	S	*	*				-168.8	117	125.9	-90.3	-7.7	0	0	0	107.6
460	S	31.3	Very low	33	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	66%	0.663	S	S	*	*			trans	-102.9	158.1	158.6	47	0	0	0	0	107.6
461	E	36.3	Very low	32.4	Very low	169 Å²	169	129.8 Å²	129.8	79%	0.79	68%	0.684	S	S	*	*			trans	83.6	75.7	170.9	-65.8	144.7	-127.6	0	0	117.8
462	T	34.5	Very low	32.4	Very low	123 Å²	123	129.7 Å²	129.7	76%	0.755	69%	0.694	S	S	*	*				38.6	110.7	120.8	46.3	0	0	0	0	121.5
463	N	29.3	Very low	32.5	Very low	150 Å²	150	128.6 Å²	128.6	80%	0.802	70%	0.697	S	S	*	*				14	130.9	127.2	-50.8	-14	0	0	0	119.3
464	H	34	Very low	32.4	Very low	175 Å²	175	133.4 Å²	133.4	81%	0.81	72%	0.72	S	S	*	*				-163	136	107	-125.7	-86.9	0	0	0	115.7
465	S	31.6	Very low	32.4	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	73%	0.725	S	S	*	*			trans	51.4	128.3	152	36.9	0	0	0	0	123.4
466	L	26.1	Very low	32.4	Very low	169 Å²	169	138.2 Å²	138.2	89%	0.885	74%	0.735	S	S	*	*			trans	-71.2	146.6	160.7	-58.8	151.3	0	0	0	111.3
467	Q	28.2	Very low	32.7	Very low	162 Å²	162	135.8 Å²	135.8	76%	0.757	74%	0.736	S	S	*	*				177.2	151.7	107	-123.5	171.3	-47.7	0	0	111.4
468	E	27.9	Very low	32.9	Very low	144 Å²	144	138.5 Å²	138.5	67%	0.673	75%	0.747	S	S	*	*			trans	33.3	133	148.7	-74.7	162.2	-134.1	0	0	120.2
469	N	29.6	Very low	32.9	Very low	148 Å²	148	140 Å²	140	79%	0.791	76%	0.755	S	S	*	*			cis	-174.2	176.9	44.3	-120.9	-31.2	0	0	0	111.3
470	E	29.9	Very low	33.1	Very low	167 Å²	167	138.8 Å²	138.8	78%	0.78	75%	0.754	S	S	*	*			trans	-81.3	144.5	176.5	-69.6	-157.8	142.2	0	0	115.4
471	N	32.9	Very low	33.1	Very low	140 Å²	140	142.3 Å²	142.3	75%	0.749	76%	0.756	S	S	*	*			trans	68	144.7	152.7	-66.5	-46.1	0	0	0	121.9
472	P	38.9	Very low	33	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	76%	0.756	S	S	*	*			trans	-115.4	-161.2	-176.9	47.5	-36.5	0	0	0	111.7
473	P	42.6	Very low	32.9	Very low	103 Å²	103	141.4 Å²	141.4	67%	0.669	75%	0.753	S	S	*	*			cis	-120.1	179.9	-23.3	28.1	-7.1	0	0	0	112.3
474	D	35.4	Very low	33	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	75%	0.753	S	S	*	*				177.9	145.1	118.7	-91.8	-18.5	0	0	0	115.3
475	E	36	Very low	33	Very low	164 Å²	164	139.2 Å²	139.2	77%	0.766	76%	0.756	S	S	*	*			trans	47.1	130.3	151.5	-63	-138.9	143	0	0	125.6
476	N	33	Very low	33	Very low	125 Å²	125	141.6 Å²	141.6	67%	0.668	76%	0.76	S	S	*	*			trans	74.2	92.8	133.8	-74.5	-37.9	0	0	0	122.4
477	S	35.8	Very low	33.6	Very low	91 Å²	91	137.8 Å²	137.8	64%	0.636	75%	0.746	S	S	*	*				120	146.6	98.7	77.2	0	0	0	0	119.2
478	N	34.8	Very low	33.7	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	74%	0.744	S	S	*	*			trans	77	98	153	-59.2	-36.2	0	0	0	121
479	N	30.1	Very low	34.1	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	75%	0.753	S	S	*	*				31	128.4	120	-71.7	-40	0	0	0	119.2
480	V	36	Very low	34	Very low	140 Å²	140	137.1 Å²	137.1	85%	0.848	76%	0.758	S	S	*	*				-165.5	156.1	95.4	145.7	0	0	0	0	110.5
481	K	32	Very low	34.3	Very low	172 Å²	172	135.7 Å²	135.7	75%	0.748	76%	0.76	S	S	*	*			trans	-74.7	163.6	-175	-57.6	160.2	180	173.1	0	112.6
482	N	35	Very low	34	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	77%	0.766	S	S	*	*				-175.8	102.6	116.3	-88	-9.9	0	0	0	113.1
483	D	31.5	Very low	33.7	Very low	127 Å²	127	140.3 Å²	140.3	68%	0.679	77%	0.77	S	S	*	*				39.8	124.3	124.7	-66.4	-5.9	0	0	0	123.7
484	L	32.6	Very low	33.2	Very low	155 Å²	155	141 Å²	141	81%	0.812	77%	0.772	S	S	*	*			trans	61.9	119.2	136.1	-82.2	64.4	0	0	0	119
485	S	33.4	Very low	33.1	Very low	124 Å²	124	140 Å²	140	87%	0.867	78%	0.777	S	S	*	*				-171.8	159.4	78.3	36.4	0	0	0	0	113.9
486	N	32.5	Very low	33.1	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	78%	0.78	S	S	*	*			trans	-114.1	-179.8	-178.1	-147.8	10.7	0	0	0	107.9
487	P	38.7	Very low	33.2	Very low	89 Å²	89	145.2 Å²	145.2	58%	0.578	79%	0.791	S	S	*	*			cis	-133.2	-152.2	-14	32.7	-8	0	0	0	113.2
488	D	30.1	Very low	33.2	Very low	137 Å²	137	147.3 Å²	147.3	73%	0.733	79%	0.788	S	S	*	*			trans	92.5	95.8	153.4	-69.4	-7.2	0	0	0	121.9
489	K	35.5	Very low	33.6	Very low	197 Å²	197	146.6 Å²	146.6	86%	0.857	78%	0.783	S	S	*	*				-179.4	128.5	97.1	-100.1	160	-173.7	165.6	0	113.9
490	A	28.4	Very low	34.4	Very low	107 Å²	107	143.2 Å²	143.2	88%	0.884	77%	0.769	S	S	*	*			trans	-79.9	127.7	173	0	0	0	0	0	111.8
491	V	34.7	Very low	35.1	Very low	136 Å²	136	142.7 Å²	142.7	82%	0.824	76%	0.761	S	S	*	*			trans	-115.6	117.8	168.3	179	0	0	0	0	110.1	S493	V491-S493 PolarHBondContact O-N 3.15Å
492	R	27.8	Very low	36.4	Very low	234 Å²	234	137 Å²	137	88%	0.883	74%	0.738	S	S	*	*			trans	-68.8	103.7	-179.6	172.6	-178.6	-93	-178.3	-8.1	110.8
493	S	32.5	Very low	38.3	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	73%	0.728	S	S	*	*			trans	-80.3	129.7	172.8	57.3	0	0	0	0	111.5	V491	V491-S493 PolarHBondContact O-N 3.15Å
494	T	31.6	Very low	39.8	Very low	116 Å²	116	131.5 Å²	131.5	71%	0.712	71%	0.705	S	S	*	*			trans	-91.2	127	179.7	45.7	0	0	0	0	110.9	K496	T494-K496 PolarHBondContact O-N 2.86Å
495	S	32.6	Very low	41.4	Very low	125 Å²	125	128.6 Å²	128.6	87%	0.874	69%	0.688	S	S	*	*			trans	-71.6	97.2	-175.8	57.9	0	0	0	0	112.2	K497	S495-K497 PolarHBondContact O-N 3.09Å
496	K	36.9	Very low	43.1	Very low	194 Å²	194	123.4 Å²	123.4	84%	0.843	65%	0.649	S	S	*	*			trans	-68.8	121.9	169.3	-69.6	178.4	179.2	174.9	0	109.8	T494 K498	T494-K496 PolarHBondContact O-N 2.86Å; K496-K498 PolarHBondContact O-N 3.34Å; K496-K498 VanDerWaalsContact O-N 3.17Å
497	K	34.6	Very low	44.9	Very low	205 Å²	205	119.1 Å²	119.1	89%	0.891	63%	0.625	S	S	*	*			trans	-63.4	112.5	173.7	-74.8	-177.9	173.7	-176.4	0	109.8	S495	S495-K497 PolarHBondContact O-N 3.09Å
498	K	36.1	Very low	46.6	Very low	135 Å²	135	115.4 Å²	115.4	59%	0.587	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-73.2	127.5	164.2	-80.1	179.7	172.3	178.2	0	108.9	T457 N458 K496	T457-K498 HydrophobicContact CG2-CD 4.13Å; N458-K498 PolarHBondContact OD1-NZ 3.39Å; K496-K498 PolarHBondContact O-N 3.34Å; K496-K498 VanDerWaalsContact O-N 3.17Å
499	I	42.1	Very low	48.5	Very low	120 Å²	120	110.4 Å²	110.4	62%	0.615	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-83.2	138.6	170.8	-55.8	164.8	0	0	0	107.4	I319	I319-I499 HydrophobicContact CD1-CD1 4.18Å; I319-I499 HydrophobicContact CD1-CG2 4.14Å
500	P	48.8	Very low	50.3	Low	75 Å²	75	103.5 Å²	103.5	49%	0.487	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-67	137.7	173	-15.8	31.5	0	0	0	110.7	E133	E133-P500 VanDerWaalsContact OE1-CB 3.3Å; E133-P500 WeakPolarHBondContact OE1-CB 3.49Å; E133-P500 VanDerWaalsContact OE1-CG 3.28Å; E133-P500 WeakPolarHBondContact OE1-CG 3.31Å
501	L	49.6	Very low	52.4	Low	130 Å²	130	99.5 Å²	99.5	68%	0.681	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-88.8	122.1	172.2	-75.2	160.3	0	0	0	108.2	Q322 N503	Q322-L501 HydrophobicContact CG-CD2 4.14Å; L501-N503 PolarHBondContact O-N 3.14Å
502	M	59.9	Low	54.6	Low	51 Å²	51	98.8 Å²	98.8	25%	0.251	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-58.4	136.5	171.8	-77.1	-175.5	104.9	0	0	109.8	H506	M502-H506 HydrophobicContact CE-CB 4.08Å
503	N	73.7	Confident	56.7	Low	109 Å²	109	88.5 Å²	88.5	58%	0.583	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-57.8	149.2	173.1	-170.3	6.1	0	0	0	110.5	L501 E505 H506 M507	L501-N503 PolarHBondContact O-N 3.14Å; N503-E505 PolarHBondContact O-N 3.23Å; N503-H506 VanDerWaalsContact O-CB 3.31Å; N503-H506 WeakPolarHBondContact O-CB 3.48Å; N503-H506 PolarHBondContact O-N 3.09Å; N503-M507 PolarHBondContact O-N 2.98Å
504	Y	63	Low	58.7	Low	51 Å²	51	86.1 Å²	86.1	20%	0.2	44%	0.436	C	S	.	.	H	α-helix	trans	-55	-49.3	-175.4	-177.1	-139.3	0	0	0	112.8	H420 R423 T424 H506 M507 L508	H420-Y504 VanDerWaalsContact C-OH 3.24Å; H420-Y504 WeakPolarHBondContact CA-OH 3.44Å; H420-Y504 HydrophobicContact CB-CE2 4.16Å; H420-Y504 WeakPolarHBondContact CB-OH 3.4Å; H420-Y504 AromaticContact CE1-CE2 3.82Å; H420-Y504 AromaticContact CG-CE2 3.86Å; H420-Y504 AromaticContact ND1-CE2 3.24Å; H420-Y504 WeakPolarHBondContact ND1-CE2 3.25Å; H420-Y504 AromaticContact ND1-CZ 3.69Å; H420-Y504 PolarHBondContact ND1-OH 3.14Å; H420-Y504 PolarHBondContact O-OH 3.44Å; R423-Y504 WeakPolarHBondContact CB-OH 3.31Å; R423-Y504 HydrophobicContact CG-CE1 4.29Å; T424-Y504 HydrophobicContact CG2-CD1 4.14Å; T424-Y504 HydrophobicContact CG2-CE1 3.42Å; T424-Y504 VanDerWaalsContact CG2-CE1 3.42Å; Y504-H506 PolarHBondContact O-N 2.74Å; Y504-M507 WeakPolarHBondContact O-CA 3.49Å; Y504-M507 WeakPolarHBondContact O-CB 3.44Å; Y504-M507 PolarHBondContact O-N 3.22Å; Y504-L508 HydrophobicContact CD1-CD1 3.86Å; Y504-L508 HydrophobicContact CD2-CD1 3.93Å; Y504-L508 HydrophobicContact CD2-CG 4.42Å; Y504-L508 HydrophobicContact CE1-CD1 3.8Å; Y504-L508 HydrophobicContact CE2-CD1 3.81Å; Y504-L508 HydrophobicContact CE2-CD2 4.38Å; Y504-L508 HydrophobicContact CE2-CG 4.07Å; Y504-L508 HydrophobicContact CG-CD1 3.94Å; Y504-L508 WeakPolarHBondContact O-CD1 3.26Å; Y504-L508 PolarHBondContact O-N 3.03Å; Y504-L508 VanDerWaalsContact O-N 3.1Å
505	E	67.8	Low	60.7	Low	94 Å²	94	84 Å²	84	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-48.7	-41.3	173.6	-96.7	-69.3	97.2	0	0	113.9	N503 M507 L508 T509	N503-E505 PolarHBondContact O-N 3.23Å; E505-M507 VanDerWaalsContact C-N 3.33Å; E505-M507 PolarHBondContact O-N 2.79Å; E505-L508 PolarHBondContact O-N 3.18Å; E505-T509 WeakPolarHBondContact O-CB 3.49Å; E505-T509 PolarHBondContact O-N 3.48Å; E505-T509 PolarHBondContact O-OG1 3.24Å
506	H	68.2	Low	62.6	Low	14 Å²	14	83.6 Å²	83.6	7%	0.065	40%	0.404	C	S	.	.	H	α-helix	trans	-67.4	-35.2	176.9	-105.7	122.7	0	0	0	112	E133 T142 M502 N503 Y504 K510	E133-H506 PolarHBondContact O-CE1 3.21Å; E133-H506 PolarHBondContact O-NE2 3.1Å; T142-H506 VanDerWaalsContact CG2-CE1 3.47Å; T142-H506 WeakPolarHBondContact CG2-CE1 3.34Å; M502-H506 HydrophobicContact CE-CB 4.08Å; N503-H506 VanDerWaalsContact O-CB 3.31Å; N503-H506 WeakPolarHBondContact O-CB 3.48Å; N503-H506 PolarHBondContact O-N 3.09Å; Y504-H506 PolarHBondContact O-N 2.74Å; H506-K510 WeakPolarHBondContact O-CB 3.36Å; H506-K510 PolarHBondContact O-N 2.57Å; H506-K510 VanDerWaalsContact O-N 3.07Å
507	M	71.1	Confident	64.2	Low	65 Å²	65	77.9 Å²	77.9	32%	0.32	38%	0.38	S	S	.	.	H	α-helix	trans	-68	-41.7	177.5	-150.8	-174.7	-48.1	0	0	111.3	N503 Y504 E505 A511	N503-M507 PolarHBondContact O-N 2.98Å; Y504-M507 WeakPolarHBondContact O-CA 3.49Å; Y504-M507 WeakPolarHBondContact O-CB 3.44Å; Y504-M507 PolarHBondContact O-N 3.22Å; E505-M507 VanDerWaalsContact C-N 3.33Å; E505-M507 PolarHBondContact O-N 2.79Å; M507-A511 WeakPolarHBondContact O-CB 3.33Å; M507-A511 PolarHBondContact O-N 3.06Å
508	L	73.8	Confident	65.9	Low	10 Å²	10	70.4 Å²	70.4	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-68.6	-45.5	177.1	-66.3	137.4	0	0	0	112.3	H420 T424 Y504 E505 K510 A511 R512	H420-L508 HydrophobicContact CB-CD2 3.96Å; T424-L508 HydrophobicContact CG2-CD1 3.16Å; T424-L508 HydrophobicContact CG2-CD2 3.73Å; T424-L508 HydrophobicContact CG2-CG 4.06Å; Y504-L508 HydrophobicContact CD1-CD1 3.86Å; Y504-L508 HydrophobicContact CD2-CD1 3.93Å; Y504-L508 HydrophobicContact CD2-CG 4.42Å; Y504-L508 HydrophobicContact CE1-CD1 3.8Å; Y504-L508 HydrophobicContact CE2-CD1 3.81Å; Y504-L508 HydrophobicContact CE2-CD2 4.38Å; Y504-L508 HydrophobicContact CE2-CG 4.07Å; Y504-L508 HydrophobicContact CG-CD1 3.94Å; Y504-L508 WeakPolarHBondContact O-CD1 3.26Å; Y504-L508 PolarHBondContact O-N 3.03Å; Y504-L508 VanDerWaalsContact O-N 3.1Å; E505-L508 PolarHBondContact O-N 3.18Å; L508-K510 VanDerWaalsContact C-N 3.26Å; L508-K510 PolarHBondContact O-N 2.96Å; L508-A511 WeakPolarHBondContact O-CB 3.22Å; L508-A511 PolarHBondContact O-N 3.49Å; L508-A511 VanDerWaalsContact O-N 3.08Å; L508-R512 WeakPolarHBondContact O-CG 3.38Å; L508-R512 PolarHBondContact O-N 2.78Å
509	T	69.1	Low	67.5	Low	32 Å²	32	72.9 Å²	72.9	20%	0.196	36%	0.359	C	S	.	.	H	α-helix	trans	-58.5	-42.5	176.4	-62.1	0	0	0	0	110.6	E505 R512 S513	E505-T509 WeakPolarHBondContact O-CB 3.49Å; E505-T509 PolarHBondContact O-N 3.48Å; E505-T509 PolarHBondContact O-OG1 3.24Å; T509-R512 PolarHBondContact O-N 2.81Å; T509-S513 WeakPolarHBondContact O-CB 3.16Å; T509-S513 PolarHBondContact O-N 3.34Å
510	K	74.3	Confident	68.6	Low	53 Å²	53	73.1 Å²	73.1	23%	0.23	36%	0.361	C	S	.	.	H	α-helix	trans	-65.6	-37.5	173.8	-169.2	176.6	-176.4	-178.5	0	112.8	I90 Q91 H506 L508 L514	I90-K510 HydrophobicContact CG2-CG 4.42Å; Q91-K510 VanDerWaalsContact CD-NZ 3.32Å; H506-K510 WeakPolarHBondContact O-CB 3.36Å; H506-K510 PolarHBondContact O-N 2.57Å; H506-K510 VanDerWaalsContact O-N 3.07Å; L508-K510 VanDerWaalsContact C-N 3.26Å; L508-K510 PolarHBondContact O-N 2.96Å; K510-L514 VanDerWaalsContact O-CB 3.32Å; K510-L514 WeakPolarHBondContact O-CB 3.46Å; K510-L514 PolarHBondContact O-N 2.82Å
511	A	72.5	Confident	69.1	Low	22 Å²	22	75.7 Å²	75.7	18%	0.182	37%	0.371	C	S	.	.	H	α-helix	trans	-68.2	-40.8	174.9	0	0	0	0	0	112.8	T417 M507 L508 L514 L515	T417-A511 HydrophobicContact CG2-CB 4.4Å; M507-A511 WeakPolarHBondContact O-CB 3.33Å; M507-A511 PolarHBondContact O-N 3.06Å; L508-A511 WeakPolarHBondContact O-CB 3.22Å; L508-A511 PolarHBondContact O-N 3.49Å; L508-A511 VanDerWaalsContact O-N 3.08Å; A511-L514 VanDerWaalsContact O-CB 3.31Å; A511-L514 WeakPolarHBondContact O-CB 3.47Å; A511-L514 PolarHBondContact O-N 2.95Å; A511-L515 WeakPolarHBondContact O-CG 3.48Å; A511-L515 PolarHBondContact O-N 3.44Å
512	R	79.9	Confident	69.2	Low	122 Å²	122	79.3 Å²	79.3	46%	0.46	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-47.1	173.5	-70.6	174.1	-178.5	146.5	0.4	111	L508 T509 L514 L515 Q516	L508-R512 WeakPolarHBondContact O-CG 3.38Å; L508-R512 PolarHBondContact O-N 2.78Å; T509-R512 PolarHBondContact O-N 2.81Å; R512-L514 VanDerWaalsContact C-N 3.35Å; R512-L514 PolarHBondContact O-N 2.76Å; R512-L515 PolarHBondContact O-N 3.15Å; R512-Q516 WeakPolarHBondContact O-CG 3.18Å; R512-Q516 PolarHBondContact O-N 3.04Å
513	S	72.9	Confident	68.6	Low	18 Å²	18	83.6 Å²	83.6	13%	0.126	40%	0.4	C	S	.	.	H	α-helix	trans	-59.7	-42.6	174.8	176.7	0	0	0	0	112.2	T509 L515 Q516 Q517	T509-S513 WeakPolarHBondContact O-CB 3.16Å; T509-S513 PolarHBondContact O-N 3.34Å; S513-L515 PolarHBondContact O-N 3.09Å; S513-Q516 PolarHBondContact O-N 3.5Å; S513-Q517 WeakPolarHBondContact O-CB 3.34Å; S513-Q517 PolarHBondContact O-N 3.39Å
514	L	73.4	Confident	66.9	Low	67 Å²	67	81.4 Å²	81.4	35%	0.351	40%	0.397	S	S	.	.	H	α-helix	trans	-55.8	-47.7	173.3	-103.2	164.7	0	0	0	113.1	I90 K510 A511 R512 Q517 S518	I90-L514 HydrophobicContact CD1-CD1 4.5Å; I90-L514 HydrophobicContact CD1-CD2 3.41Å; I90-L514 VanDerWaalsContact CD1-CD2 3.41Å; I90-L514 HydrophobicContact CD1-CG 4.05Å; I90-L514 HydrophobicContact CG1-CD2 3.72Å; I90-L514 HydrophobicContact CG1-CG 3.96Å; K510-L514 VanDerWaalsContact O-CB 3.32Å; K510-L514 WeakPolarHBondContact O-CB 3.46Å; K510-L514 PolarHBondContact O-N 2.82Å; A511-L514 VanDerWaalsContact O-CB 3.31Å; A511-L514 WeakPolarHBondContact O-CB 3.47Å; A511-L514 PolarHBondContact O-N 2.95Å; R512-L514 VanDerWaalsContact C-N 3.35Å; R512-L514 PolarHBondContact O-N 2.76Å; L514-Q517 PolarHBondContact O-N 2.83Å; L514-S518 PolarHBondContact O-N 3.13Å
515	L	74.2	Confident	65.9	Low	72 Å²	72	84.6 Å²	84.6	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-69.6	-32.9	178.9	-73	174.2	0	0	0	113	T417 A511 R512 S513 S518 R519	T417-L515 HydrophobicContact CG2-CD1 4Å; A511-L515 WeakPolarHBondContact O-CG 3.48Å; A511-L515 PolarHBondContact O-N 3.44Å; R512-L515 PolarHBondContact O-N 3.15Å; S513-L515 PolarHBondContact O-N 3.09Å; L515-S518 PolarHBondContact O-OG 3.47Å; L515-S518 VanDerWaalsContact O-OG 3.04Å; L515-R519 WeakPolarHBondContact O-CG 3.49Å; L515-R519 PolarHBondContact O-N 3.18Å; L515-R519 VanDerWaalsContact O-N 3.14Å
516	Q	73	Confident	64.5	Low	116 Å²	116	86.9 Å²	86.9	54%	0.542	44%	0.444	S	S	.	.	H	α-helix	trans	-67.5	-43.2	171.8	-73.8	175.2	-29.6	0	0	111.1	R512 S513 R519 L520	R512-Q516 WeakPolarHBondContact O-CG 3.18Å; R512-Q516 PolarHBondContact O-N 3.04Å; S513-Q516 PolarHBondContact O-N 3.5Å; Q516-R519 PolarHBondContact O-N 2.99Å; Q516-L520 WeakPolarHBondContact O-CG 3.03Å; Q516-L520 PolarHBondContact O-N 3.48Å
517	Q	69.6	Low	63.2	Low	75 Å²	75	91.6 Å²	91.6	35%	0.35	48%	0.479	S	S	.	.	H	α-helix	trans	-68.8	-34.4	179.9	-169.8	161	69.9	0	0	112.6	S513 L514 N521	S513-Q517 WeakPolarHBondContact O-CB 3.34Å; S513-Q517 PolarHBondContact O-N 3.39Å; L514-Q517 PolarHBondContact O-N 2.83Å; Q517-N521 PolarHBondContact O-N 2.98Å
518	S	70.9	Confident	61.6	Low	47 Å²	47	99.7 Å²	99.7	33%	0.329	51%	0.506	S	S	.	.	H	α-helix	trans	-67	-43.2	171.1	67.7	0	0	0	0	111.9	L514 L515 L520 N521 Y522	L514-S518 PolarHBondContact O-N 3.13Å; L515-S518 PolarHBondContact O-OG 3.47Å; L515-S518 VanDerWaalsContact O-OG 3.04Å; S518-L520 VanDerWaalsContact C-N 3.34Å; S518-L520 PolarHBondContact O-N 3.16Å; S518-N521 PolarHBondContact O-N 3.26Å; S518-N521 VanDerWaalsContact O-N 3.14Å; S518-Y522 VanDerWaalsContact O-CD2 3.27Å; S518-Y522 WeakPolarHBondContact O-CD2 3.36Å; S518-Y522 PolarHBondContact O-N 3.1Å; S518-Y522 VanDerWaalsContact O-N 3.17Å
519	R	70.4	Confident	60.1	Low	188 Å²	188	105 Å²	105	71%	0.709	54%	0.541	S	S	*	.	H	α-helix	trans	-58.1	-42.2	174.8	-82.2	-177.7	167.1	-177.1	-2.9	113	L515 Q516 N521 Y522 L523	L515-R519 WeakPolarHBondContact O-CG 3.49Å; L515-R519 PolarHBondContact O-N 3.18Å; L515-R519 VanDerWaalsContact O-N 3.14Å; Q516-R519 PolarHBondContact O-N 2.99Å; R519-N521 VanDerWaalsContact C-N 3.32Å; R519-N521 PolarHBondContact O-N 3.01Å; R519-Y522 PolarHBondContact O-N 3Å; R519-L523 PolarHBondContact O-N 3.1Å
520	L	63.9	Low	58.5	Low	125 Å²	125	107 Å²	107	65%	0.654	57%	0.568	S	S	*	*	H	α-helix	trans	-63.9	-36	176.1	-70.2	173	0	0	0	112.5	Q516 S518 Y522 L523 A524	Q516-L520 WeakPolarHBondContact O-CG 3.03Å; Q516-L520 PolarHBondContact O-N 3.48Å; S518-L520 VanDerWaalsContact C-N 3.34Å; S518-L520 PolarHBondContact O-N 3.16Å; L520-Y522 VanDerWaalsContact C-N 3.33Å; L520-Y522 PolarHBondContact O-N 3.15Å; L520-L523 PolarHBondContact O-N 3.41Å; L520-A524 PolarHBondContact O-N 3.12Å
521	N	59.7	Low	56.9	Low	128 Å²	128	109.5 Å²	109.5	68%	0.684	60%	0.598	S	S	*	*	H	α-helix	trans	-70.5	-24.4	176.2	-73.6	-11.2	0	0	0	113.7	Q517 S518 R519	Q517-N521 PolarHBondContact O-N 2.98Å; S518-N521 PolarHBondContact O-N 3.26Å; S518-N521 VanDerWaalsContact O-N 3.14Å; R519-N521 VanDerWaalsContact C-N 3.32Å; R519-N521 PolarHBondContact O-N 3.01Å
522	Y	51.5	Low	55.5	Low	206 Å²	206	116.2 Å²	116.2	81%	0.808	63%	0.631	S	S	*	*	H	α-helix	trans	-87.3	-15.7	174.9	-79.3	-71.6	0	0	0	114.2	S518 R519 L520	S518-Y522 VanDerWaalsContact O-CD2 3.27Å; S518-Y522 WeakPolarHBondContact O-CD2 3.36Å; S518-Y522 PolarHBondContact O-N 3.1Å; S518-Y522 VanDerWaalsContact O-N 3.17Å; R519-Y522 PolarHBondContact O-N 3Å; L520-Y522 VanDerWaalsContact C-N 3.33Å; L520-Y522 PolarHBondContact O-N 3.15Å
523	L	48.7	Very low	53.9	Low	142 Å²	142	115 Å²	115	74%	0.743	64%	0.638	S	S	*	*	S	Bend	trans	-102.6	4.6	178.3	-69.2	172.7	0	0	0	113.6	R519 L520 P525	R519-L523 PolarHBondContact O-N 3.1Å; L520-L523 PolarHBondContact O-N 3.41Å; L523-P525 WeakPolarHBondContact O-CD 3.46Å
524	A	38.2	Very low	52.4	Low	63 Å²	63	120.3 Å²	120.3	52%	0.521	67%	0.672	S	S	.	*	S	Bend	trans	-68	117.3	172.1	0	0	0	0	0	110.1	L520 T526	L520-A524 PolarHBondContact O-N 3.12Å; A524-T526 PolarHBondContact O-N 2.86Å
525	P	40.1	Very low	50.9	Low	117 Å²	117	125 Å²	125	76%	0.76	70%	0.697	S	S	*	*			trans	-66.2	134.5	178.2	27.4	-33.5	0	0	0	110	L523 S527	L523-P525 WeakPolarHBondContact O-CD 3.46Å; P525-S527 VanDerWaalsContact C-N 3.3Å; P525-S527 PolarHBondContact O-N 3.25Å
526	T	39.2	Very low	49.3	Very low	142 Å²	142	125.6 Å²	125.6	87%	0.871	71%	0.712	S	S	*	*			trans	-72.2	79.8	179.7	45	0	0	0	0	111.3	A524 R528	A524-T526 PolarHBondContact O-N 2.86Å; T526-R528 VanDerWaalsContact C-N 3.35Å; T526-R528 PolarHBondContact O-N 3.32Å
527	S	40.7	Very low	47.9	Very low	113 Å²	113	128.7 Å²	128.7	79%	0.79	73%	0.727	S	S	*	*			trans	-68.4	91.6	171.8	60.9	0	0	0	0	110.3	P525	P525-S527 VanDerWaalsContact C-N 3.3Å; P525-S527 PolarHBondContact O-N 3.25Å
528	R	38.7	Very low	46.8	Very low	235 Å²	235	130.5 Å²	130.5	89%	0.887	75%	0.745	S	S	*	*			trans	-57.7	132.5	173.4	-157.3	-179.2	-167.9	-153.3	4.8	109.5	T526	T526-R528 VanDerWaalsContact C-N 3.35Å; T526-R528 PolarHBondContact O-N 3.32Å
529	P	40.7	Very low	45.3	Very low	123 Å²	123	140 Å²	140	80%	0.799	77%	0.774	S	S	*	*			trans	-75.3	136	-174.4	29.1	-34.5	0	0	0	112.4
530	G	35.9	Very low	44	Very low	73 Å²	73	140.8 Å²	140.8	75%	0.753	78%	0.782	S	S	*	*			trans	67.7	74.5	149.1	0	0	0	0	0	118.2
531	A	41.8	Very low	43	Very low	105 Å²	105	139 Å²	139	87%	0.868	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-80.3	126.4	144.4	0	0	0	0	0	108.1
532	L	43.1	Very low	42.2	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.1	145.3	-173.8	-68.4	164.9	0	0	0	112.2
533	P	46.3	Very low	41.6	Very low	95 Å²	95	137 Å²	137	62%	0.617	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-75.3	148.8	168.6	33.1	-34	0	0	0	110.8	L535	P533-L535 PolarHBondContact O-N 3.38Å
534	P	41.1	Very low	41.3	Very low	131 Å²	131	138.1 Å²	138.1	85%	0.851	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75	126.1	175.2	30.7	-32.6	0	0	0	110.4
535	L	41.1	Very low	41.4	Very low	165 Å²	165	140.9 Å²	140.9	86%	0.864	80%	0.804	S	S	*	*			trans	-109.6	143.8	174.6	-73	177	0	0	0	112.2	P533	P533-L535 PolarHBondContact O-N 3.38Å
536	A	41.4	Very low	41.3	Very low	85 Å²	85	138.5 Å²	138.5	70%	0.702	80%	0.801	S	S	*	*			trans	-55	148.5	-166.1	0	0	0	0	0	118
537	H	43	Very low	41.2	Very low	181 Å²	181	137.2 Å²	137.2	84%	0.838	80%	0.798	S	S	*	*				11.3	165.1	126.8	-56.3	-50.6	0	0	0	121.2
538	P	45.9	Very low	41.2	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	80%	0.795	S	S	*	*			cis	-137.3	174.6	-27.2	33	-14.9	0	0	0	113.8
539	R	40.2	Very low	41.4	Very low	247 Å²	247	133.4 Å²	133.4	93%	0.932	79%	0.79	S	S	*	*			trans	-156.2	148	142.1	-108.5	156.4	-164	165.6	5.1	112.4
540	K	42.3	Very low	41.4	Very low	203 Å²	203	131.2 Å²	131.2	88%	0.883	78%	0.782	S	S	*	*			trans	-53.4	161.1	-174.9	-64.7	169.3	177.8	178.3	0	112.7
541	S	43.6	Very low	41.7	Very low	88 Å²	88	134.9 Å²	134.9	62%	0.615	78%	0.783	S	S	*	*				-167.4	168.8	50.3	53.7	0	0	0	0	118.4
542	H	42.9	Very low	41.6	Very low	175 Å²	175	138.1 Å²	138.1	81%	0.81	78%	0.78	S	S	*	*			trans	79.2	117.7	161.6	-54.9	-58.6	0	0	0	120.7
543	P	39.6	Very low	41.3	Very low	117 Å²	117	134.6 Å²	134.6	76%	0.76	77%	0.769	S	S	*	*			trans	-103.6	171.6	166.6	40.6	-33.1	0	0	0	112.4
544	I	41.3	Very low	41	Very low	165 Å²	165	135.7 Å²	135.7	85%	0.846	77%	0.773	S	S	*	*			trans	-161.5	137.4	146.1	-98.5	144.4	0	0	0	109.3
545	S	41.1	Very low	40.7	Very low	122 Å²	122	136.3 Å²	136.3	85%	0.853	77%	0.77	S	S	*	*			trans	22.9	140.6	162.4	-55.7	0	0	0	0	122.3
546	G	37.6	Very low	40.6	Very low	66 Å²	66	136.9 Å²	136.9	68%	0.68	77%	0.768	S	S	*	*			cis	160.5	-179.2	0.4	0	0	0	0	0	112.6
547	S	37.9	Very low	40.4	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	77%	0.77	S	S	*	*			trans	67.9	144.9	173.6	-68.4	0	0	0	0	117.4
548	L	39.1	Very low	40.2	Very low	140 Å²	140	139.2 Å²	139.2	73%	0.733	77%	0.767	S	S	*	*			cis	-162.4	158.5	-4.3	-115.4	165	0	0	0	110.5
549	T	42.9	Very low	39.9	Very low	128 Å²	128	139.4 Å²	139.4	79%	0.785	76%	0.761	S	S	*	*			trans	63.8	148.3	158.6	55.5	0	0	0	0	121.3
550	A	41.1	Very low	39.8	Very low	76 Å²	76	137.1 Å²	137.1	63%	0.628	75%	0.753	S	S	*	*			cis	-173.6	164.2	-20.8	0	0	0	0	0	111.7
551	I	41.5	Very low	39.6	Very low	150 Å²	150	134 Å²	134	77%	0.769	75%	0.746	S	S	*	*			trans	73.2	111.2	152.6	-68.5	151.2	0	0	0	116.7
552	H	40.7	Very low	39.3	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.806	75%	0.752	S	S	*	*				68	145.6	82.6	-83.7	-76.8	0	0	0	114
553	S	37.1	Very low	39.3	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	75%	0.751	S	S	*	*			cis	-168.1	143.3	-7.9	-140.8	0	0	0	0	110.3
554	V	40.1	Very low	39.3	Very low	117 Å²	117	132 Å²	132	71%	0.709	76%	0.755	S	S	*	*			trans	48.8	129.9	134.9	-179.4	0	0	0	0	122.7
555	D	35.3	Very low	39.3	Very low	145 Å²	145	127.7 Å²	127.7	78%	0.775	75%	0.751	S	S	*	*			trans	25.5	138.8	148.3	-49.8	-24.7	0	0	0	123.6
556	E	38.6	Very low	39.1	Very low	176 Å²	176	130.7 Å²	130.7	82%	0.822	75%	0.752	S	S	*	*				-173.3	167.8	107.1	-100.5	-155.8	160.8	0	0	114.6
557	N	36.2	Very low	39.1	Very low	141 Å²	141	131.9 Å²	131.9	75%	0.754	75%	0.749	S	S	*	*			trans	-73.7	167.6	-179.7	-64.8	-71.2	0	0	0	113.5
558	F	40.1	Very low	39.2	Very low	174 Å²	174	133.2 Å²	133.2	76%	0.763	75%	0.747	S	S	*	*				177.9	129.2	120.3	-100.6	-65.1	0	0	0	116.3
559	N	38.6	Very low	39.2	Very low	117 Å²	117	131.4 Å²	131.4	63%	0.626	74%	0.742	S	S	*	*			trans	56.8	117.3	135.6	-95	-14.1	0	0	0	125.6
560	R	38.8	Very low	39	Very low	200 Å²	200	131.8 Å²	131.8	76%	0.755	74%	0.739	S	S	*	*				81.1	135.8	113.7	-88.4	-179	-179	-151.1	-2.9	124.6
561	N	37.6	Very low	38.9	Very low	136 Å²	136	133.3 Å²	133.3	73%	0.727	74%	0.741	S	S	*	*			trans	75	150.8	142.7	-63.4	-3.7	0	0	0	119
562	S	36.4	Very low	38.5	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	74%	0.738	S	S	*	*			cis	-173.4	-174.6	-23.2	-170	0	0	0	0	108.7
563	V	43.5	Very low	38.4	Very low	130 Å²	130	130.5 Å²	130.5	79%	0.788	74%	0.737	S	S	*	*			trans	88.4	101.2	174.6	-171.2	0	0	0	0	113.6
564	A	40.5	Very low	38.5	Very low	101 Å²	101	131.6 Å²	131.6	84%	0.835	74%	0.74	S	S	*	*				74.2	134.4	65.9	0	0	0	0	0	114
565	G	40	Very low	38.2	Very low	75 Å²	75	134 Å²	134	77%	0.773	75%	0.749	S	S	*	*			cis	-134.3	-150.7	-10.9	0	0	0	0	0	110.1
566	E	38.2	Very low	38.2	Very low	185 Å²	185	130.2 Å²	130.2	86%	0.864	74%	0.744	S	S	*	*			cis	-150.8	149.3	-3.4	-79	-151.9	69.8	0	0	109
567	S	37.7	Very low	38	Very low	90 Å²	90	130 Å²	130	63%	0.629	74%	0.743	S	S	*	*				55	122.9	97.4	-133.3	0	0	0	0	115.7
568	L	40.2	Very low	37.8	Very low	144 Å²	144	129.3 Å²	129.3	75%	0.754	74%	0.739	S	S	*	*			cis	-159.4	134.5	49.2	-87.1	164.8	0	0	0	114.3
569	T	39	Very low	37.6	Very low	103 Å²	103	130.7 Å²	130.7	63%	0.632	75%	0.748	S	S	*	*			trans	44.2	151.5	132.3	65.2	0	0	0	0	123.4
570	N	38.1	Very low	37.1	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	76%	0.758	S	S	*	*			cis	-166.3	136.8	-5.8	-102.4	-1.4	0	0	0	109.1
571	T	38	Very low	36.7	Very low	108 Å²	108	132.7 Å²	132.7	66%	0.663	76%	0.756	S	S	*	*				79.1	104.4	101.4	-44.4	0	0	0	0	115.8
572	T	34.8	Very low	36.3	Very low	118 Å²	118	131.6 Å²	131.6	72%	0.724	75%	0.754	S	S	*	*				93.6	147.7	66.9	-42.2	0	0	0	0	114.4
573	L	38.2	Very low	35.9	Very low	148 Å²	148	133.4 Å²	133.4	78%	0.775	76%	0.756	S	S	*	*			trans	87.9	143.7	163.1	-50.8	172.3	0	0	0	117.4
574	T	38.1	Very low	35.6	Very low	113 Å²	113	133.8 Å²	133.8	69%	0.693	76%	0.759	S	S	*	*			cis	-167.1	150.7	-19.2	18.6	0	0	0	0	110.8
575	D	34.7	Very low	35.3	Very low	168 Å²	168	137.8 Å²	137.8	90%	0.898	76%	0.757	S	S	*	*			trans	58.8	158.7	149.4	-103.3	-43	0	0	0	124
576	G	35.5	Very low	35	Very low	65 Å²	65	141.4 Å²	141.4	67%	0.67	76%	0.758	S	S	*	*			trans	131.5	50.5	151.6	0	0	0	0	0	121.4
577	Q	34.3	Very low	34.6	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	76%	0.758	S	S	*	*			trans	34	131.6	150.2	-66.5	-166.8	7.7	0	0	124
578	N	31.1	Very low	34.2	Very low	128 Å²	128	139.8 Å²	139.8	68%	0.684	76%	0.761	S	S	*	*			trans	58.8	113.8	137.9	-62.3	-32.8	0	0	0	121.1
579	H	36.2	Very low	33.8	Very low	203 Å²	203	138.1 Å²	138.1	94%	0.94	76%	0.761	S	S	*	*				-162.9	172	124.6	-98.4	-58.5	0	0	0	111.7
580	R	27.8	Very low	33.5	Very low	221 Å²	221	138.6 Å²	138.6	83%	0.834	76%	0.764	S	S	*	*			trans	-115.7	156.9	-160.1	-178.4	-169.5	173.8	-172.9	-0.6	111.1
581	L	30	Very low	33.3	Very low	137 Å²	137	139.7 Å²	139.7	72%	0.717	77%	0.768	S	S	*	*			trans	102	134.2	162.3	-69.2	115.8	0	0	0	120.3
582	T	30.8	Very low	32.9	Very low	113 Å²	113	139.5 Å²	139.5	69%	0.693	77%	0.77	S	S	*	*			trans	72.8	120.7	143.8	48	0	0	0	0	123.6
583	D	28.1	Very low	32.7	Very low	147 Å²	147	141.4 Å²	141.4	79%	0.786	77%	0.774	S	S	*	*			trans	54.9	100	135	-61.9	-10.1	0	0	0	122.8
584	T	35.6	Very low	32.6	Very low	138 Å²	138	139.7 Å²	139.7	85%	0.847	77%	0.772	S	S	*	*			trans	-136.7	105	146.6	52.4	0	0	0	0	108.6
585	K	36	Very low	32.2	Very low	185 Å²	185	140.9 Å²	140.9	80%	0.804	77%	0.774	S	S	*	*				55.8	121.9	83.1	-79	-173	178.2	174.9	0	115.8
586	L	31.8	Very low	32.5	Very low	151 Å²	151	139.2 Å²	139.2	79%	0.791	77%	0.77	S	S	*	*			trans	61.2	114.4	144.5	-67	159.5	0	0	0	119
587	C	30.5	Very low	32.2	Very low	129 Å²	129	142 Å²	142	87%	0.872	77%	0.77	S	S	*	*			trans	-139.6	116.9	132.2	-162.8	0	0	0	0	110
588	T	29.9	Very low	32.3	Very low	111 Å²	111	139.9 Å²	139.9	68%	0.681	77%	0.768	S	S	*	*			trans	-84.2	133.3	171.9	-54.4	0	0	0	0	108.5
589	S	31.7	Very low	32.4	Very low	110 Å²	110	138.4 Å²	138.4	77%	0.769	77%	0.768	S	S	*	*			trans	-119.4	90	171.7	57.1	0	0	0	0	110.3
590	T	31.4	Very low	32.5	Very low	112 Å²	112	135.7 Å²	135.7	69%	0.687	76%	0.76	S	S	*	*			trans	-71.6	132.4	168.5	-54.4	0	0	0	0	109.3
591	I	34.2	Very low	32.7	Very low	159 Å²	159	131.5 Å²	131.5	82%	0.815	75%	0.754	S	S	*	*			trans	-110.9	109.4	166.8	-62.6	179	0	0	0	107.6
592	C	30.8	Very low	32.8	Very low	104 Å²	104	129.8 Å²	129.8	70%	0.703	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-82.5	143.1	175.4	-61.5	0	0	0	0	110.6
593	I	30.3	Very low	32.9	Very low	157 Å²	157	131.9 Å²	131.9	81%	0.805	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-94.2	123.1	170.2	-58	170.1	0	0	0	107.7
594	P	35.8	Very low	33.2	Very low	112 Å²	112	129.3 Å²	129.3	73%	0.727	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-86.5	120.6	168.5	31.9	-28.5	0	0	0	110.1
595	N	30.1	Very low	33.1	Very low	138 Å²	138	132 Å²	132	74%	0.738	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-95.4	126.5	167	-155.3	56.7	0	0	0	107.7
596	V	40.1	Very low	33.1	Very low	134 Å²	134	129.1 Å²	129.1	81%	0.812	75%	0.752	S	S	*	*			trans	-139.3	105.1	173.6	-177.9	0	0	0	0	109.6
597	D	30.4	Very low	33.3	Very low	124 Å²	124	131.4 Å²	131.4	66%	0.663	76%	0.756	S	S	*	*			trans	-82.5	172.9	161.8	-70.6	-62	0	0	0	110.6
598	T	36.4	Very low	33.3	Very low	125 Å²	125	135.7 Å²	135.7	77%	0.767	75%	0.754	S	S	*	*			trans	94.5	81.9	159.4	-42.5	0	0	0	0	117.7
599	S	33.6	Very low	33.6	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	76%	0.764	S	S	*	*				66.2	139.1	116.9	94.2	0	0	0	0	124
600	L	36.6	Very low	33.5	Very low	147 Å²	147	140.1 Å²	140.1	77%	0.77	76%	0.764	S	S	*	*			trans	76	126.4	149.4	-65.4	171.7	0	0	0	122.9
601	N	33	Very low	33.5	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	77%	0.767	S	S	*	*			trans	78	100.6	143.3	-66.1	-8.4	0	0	0	121.9
602	S	31.5	Very low	33.8	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	77%	0.769	S	S	*	*				54	121.4	128.9	65.8	0	0	0	0	120.7
603	I	34.5	Very low	33.9	Very low	156 Å²	156	140.4 Å²	140.4	80%	0.8	77%	0.77	S	S	*	*				-173.7	126.9	108.8	-95.2	157.7	0	0	0	112
604	S	32.9	Very low	34.3	Very low	93 Å²	93	140.9 Å²	140.9	65%	0.65	77%	0.772	S	S	*	*			trans	13.4	127.1	162.6	70.1	0	0	0	0	122.7
605	K	34.3	Very low	34.1	Very low	196 Å²	196	144 Å²	144	85%	0.852	78%	0.775	S	S	*	*				166.9	125.4	103.8	-89.9	169.6	-173.7	175.3	0	111.9
606	P	36.2	Very low	34.5	Very low	124 Å²	124	143.3 Å²	143.3	81%	0.805	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-99.5	145.3	174	36.2	-30.8	0	0	0	112.8
607	F	34.4	Very low	34.1	Very low	199 Å²	199	142.4 Å²	142.4	87%	0.873	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-94.1	121.1	166	-106.6	-89.6	0	0	0	110.4
608	R	31.2	Very low	34.3	Very low	219 Å²	219	144.5 Å²	144.5	83%	0.826	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-92.9	148	164.5	-76.2	-175.7	177.8	177.7	0.2	109.5
609	F	35.4	Very low	34.4	Very low	205 Å²	205	144.3 Å²	144.3	90%	0.899	79%	0.787	S	S	*	*			trans	-113.5	141	144.6	-91	-82.4	0	0	0	109.3
610	S	31	Very low	34.6	Very low	109 Å²	109	149.4 Å²	149.4	76%	0.762	80%	0.797	S	S	*	*			trans	-92.3	157.5	-163.7	-65.6	0	0	0	0	114.2
611	T	30.8	Very low	34.5	Very low	123 Å²	123	148.1 Å²	148.1	76%	0.755	80%	0.798	S	S	*	*			trans	-71.8	153.9	176.2	50.6	0	0	0	0	114.3
612	S	39.8	Very low	34.5	Very low	121 Å²	121	148.9 Å²	148.9	85%	0.846	81%	0.807	S	S	*	*			trans	-135.4	120.3	149.6	58.8	0	0	0	0	110.3
613	N	33.8	Very low	34.5	Very low	137 Å²	137	153 Å²	153	73%	0.733	82%	0.815	S	S	*	*			trans	-89.1	140.3	-177.5	-56.7	-38.6	0	0	0	111.5
614	I	38.9	Very low	34.6	Very low	166 Å²	166	151.2 Å²	151.2	85%	0.851	82%	0.816	S	S	*	*			trans	-141.5	116.4	148.9	-57.6	-176.7	0	0	0	108.8
615	F	31.6	Very low	34.4	Very low	178 Å²	178	152.7 Å²	152.7	78%	0.781	82%	0.822	S	S	*	*			trans	-95.5	156.7	159	-89.7	-90.3	0	0	0	108.3	T617	F615-T617 HydrophobicContact CD1-CG2 4.38Å
616	P	37.8	Very low	34.4	Very low	123 Å²	123	149.9 Å²	149.9	80%	0.799	82%	0.821	S	S	*	*				-140.3	164.6	105.6	35.7	-22.2	0	0	0	114.4
617	T	33.2	Very low	34	Very low	115 Å²	115	150.4 Å²	150.4	71%	0.706	82%	0.817	S	S	*	*			trans	-107.8	161.1	-173.9	51	0	0	0	0	113.3	F615	F615-T617 HydrophobicContact CD1-CG2 4.38Å
618	L	33.4	Very low	33.9	Very low	168 Å²	168	146.9 Å²	146.9	88%	0.88	81%	0.812	S	S	*	*			trans	87.2	104.8	142.1	-152.4	80.6	0	0	0	120
619	S	39.2	Very low	33.7	Very low	122 Å²	122	147.8 Å²	147.8	85%	0.853	82%	0.815	S	S	*	*				-163.9	160	127.7	58.4	0	0	0	0	112.2
620	K	37.6	Very low	33.5	Very low	203 Å²	203	148 Å²	148	88%	0.883	82%	0.816	S	S	*	*			trans	-82.3	167.3	-164.2	-91.2	176.1	176.2	175.4	0	115.8
621	P	34.5	Very low	33.4	Very low	120 Å²	120	147.9 Å²	147.9	78%	0.779	82%	0.815	S	S	*	*			trans	-98	166	-173.6	39.4	-36	0	0	0	114.6
622	T	33.7	Very low	33.5	Very low	148 Å²	148	148 Å²	148	91%	0.908	82%	0.818	S	S	*	*			trans	-136.8	145.7	162.9	-21.9	0	0	0	0	110.6
623	Q	31.4	Very low	33.3	Very low	188 Å²	188	150.2 Å²	150.2	88%	0.879	82%	0.815	S	S	*	*			trans	-85.3	145.4	-175.9	-60.8	164.9	-9.1	0	0	111.9
624	S	35.2	Very low	33.2	Very low	118 Å²	118	151.6 Å²	151.6	83%	0.825	82%	0.817	S	S	*	*			trans	-155.9	125.8	142.1	58.4	0	0	0	0	111.6
625	T	28.9	Very low	33	Very low	124 Å²	124	152.4 Å²	152.4	76%	0.761	82%	0.82	S	S	*	*			trans	-64.2	150.4	175.8	-40.4	0	0	0	0	112.3
626	V	35.2	Very low	33	Very low	138 Å²	138	153.8 Å²	153.8	84%	0.836	83%	0.825	S	S	*	*				179.2	126.8	126.8	149.4	0	0	0	0	109.4
627	D	27.2	Very low	33.2	Very low	134 Å²	134	153.8 Å²	153.8	72%	0.717	82%	0.823	S	S	*	*			trans	-65.3	154.5	171.9	-57.3	-88	0	0	0	112.3
628	T	31.7	Very low	33.3	Very low	126 Å²	126	159.3 Å²	159.3	77%	0.773	83%	0.831	S	S	*	*				-176.8	136.2	113.7	-74.5	0	0	0	0	112.5
629	R	27.4	Very low	33.5	Very low	238 Å²	238	162.7 Å²	162.7	90%	0.898	83%	0.832	S	S	*	*			trans	-34.4	133.1	172.7	-58.5	163.8	-174.1	173.3	1.8	115.8
630	F	31.5	Very low	33.4	Very low	209 Å²	209	164.6 Å²	164.6	92%	0.917	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-89.7	124.6	151.5	-86.3	-84.6	0	0	0	110.6
631	S	29.4	Very low	33.4	Very low	106 Å²	106	165.7 Å²	165.7	74%	0.741	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-92.3	138.7	174.6	-174.1	0	0	0	0	110.6
632	P	33.4	Very low	33.9	Very low	125 Å²	125	168.4 Å²	168.4	81%	0.812	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-93	124.5	173.1	34.1	-28.5	0	0	0	110.8
633	E	34	Very low	34	Very low	169 Å²	169	165 Å²	165	79%	0.79	82%	0.819	S	S	*	*			trans	-142.7	153	167.7	-141.4	-163.6	177.1	0	0	114
634	Q	33	Very low	34.3	Very low	166 Å²	166	165.2 Å²	165.2	78%	0.776	82%	0.82	S	S	*	*			trans	79.3	76	165.8	-48	-166.8	29.7	0	0	118.2
635	M	33.2	Very low	34.5	Very low	183 Å²	183	167.4 Å²	167.4	90%	0.901	82%	0.819	S	S	*	*			trans	-127.7	108.9	139.9	-147.6	178.1	-165.5	0	0	111.3	V637	M635-V637 PolarHBondContact O-N 2.85Å; M635-V637 VanDerWaalsContact O-N 3.16Å
636	K	33.3	Very low	34.8	Very low	206 Å²	206	168.9 Å²	168.9	90%	0.896	82%	0.823	S	S	*	*			trans	-89.6	77.9	-162.1	-157.7	167.1	-170.6	166.8	0	111.9	R638	K636-R638 PolarHBondContact O-N 3.47Å
637	V	40.2	Very low	35.1	Very low	124 Å²	124	168.8 Å²	168.8	75%	0.752	82%	0.817	S	S	*	*			trans	-74.1	106.3	-178.9	-176	0	0	0	0	111.5	M635 R639	M635-V637 PolarHBondContact O-N 2.85Å; M635-V637 VanDerWaalsContact O-N 3.16Å; V637-R639 PolarHBondContact O-N 3.35Å
638	R	37	Very low	35.8	Very low	230 Å²	230	170.9 Å²	170.9	87%	0.868	82%	0.82	S	S	*	*			trans	-70	108	172.3	-67.8	-178.5	174	114.7	-6.7	110.5	K636 L640	K636-R638 PolarHBondContact O-N 3.47Å; R638-L640 PolarHBondContact O-N 3.45Å
639	R	37.6	Very low	36.2	Very low	240 Å²	240	169.8 Å²	169.8	91%	0.906	82%	0.824	S	S	*	*			trans	-78.5	104.9	166.6	-81.8	-175.9	169.6	130.4	-3.6	110.2	V637	V637-R639 PolarHBondContact O-N 3.35Å
640	L	36.3	Very low	36.6	Very low	161 Å²	161	163.8 Å²	163.8	84%	0.843	82%	0.818	S	S	*	*			trans	-72.1	126	167.1	-73.1	168.7	0	0	0	110	R638 L642	R638-L640 PolarHBondContact O-N 3.45Å; L640-L642 PolarHBondContact O-N 3.39Å
641	R	37.2	Very low	37	Very low	226 Å²	226	157.8 Å²	157.8	85%	0.853	82%	0.815	S	S	*	*			trans	-77.6	111.3	173	-87.3	-81.1	-178.7	145.3	-1.5	109.3	S643	R641-S643 PolarHBondContact O-N 3.17Å
642	L	46	Very low	37.6	Very low	178 Å²	178	164.4 Å²	164.4	93%	0.932	82%	0.824	S	S	*	*			trans	-75.5	65.8	172.8	-123.3	87.5	0	0	0	110.9	L640	L640-L642 PolarHBondContact O-N 3.39Å
643	S	35.6	Very low	38	Very low	76 Å²	76	162 Å²	162	53%	0.531	82%	0.821	S	S	.	*			trans	-146.3	64.5	180	60.5	0	0	0	0	111.1	R641	R641-S643 PolarHBondContact O-N 3.17Å
644	Q	36.1	Very low	38.3	Very low	193 Å²	193	160.4 Å²	160.4	90%	0.902	83%	0.829	S	S	*	*			trans	-174.5	0.3	161	-108.6	163.8	29.9	0	0	116.4	N646	Q644-N646 PolarHBondContact O-N 3.44Å
645	M	40.5	Very low	38.7	Very low	163 Å²	163	156 Å²	156	80%	0.803	83%	0.829	S	S	*	*			trans	-76	84.9	177.2	-98.3	173.8	55.9	0	0	113.1	L647	M645-L647 HydrophobicContact CE-CD1 3.74Å; M645-L647 HydrophobicContact CG-CD1 4.35Å; M645-L647 PolarHBondContact O-N 3.44Å; M645-L647 HydrophobicContact SD-CD1 4.42Å
646	N	35.9	Very low	39.1	Very low	155 Å²	155	151.8 Å²	151.8	83%	0.829	82%	0.823	S	S	*	*			trans	-74.4	103.1	148.6	-94.8	-19.1	0	0	0	107.6	Q644	Q644-N646 PolarHBondContact O-N 3.44Å
647	L	41.3	Very low	39.2	Very low	136 Å²	136	147.8 Å²	147.8	71%	0.712	82%	0.818	S	S	*	*			trans	-123.6	120.5	175.9	-123.9	160.5	0	0	0	110.5	M645	M645-L647 HydrophobicContact CE-CD1 3.74Å; M645-L647 HydrophobicContact CG-CD1 4.35Å; M645-L647 PolarHBondContact O-N 3.44Å; M645-L647 HydrophobicContact SD-CD1 4.42Å
648	F	41	Very low	39.4	Very low	179 Å²	179	148.3 Å²	148.3	79%	0.785	82%	0.821	S	S	*	*			trans	-70.4	142	-162.1	-64.7	-102.1	0	0	0	113.6
649	A	39.8	Very low	39.6	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	82%	0.815	S	S	*	*			trans	-151.5	56.2	155	0	0	0	0	0	109.8	G651	A649-G651 PolarHBondContact O-N 3.23Å
650	S	36.9	Very low	39.8	Very low	111 Å²	111	139 Å²	139	78%	0.776	81%	0.811	S	S	*	*			trans	-71.3	88.9	176.9	-67.5	0	0	0	0	111.2	R652	S650-R652 PolarHBondContact O-N 3.2Å
651	G	39.2	Very low	40	Very low	83 Å²	83	142.7 Å²	142.7	86%	0.856	81%	0.814	S	S	*	*			trans	-88.2	67.6	167.2	0	0	0	0	0	112.1	A649	A649-G651 PolarHBondContact O-N 3.23Å
652	R	43.2	Very low	39.8	Very low	245 Å²	245	140.2 Å²	140.2	93%	0.925	82%	0.816	S	S	*	*			trans	-112.8	107.3	165.8	-78.2	-163.9	-178.7	-148.5	3.3	109.3	S650	S650-R652 PolarHBondContact O-N 3.2Å
653	G	40.6	Very low	39.4	Very low	74 Å²	74	134.8 Å²	134.8	76%	0.763	80%	0.803	S	S	*	*			trans	-98.2	128.6	172.1	0	0	0	0	0	111.4
654	S	40.1	Very low	39.3	Very low	136 Å²	136	139.4 Å²	139.4	95%	0.951	82%	0.816	S	S	*	*			trans	56	114.6	162.3	-147.6	0	0	0	0	119.6
655	G	41.6	Very low	39.6	Very low	75 Å²	75	137.8 Å²	137.8	77%	0.773	81%	0.808	S	S	*	*			trans	-177.8	95	168.5	0	0	0	0	0	108.1
656	A	42	Very low	39.4	Very low	93 Å²	93	137.4 Å²	137.4	77%	0.769	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-67.6	148.4	-162.9	0	0	0	0	0	114
657	P	35.9	Very low	39.2	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-85.3	125.5	175.6	33.3	-31.3	0	0	0	111.4
658	V	44.3	Very low	39	Very low	134 Å²	134	136 Å²	136	81%	0.812	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-99.1	119.2	164.2	179.4	0	0	0	0	108.1
659	P	39.7	Very low	38.6	Very low	115 Å²	115	134 Å²	134	75%	0.747	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-86.8	123.5	-177.5	32.4	-31.9	0	0	0	111.4
660	I	42.1	Very low	38.5	Very low	159 Å²	159	138.2 Å²	138.2	82%	0.815	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-95.5	118.5	165.4	-64.2	173.3	0	0	0	107.5
661	R	40.9	Very low	38.5	Very low	239 Å²	239	137.7 Å²	137.7	90%	0.902	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.6	137	176.2	-71.5	-179.7	176.9	162	-1.8	110.3
662	I	33.9	Very low	38.6	Very low	175 Å²	175	139.5 Å²	139.5	90%	0.897	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-98.1	130.1	158.9	-64.2	169.3	0	0	0	105.8
663	G	36.6	Very low	38.4	Very low	64 Å²	64	133.7 Å²	133.7	66%	0.66	76%	0.762	S	S	*	*			trans	177.4	73.6	-174.2	0	0	0	0	0	115.5
664	E	33.7	Very low	38.2	Very low	172 Å²	172	140.1 Å²	140.1	80%	0.804	76%	0.764	S	S	*	*			trans	68.9	162.1	144.4	-51.7	-171.4	133.4	0	0	122.2
665	H	41.7	Very low	37.9	Very low	160 Å²	160	138.6 Å²	138.6	74%	0.741	75%	0.749	S	S	*	*			trans	79.6	88	163.6	-58	-61.7	0	0	0	121.4
666	H	36.5	Very low	37.8	Very low	154 Å²	154	143.5 Å²	143.5	71%	0.713	75%	0.751	S	S	*	*				82.4	136.6	115.9	-150.8	-80.6	0	0	0	120.1
667	L	32	Very low	37.4	Very low	122 Å²	122	144.9 Å²	144.9	64%	0.639	75%	0.75	S	S	*	*			trans	-51.2	149	172.7	-45.8	96.4	0	0	0	112.4
668	D	37.5	Very low	37.4	Very low	140 Å²	140	144.9 Å²	144.9	75%	0.749	75%	0.753	S	S	*	*				-160.7	161.9	92.8	-120.4	-43.7	0	0	0	116.1
669	N	32.7	Very low	36.7	Very low	136 Å²	136	145.1 Å²	145.1	73%	0.727	76%	0.755	S	S	*	*			trans	-78.1	150.3	-178.5	-57.2	-87.2	0	0	0	112.1
670	K	38.2	Very low	36.6	Very low	193 Å²	193	144.6 Å²	144.6	84%	0.839	76%	0.76	S	S	*	*				-159.8	141.3	115.7	-150.6	148.3	-178	174.7	0	115.2
671	T	36.8	Very low	36.2	Very low	100 Å²	100	143 Å²	143	61%	0.613	76%	0.758	S	S	*	*			trans	-49.6	159.9	164.8	52.3	0	0	0	0	113
672	D	40.7	Very low	36	Very low	120 Å²	120	139.7 Å²	139.7	64%	0.642	76%	0.757	S	S	*	*				-178.3	145.1	66.8	-99	-58.1	0	0	0	114.8
673	N	38	Very low	35.9	Very low	123 Å²	123	139.4 Å²	139.4	66%	0.658	75%	0.752	S	S	*	*			trans	65.5	108.3	133.9	-66.4	-35	0	0	0	126.2
674	R	37.1	Very low	35.9	Very low	210 Å²	210	141.5 Å²	141.5	79%	0.792	76%	0.757	S	S	*	*				88.7	119.6	95.3	-154	-176.5	175.9	158.8	0.7	120.9
675	T	35.2	Very low	36.1	Very low	104 Å²	104	141 Å²	141	64%	0.638	76%	0.758	S	S	*	*			trans	59.8	135.9	147.5	56.4	0	0	0	0	120
676	H	38.8	Very low	36	Very low	177 Å²	177	138.8 Å²	138.8	82%	0.819	76%	0.758	S	S	*	*				-159	160.5	67.7	-119.5	-90.9	0	0	0	115.3
677	V	32.4	Very low	36.1	Very low	123 Å²	123	139.3 Å²	139.3	75%	0.745	76%	0.764	S	S	*	*			trans	-95	145.2	175.3	170.5	0	0	0	0	110.4
678	S	36.9	Very low	36.1	Very low	123 Å²	123	143.4 Å²	143.4	86%	0.86	77%	0.771	S	S	*	*			trans	-167.2	138.4	141.8	-84.2	0	0	0	0	114.4
679	T	30.4	Very low	36.1	Very low	139 Å²	139	144.1 Å²	144.1	85%	0.853	77%	0.774	S	S	*	*			trans	-84.1	147	173.2	32.7	0	0	0	0	112.9
680	A	37.6	Very low	36.1	Very low	104 Å²	104	143.6 Å²	143.6	86%	0.86	77%	0.769	S	S	*	*			trans	-164.6	131.4	143.8	0	0	0	0	0	114.1
681	T	32.7	Very low	36.4	Very low	126 Å²	126	143.1 Å²	143.1	77%	0.773	77%	0.769	S	S	*	*			trans	-59.8	149.2	172.1	-44.1	0	0	0	0	114.7
682	L	37.6	Very low	36.5	Very low	169 Å²	169	146.6 Å²	146.6	89%	0.885	78%	0.776	S	S	*	*			trans	-172.1	148.7	131.5	-103.6	164.8	0	0	0	113.8
683	Q	31	Very low	36.3	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	78%	0.781	S	S	*	*			trans	-89.2	152.3	178.4	-64.8	154.3	-85.3	0	0	111.7
684	S	36.9	Very low	36.7	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	78%	0.776	S	S	*	*				171	127.7	120.8	44.5	0	0	0	0	115.8
685	I	36.7	Very low	36.8	Very low	161 Å²	161	142.5 Å²	142.5	83%	0.826	78%	0.775	S	S	*	*			trans	64.2	136.5	131.7	-58.3	174.4	0	0	0	120.2
686	P	39.7	Very low	37	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	78%	0.783	S	S	*	*			trans	-101.8	162.7	-171	40.2	-35.5	0	0	0	114.9
687	I	39.5	Very low	36.8	Very low	165 Å²	165	146.9 Å²	146.9	85%	0.846	78%	0.783	S	S	*	*			trans	-130.4	140.1	169.6	-63.7	-177.7	0	0	0	111.7
688	R	31.6	Very low	37.2	Very low	208 Å²	208	148.7 Å²	148.7	79%	0.785	79%	0.787	S	S	*	*			trans	-108.6	139.9	-178.2	-176.7	-169.2	-162.1	-177.9	6.8	108.5
689	L	38.3	Very low	37.4	Very low	155 Å²	155	148.4 Å²	148.4	81%	0.812	79%	0.785	S	S	*	*			trans	-132.7	113.1	170.8	-107.9	159.2	0	0	0	110.7
690	M	32.4	Very low	37.7	Very low	125 Å²	125	145.9 Å²	145.9	62%	0.616	78%	0.778	S	S	*	*			trans	-94.6	157.6	163.3	-76.1	-177.1	167.9	0	0	109
691	H	44.6	Very low	37.7	Very low	182 Å²	182	149.8 Å²	149.8	84%	0.843	78%	0.78	S	S	*	*			trans	-134.9	137.4	153.2	-114.1	-99.3	0	0	0	110.9
692	F	37.7	Very low	38.2	Very low	174 Å²	174	148.6 Å²	148.6	76%	0.763	78%	0.777	S	S	*	*			trans	-75.7	172.3	-177.8	-85.7	-113	0	0	0	111.4
693	S	38.3	Very low	38.6	Very low	105 Å²	105	151.2 Å²	151.2	73%	0.734	78%	0.775	S	S	*	*				-176.4	-173.1	57.7	-134.6	0	0	0	0	112.5
694	P	44.6	Very low	39.1	Very low	88 Å²	88	151.4 Å²	151.4	57%	0.571	78%	0.781	S	S	*	*				-136.5	-175.1	-118.7	38.7	-15.5	0	0	0	116.8
695	F	39.1	Very low	39.5	Very low	174 Å²	174	157.5 Å²	157.5	76%	0.763	81%	0.805	S	S	*	*				160.5	140.1	122.8	-96.2	-66.5	0	0	0	116.9
696	R	39.9	Very low	39.6	Very low	215 Å²	215	157.3 Å²	157.3	81%	0.811	80%	0.804	S	S	*	*			trans	60.7	120.6	157.3	-60.4	178.3	-176.7	-171.7	-1.6	118.1
697	I	35.1	Very low	39.6	Very low	157 Å²	157	159.5 Å²	159.5	81%	0.805	81%	0.807	S	S	*	*			cis	82.6	140.9	34.8	-52.1	174.3	0	0	0	114.1
698	I	40.6	Very low	39.6	Very low	162 Å²	162	159.2 Å²	159.2	83%	0.831	81%	0.805	S	S	*	*			trans	90.3	125.4	-178.8	-52.4	174.8	0	0	0	112.7
699	S	40.9	Very low	40.1	Very low	117 Å²	117	156.4 Å²	156.4	82%	0.818	81%	0.806	S	S	*	*			cis	-146.3	167	0.4	-158.8	0	0	0	0	111.9
700	A	37.6	Very low	40.2	Very low	85 Å²	85	156.4 Å²	156.4	70%	0.702	81%	0.805	S	S	*	*			trans	-134.7	157.7	171.4	0	0	0	0	0	112.3
701	M	36.6	Very low	40.8	Very low	187 Å²	187	158.5 Å²	158.5	92%	0.921	82%	0.818	S	S	*	*			trans	62.8	117.7	165.1	-69.3	-160.8	163.1	0	0	121.1
702	S	43.9	Very low	40.5	Very low	100 Å²	100	156.9 Å²	156.9	70%	0.699	82%	0.816	S	S	*	*				-158.7	132.1	126.3	-113.4	0	0	0	0	113.8
703	R	44.9	Very low	40.7	Very low	225 Å²	225	155.5 Å²	155.5	85%	0.849	82%	0.82	S	S	*	*			trans	71.3	102	146.3	-60.3	169.4	-164.9	-140.8	-2	119.8
704	L	42	Very low	40.9	Very low	173 Å²	173	159.8 Å²	159.8	91%	0.906	83%	0.827	S	S	*	*				9.3	115.8	115.8	-74.9	147.4	0	0	0	116.4
705	N	45.5	Very low	40.6	Very low	234 Å²	234	166.3 Å²	166.3	100%	1.251	85%	0.851	S	S	*	*				-148.7	0	113.3	-135.9	28.3	0	0	0	109

Retrieved 705 of 705 residues in 435.1 ms (Link to these results)

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