A0A3Q0KRL4_SCHMA Loading...

rRNA adenine N(6)-methyltransferase

AlphaFold DB (A0A5K4ETU1), UniProt , Accession A0A3Q0KRL4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 289 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.4	Very low	56	Low	238 Å²	238	104.3 Å²	104.3	100%	1.172	53%	0.529	S	S	*	.				0	118.2	0	-80.5	173.6	171.5	0	0	108
2	G	44.7	Very low	57.2	Low	82 Å²	82	97.5 Å²	97.5	85%	0.845	50%	0.495	S	S	*	.			trans	-74.9	122.6	170.4	0	0	0	0	0	108.5	Q4	G2-Q4 PolarHBondContact O-N 3.47Å
3	T	50.7	Low	58.7	Low	69 Å²	69	90.3 Å²	90.3	42%	0.423	46%	0.459	S	S	.	.			trans	-71.9	127	176.5	-47.9	0	0	0	0	109.5	M5 C17 I67	T3-M5 PolarHBondContact O-N 3.16Å; T3-C17 HydrophobicContact CG2-CB 3.79Å; T3-C17 VanDerWaalsContact CG2-SG 3.59Å; T3-C17 PolarHBondContact OG1-SG 2.84Å; T3-I67 HydrophobicContact CG2-CD1 3.54Å
4	Q	51.7	Low	60	Low	170 Å²	170	86.4 Å²	86.4	79%	0.794	44%	0.437	S	S	*	.			trans	-83.6	112.5	176.7	-165.2	170.6	-3.1	0	0	109	G2 D6	G2-Q4 PolarHBondContact O-N 3.47Å; Q4-D6 PolarHBondContact O-N 3.24Å
5	M	57.6	Low	61.1	Low	33 Å²	33	81.9 Å²	81.9	16%	0.163	41%	0.413	C	S	.	.			trans	-64.1	129.3	165.6	-79.2	178	93	0	0	108.4	T3 I7 I67 G68 T101 T103 V155	T3-M5 PolarHBondContact O-N 3.16Å; M5-I7 VanDerWaalsContact C-N 3.29Å; M5-I7 HydrophobicContact CB-CG2 3.83Å; M5-I7 PolarHBondContact O-N 3.15Å; M5-I67 HydrophobicContact CE-CG2 3.94Å; M5-I67 HydrophobicContact CG-CG2 3.28Å; M5-I67 HydrophobicContact SD-CG2 3.99Å; M5-G68 WeakPolarHBondContact CE-O 3.48Å; M5-T101 HydrophobicContact SD-CG2 3.87Å; M5-T103 HydrophobicContact CE-CG2 3.87Å; M5-V155 HydrophobicContact SD-CG1 4.33Å
6	D	65.9	Low	61.7	Low	53 Å²	53	79.8 Å²	79.8	28%	0.283	40%	0.404	S	S	.	.			trans	-76.3	89.2	166.8	-173.8	-1	0	0	0	107.7	Q4 Y8 I12	Q4-D6 PolarHBondContact O-N 3.24Å; D6-Y8 VanDerWaalsContact C-N 3.29Å; D6-Y8 PolarHBondContact OD1-N 3.12Å; D6-I12 HydrophobicContact CB-CD1 3.96Å
7	I	63.9	Low	61.5	Low	32 Å²	32	78.1 Å²	78.1	16%	0.164	40%	0.4	C	S	.	.			trans	-79	-14.5	-176.7	59.7	172.3	0	0	0	112.3	M5 N69 I140 F145	M5-I7 VanDerWaalsContact C-N 3.29Å; M5-I7 HydrophobicContact CB-CG2 3.83Å; M5-I7 PolarHBondContact O-N 3.15Å; I7-N69 PolarHBondContact O-ND2 3.29Å; I7-I140 HydrophobicContact CB-CD1 4.46Å; I7-I140 HydrophobicContact CD1-CD1 4.46Å; I7-I140 HydrophobicContact CD1-CG2 4.29Å; I7-I140 HydrophobicContact CG2-CD1 3.81Å; I7-F145 HydrophobicContact CB-CE1 4.42Å; I7-F145 WeakPolarHBondContact O-CD1 3.38Å; I7-F145 WeakPolarHBondContact O-CE1 3.39Å
8	Y	61.1	Low	61.1	Low	153 Å²	153	81.9 Å²	81.9	60%	0.6	42%	0.416	S	S	*	.	S	Bend	trans	-82.2	-24.5	-174.7	-61.3	-73.7	0	0	0	112.8	D6 A144	D6-Y8 VanDerWaalsContact C-N 3.29Å; D6-Y8 PolarHBondContact OD1-N 3.12Å; Y8-A144 WeakPolarHBondContact CD1-O 3.42Å
9	R	63.8	Low	61	Low	177 Å²	177	78.7 Å²	78.7	67%	0.668	41%	0.405	S	S	*	.	S	Bend	trans	-104.5	121.7	174.1	-71.4	-178.9	177	-176.7	0.6	110	I12 N69	R9-I12 HydrophobicContact CB-CD1 3.51Å; R9-I12 HydrophobicContact CB-CG1 4.22Å; R9-I12 HydrophobicContact CG-CD1 4.44Å; R9-N69 PolarHBondContact O-ND2 3.16Å
10	Q	60.5	Low	60.6	Low	60 Å²	60	80.1 Å²	80.1	28%	0.28	41%	0.412	S	S	.	.	S	Bend	trans	-68.4	161.5	163.4	-65.4	178.9	-1.4	0	0	108.9
11	D	66.3	Low	60.4	Low	80 Å²	80	78.7 Å²	78.7	43%	0.428	40%	0.403	S	S	.	.	S	Bend	trans	77.4	27.1	174.8	-59.7	-61.7	0	0	0	117.6	I23 N69 P71	D11-I23 HydrophobicContact CB-CD1 4.24Å; D11-I23 WeakPolarHBondContact OD1-CD1 3.1Å; D11-N69 PolarHBondContact N-O 3.1Å; D11-P71 WeakPolarHBondContact OD1-CD 3.48Å; D11-P71 WeakPolarHBondContact OD1-CG 3.36Å
12	I	70.2	Confident	61.7	Low	23 Å²	23	70.9 Å²	70.9	12%	0.118	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.7	179	-61.4	-179.8	0	0	0	110.6	D6 R9 K14 I20 G68 N69	D6-I12 HydrophobicContact CB-CD1 3.96Å; R9-I12 HydrophobicContact CB-CD1 3.51Å; R9-I12 HydrophobicContact CB-CG1 4.22Å; R9-I12 HydrophobicContact CG-CD1 4.44Å; I12-K14 HydrophobicContact CG2-CD 4.37Å; I12-K14 HydrophobicContact CG2-CG 3.8Å; I12-I20 HydrophobicContact CG2-CG2 4.01Å; I12-G68 CarbonylContact O-C 3.53Å; I12-G68 VanDerWaalsContact O-CA 3.23Å; I12-G68 WeakPolarHBondContact O-CA 3.44Å; I12-N69 PolarHBondContact N-O 3.11Å; I12-N69 PolarHBondContact O-N 3.05Å
13	L	77	Confident	62	Low	4 Å²	4	68 Å²	68	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.9	168.1	-171.8	52.3	0	0	0	109.5	F15 F21 M26 V66 L70 W82	L13-F15 HydrophobicContact CD2-CE2 4.27Å; L13-F15 HydrophobicContact CD2-CZ 4.19Å; L13-F15 HydrophobicContact CG-CE2 4.01Å; L13-F15 HydrophobicContact CG-CZ 4.21Å; L13-F21 PolarHBondContact N-O 2.84Å; L13-F21 PolarHBondContact O-N 3.34Å; L13-M26 HydrophobicContact CD2-CE 4.4Å; L13-M26 HydrophobicContact CD2-SD 3.31Å; L13-M26 WeakPolarHBondContact CD2-SD 3.29Å; L13-M26 HydrophobicContact CG-SD 4.14Å; L13-V66 HydrophobicContact CD1-CG1 3.42Å; L13-V66 VanDerWaalsContact CD1-CG1 3.42Å; L13-V66 HydrophobicContact CG-CG1 4.47Å; L13-L70 HydrophobicContact CB-CD2 4.1Å; L13-L70 HydrophobicContact CD1-CD2 4.37Å; L13-W82 HydrophobicContact CD1-CH2 4.1Å; L13-W82 HydrophobicContact CD2-CH2 4.01Å; L13-W82 HydrophobicContact CD2-CZ2 4.12Å
14	K	76.2	Confident	62.1	Low	35 Å²	35	69.3 Å²	69.3	15%	0.152	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.2	-178.1	-57.8	-168.3	-179.5	-171.8	0	111.7	I12 G19 I20 V66 I67	I12-K14 HydrophobicContact CG2-CD 4.37Å; I12-K14 HydrophobicContact CG2-CG 3.8Å; K14-G19 CarbonylContact C-O 3.53Å; K14-G19 WeakPolarHBondContact CA-O 3.46Å; K14-G19 WeakPolarHBondContact CB-O 3.3Å; K14-I20 HydrophobicContact CD-CD1 4.39Å; K14-I20 HydrophobicContact CD-CG1 3.89Å; K14-I20 HydrophobicContact CG-CB 4.42Å; K14-I20 HydrophobicContact CG-CG1 4.11Å; K14-I20 HydrophobicContact CG-CG2 4.33Å; K14-V66 WeakPolarHBondContact O-CA 3.38Å; K14-I67 PolarHBondContact N-O 3.26Å; K14-I67 PolarHBondContact O-N 3.11Å
15	F	77.3	Confident	62.1	Low	19 Å²	19	63.8 Å²	63.8	8%	0.083	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.4	173.3	-65	-87.8	0	0	0	110.4	L13 C17 E18 G19 F21 M26 W32 L64 C65 V66 I92	L13-F15 HydrophobicContact CD2-CE2 4.27Å; L13-F15 HydrophobicContact CD2-CZ 4.19Å; L13-F15 HydrophobicContact CG-CE2 4.01Å; L13-F15 HydrophobicContact CG-CZ 4.21Å; F15-C17 PolarHBondContact O-N 3.06Å; F15-E18 PolarHBondContact O-N 3.5Å; F15-G19 PolarHBondContact N-O 2.62Å; F15-G19 PolarHBondContact O-N 2.72Å; F15-F21 HydrophobicContact CB-CE2 4.17Å; F15-F21 AromaticContact CD2-CD2 3.5Å; F15-F21 HydrophobicContact CD2-CD2 3.5Å; F15-F21 VanDerWaalsContact CD2-CD2 3.5Å; F15-F21 AromaticContact CD2-CE2 3.66Å; F15-F21 HydrophobicContact CD2-CE2 3.66Å; F15-F21 HydrophobicContact CD2-CG 4.32Å; F15-F21 HydrophobicContact CE2-CD2 4.13Å; F15-F21 HydrophobicContact CG-CE2 4.38Å; F15-M26 HydrophobicContact CE2-CE 3.64Å; F15-M26 HydrophobicContact CE2-SD 3.51Å; F15-M26 VanDerWaalsContact CE2-SD 3.51Å; F15-M26 HydrophobicContact CZ-CE 3.36Å; F15-M26 HydrophobicContact CZ-SD 3.73Å; F15-W32 AromaticContact CE1-CH2 3.97Å; F15-W32 HydrophobicContact CE1-CH2 3.97Å; F15-W32 HydrophobicContact CE1-CZ3 4.1Å; F15-W32 AromaticContact CZ-CH2 3.76Å; F15-W32 HydrophobicContact CZ-CH2 3.76Å; F15-W32 HydrophobicContact CZ-CZ3 4.09Å; F15-L64 HydrophobicContact CB-CD1 3.83Å; F15-L64 HydrophobicContact CD1-CD1 3.88Å; F15-L64 HydrophobicContact CD1-CG 4.48Å; F15-L64 HydrophobicContact CG-CD1 4.32Å; F15-C65 WeakPolarHBondContact CA-O 3.18Å; F15-V66 HydrophobicContact CD1-CG2 3.88Å; F15-V66 HydrophobicContact CE1-CG1 4.4Å; F15-V66 HydrophobicContact CE1-CG2 3.6Å; F15-I92 HydrophobicContact CD1-CD1 4.44Å; F15-I92 HydrophobicContact CE1-CD1 3.75Å
16	N	70.2	Confident	61.7	Low	49 Å²	49	63.7 Å²	63.7	26%	0.262	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	11.4	-179.1	-73.6	-34.9	0	0	0	115.5	E18 L64 C65	N16-E18 PolarHBondContact O-N 2.89Å; N16-L64 WeakPolarHBondContact OD1-CA 2.9Å; N16-L64 WeakPolarHBondContact OD1-CD1 3.45Å; N16-L64 PolarHBondContact OD1-N 3.04Å; N16-C65 PolarHBondContact N-O 2.99Å
17	C	58	Low	61	Low	51 Å²	51	66.5 Å²	66.5	35%	0.345	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-4.3	-167.7	-47	0	0	0	0	115.3	T3 F15 C65	T3-C17 HydrophobicContact CG2-CB 3.79Å; T3-C17 VanDerWaalsContact CG2-SG 3.59Å; T3-C17 PolarHBondContact OG1-SG 2.84Å; F15-C17 PolarHBondContact O-N 3.06Å; C17-C65 PolarHBondContact SG-SG 2.99Å
18	E	54.8	Low	60	Low	146 Å²	146	67.1 Å²	67.1	68%	0.682	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-46.5	-177	-68.2	178.8	174.5	0	0	111.8	F15 N16	F15-E18 PolarHBondContact O-N 3.5Å; N16-E18 PolarHBondContact O-N 2.89Å
19	G	58.1	Low	59	Low	21 Å²	21	65.5 Å²	65.5	22%	0.216	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.6	179.1	0	0	0	0	0	112.3	K14 F15	K14-G19 CarbonylContact C-O 3.53Å; K14-G19 WeakPolarHBondContact CA-O 3.46Å; K14-G19 WeakPolarHBondContact CB-O 3.3Å; F15-G19 PolarHBondContact N-O 2.62Å; F15-G19 PolarHBondContact O-N 2.72Å
20	I	53.6	Low	58	Low	106 Å²	106	59 Å²	59	54%	0.544	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.5	173.3	-51.4	-176.7	0	0	0	108.4	I12 K14	I12-I20 HydrophobicContact CG2-CG2 4.01Å; K14-I20 HydrophobicContact CD-CD1 4.39Å; K14-I20 HydrophobicContact CD-CG1 3.89Å; K14-I20 HydrophobicContact CG-CB 4.42Å; K14-I20 HydrophobicContact CG-CG1 4.11Å; K14-I20 HydrophobicContact CG-CG2 4.33Å
21	F	57.5	Low	57	Low	51 Å²	51	57.9 Å²	57.9	22%	0.224	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.5	-177.1	-59.9	-95.6	0	0	0	110.1	L13 F15 P36	L13-F21 PolarHBondContact N-O 2.84Å; L13-F21 PolarHBondContact O-N 3.34Å; F15-F21 HydrophobicContact CB-CE2 4.17Å; F15-F21 AromaticContact CD2-CD2 3.5Å; F15-F21 HydrophobicContact CD2-CD2 3.5Å; F15-F21 VanDerWaalsContact CD2-CD2 3.5Å; F15-F21 AromaticContact CD2-CE2 3.66Å; F15-F21 HydrophobicContact CD2-CE2 3.66Å; F15-F21 HydrophobicContact CD2-CG 4.32Å; F15-F21 HydrophobicContact CE2-CD2 4.13Å; F15-F21 HydrophobicContact CG-CE2 4.38Å; F21-P36 HydrophobicContact CE1-CB 4.35Å; F21-P36 HydrophobicContact CZ-CB 4.07Å
22	P	56	Low	55.7	Low	75 Å²	75	59.1 Å²	59.1	49%	0.487	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.1	167.8	30.3	-32.5	0	0	0	109.4	S24 S25	P22-S24 PolarHBondContact O-N 3.18Å; P22-S24 VanDerWaalsContact O-N 3.09Å; P22-S25 WeakPolarHBondContact O-CB 3.47Å; P22-S25 PolarHBondContact O-N 3.1Å; P22-S25 PolarHBondContact O-OG 3.14Å
23	I	51.9	Low	54.3	Low	21 Å²	21	65.1 Å²	65.1	11%	0.108	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-52.9	-36.2	-179.3	-65.7	176.9	0	0	0	112.5	D11 S25 M26 T27 L70 P71 I74	D11-I23 HydrophobicContact CB-CD1 4.24Å; D11-I23 WeakPolarHBondContact OD1-CD1 3.1Å; I23-S25 PolarHBondContact O-N 3.13Å; I23-S25 VanDerWaalsContact O-N 3.08Å; I23-M26 PolarHBondContact O-N 2.79Å; I23-T27 HydrophobicContact CG2-CG2 4.31Å; I23-L70 HydrophobicContact CD1-CB 4.23Å; I23-L70 HydrophobicContact CD1-CD2 3.44Å; I23-L70 VanDerWaalsContact CD1-CD2 3.44Å; I23-L70 HydrophobicContact CD1-CG 4.41Å; I23-L70 HydrophobicContact CG1-CD2 3.72Å; I23-P71 VanDerWaalsContact CD1-CD 3.4Å; I23-P71 HydrophobicContact CD1-CG 4.36Å; I23-I74 HydrophobicContact CG2-CG2 4.28Å
24	S	53.5	Low	52.3	Low	97 Å²	97	72.5 Å²	72.5	68%	0.678	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-57.7	-22.7	179.4	53	0	0	0	0	114.1	P22 M26	P22-S24 PolarHBondContact O-N 3.18Å; P22-S24 VanDerWaalsContact O-N 3.09Å; S24-M26 VanDerWaalsContact C-N 3.26Å; S24-M26 PolarHBondContact O-N 2.81Å
25	S	51	Low	50.2	Low	54 Å²	54	76 Å²	76	38%	0.378	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-74.6	-12.6	175.5	64.6	0	0	0	0	113.8	P22 I23 A31	P22-S25 WeakPolarHBondContact O-CB 3.47Å; P22-S25 PolarHBondContact O-N 3.1Å; P22-S25 PolarHBondContact O-OG 3.14Å; I23-S25 PolarHBondContact O-N 3.13Å; I23-S25 VanDerWaalsContact O-N 3.08Å; S25-A31 WeakPolarHBondContact O-CB 3.11Å
26	M	49.5	Very low	48.2	Very low	31 Å²	31	79.3 Å²	79.3	15%	0.153	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-9.2	-168	-60	-159.5	73.7	0	0	115.3	L13 F15 I23 S24 W32	L13-M26 HydrophobicContact CD2-CE 4.4Å; L13-M26 HydrophobicContact CD2-SD 3.31Å; L13-M26 WeakPolarHBondContact CD2-SD 3.29Å; L13-M26 HydrophobicContact CG-SD 4.14Å; F15-M26 HydrophobicContact CE2-CE 3.64Å; F15-M26 HydrophobicContact CE2-SD 3.51Å; F15-M26 VanDerWaalsContact CE2-SD 3.51Å; F15-M26 HydrophobicContact CZ-CE 3.36Å; F15-M26 HydrophobicContact CZ-SD 3.73Å; I23-M26 PolarHBondContact O-N 2.79Å; S24-M26 VanDerWaalsContact C-N 3.26Å; S24-M26 PolarHBondContact O-N 2.81Å; M26-W32 HydrophobicContact CE-CD2 4.37Å; M26-W32 HydrophobicContact CE-CE3 4.27Å; M26-W32 HydrophobicContact CE-CH2 3.09Å; M26-W32 HydrophobicContact CE-CZ2 3.15Å; M26-W32 HydrophobicContact CE-CZ3 3.65Å
27	T	49.7	Very low	46.3	Very low	111 Å²	111	85.2 Å²	85.2	68%	0.681	51%	0.512	S	S	*	.	S	Bend	trans	-88.4	0.3	-177.9	52.9	0	0	0	0	113.8	I23	I23-T27 HydrophobicContact CG2-CG2 4.31Å
28	G	43	Very low	45.1	Very low	46 Å²	46	87.4 Å²	87.4	47%	0.474	52%	0.523	S	S	.	.	S	Bend	trans	-86.8	144.3	177.9	0	0	0	0	0	113.4	G30 A31	G28-G30 PolarHBondContact O-N 2.89Å; G28-A31 WeakPolarHBondContact O-CB 3.49Å; G28-A31 PolarHBondContact O-N 2.99Å
29	A	41.5	Very low	43.8	Very low	119 Å²	119	86.2 Å²	86.2	98%	0.983	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	115.2	167.2	0	0	0	0	0	108.9
30	G	42.2	Very low	42.3	Very low	39 Å²	39	91.8 Å²	91.8	40%	0.402	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	107.4	-4.9	-177.2	0	0	0	0	0	115.7	G28 W32 D33	G28-G30 PolarHBondContact O-N 2.89Å; G30-W32 PolarHBondContact O-N 3.17Å; G30-D33 PolarHBondContact O-N 2.92Å
31	A	39.8	Very low	41	Very low	37 Å²	37	91.1 Å²	91.1	31%	0.306	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.6	-9.1	179.5	0	0	0	0	0	115.2	S25 G28	S25-A31 WeakPolarHBondContact O-CB 3.11Å; G28-A31 WeakPolarHBondContact O-CB 3.49Å; G28-A31 PolarHBondContact O-N 2.99Å
32	W	39.4	Very low	39.5	Very low	107 Å²	107	95.7 Å²	95.7	41%	0.405	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112	-12.5	-176.8	-64	103.5	0	0	0	114.5	F15 M26 G30 I92	F15-W32 AromaticContact CE1-CH2 3.97Å; F15-W32 HydrophobicContact CE1-CH2 3.97Å; F15-W32 HydrophobicContact CE1-CZ3 4.1Å; F15-W32 AromaticContact CZ-CH2 3.76Å; F15-W32 HydrophobicContact CZ-CH2 3.76Å; F15-W32 HydrophobicContact CZ-CZ3 4.09Å; M26-W32 HydrophobicContact CE-CD2 4.37Å; M26-W32 HydrophobicContact CE-CE3 4.27Å; M26-W32 HydrophobicContact CE-CH2 3.09Å; M26-W32 HydrophobicContact CE-CZ2 3.15Å; M26-W32 HydrophobicContact CE-CZ3 3.65Å; G30-W32 PolarHBondContact O-N 3.17Å; W32-I92 HydrophobicContact CE3-CG2 3.84Å; W32-I92 HydrophobicContact CH2-CD1 3.73Å; W32-I92 HydrophobicContact CH2-CG1 4.22Å; W32-I92 HydrophobicContact CH2-CG2 4.48Å; W32-I92 HydrophobicContact CZ3-CB 4.43Å; W32-I92 HydrophobicContact CZ3-CD1 3.79Å; W32-I92 HydrophobicContact CZ3-CG1 4.08Å; W32-I92 HydrophobicContact CZ3-CG2 3.53Å
33	D	41.2	Very low	38.1	Very low	148 Å²	148	100.4 Å²	100.4	79%	0.791	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-22.6	-179.1	-70.1	-35.3	0	0	0	111.6	G30 S35	G30-D33 PolarHBondContact O-N 2.92Å; D33-S35 PolarHBondContact O-N 3.27Å
34	E	34.5	Very low	36.8	Very low	159 Å²	159	104.8 Å²	104.8	74%	0.743	63%	0.63	S	S	*	*	S	Bend	trans	-78.7	115.7	168.7	-66.6	-178.1	178.8	0	0	108.6	P36	E34-P36 WeakPolarHBondContact O-CD 3.45Å; E34-P36 VanDerWaalsContact O-N 3.08Å
35	S	32.5	Very low	35.5	Very low	110 Å²	110	109.8 Å²	109.8	77%	0.769	64%	0.639	S	S	*	*			trans	-52.2	120.4	165	-69.6	0	0	0	0	106.8	D33 E37	D33-S35 PolarHBondContact O-N 3.27Å; S35-E37 PolarHBondContact O-N 3.1Å
36	P	34.6	Very low	34.1	Very low	87 Å²	87	111.9 Å²	111.9	57%	0.565	65%	0.654	S	S	*	*			trans	-59.6	117.4	-169.9	18.8	-29.5	0	0	0	108.3	F21 E34 V38	F21-P36 HydrophobicContact CE1-CB 4.35Å; F21-P36 HydrophobicContact CZ-CB 4.07Å; E34-P36 WeakPolarHBondContact O-CD 3.45Å; E34-P36 VanDerWaalsContact O-N 3.08Å; P36-V38 VanDerWaalsContact C-N 3.33Å; P36-V38 PolarHBondContact O-N 3.45Å
37	E	29	Very low	32.9	Very low	174 Å²	174	116.7 Å²	116.7	81%	0.813	69%	0.685	S	S	*	*			trans	-55.9	105.1	167.6	-75.7	-171.7	158.6	0	0	106.3	S35 V39	S35-E37 PolarHBondContact O-N 3.1Å; E37-V39 VanDerWaalsContact C-N 3.27Å; E37-V39 PolarHBondContact O-N 2.82Å
38	V	33.8	Very low	31.7	Very low	96 Å²	96	116.1 Å²	116.1	58%	0.582	69%	0.686	S	S	*	*			trans	-63.3	99.4	172.3	177.3	0	0	0	0	105	P36 N40	P36-V38 VanDerWaalsContact C-N 3.33Å; P36-V38 PolarHBondContact O-N 3.45Å; V38-N40 PolarHBondContact O-N 3.2Å
39	V	28.4	Very low	30.9	Very low	121 Å²	121	122.2 Å²	122.2	73%	0.733	70%	0.702	S	S	*	*			trans	-63.7	93.5	164.8	-179.8	0	0	0	0	105.1	E37 S41	E37-V39 VanDerWaalsContact C-N 3.27Å; E37-V39 PolarHBondContact O-N 2.82Å; V39-S41 PolarHBondContact O-N 3.15Å
40	N	25.9	Very low	30.3	Very low	139 Å²	139	123 Å²	123	74%	0.743	69%	0.69	S	S	*	*			trans	-62.1	81	170.3	-102	-24.3	0	0	0	107.3	V38 N42	V38-N40 PolarHBondContact O-N 3.2Å; N40-N42 PolarHBondContact O-N 3.44Å
41	S	26.6	Very low	29.6	Very low	92 Å²	92	128.5 Å²	128.5	64%	0.643	71%	0.705	S	S	*	*			trans	-74.7	87.6	169.3	65.4	0	0	0	0	107.5	V39	V39-S41 PolarHBondContact O-N 3.15Å
42	N	25	Very low	29.1	Very low	146 Å²	146	133.3 Å²	133.3	78%	0.781	73%	0.725	S	S	*	*			trans	54.2	75.5	154.6	-59	-31.8	0	0	0	116.1	N40 V44	N40-N42 PolarHBondContact O-N 3.44Å; N42-V44 VanDerWaalsContact C-N 3.29Å
43	L	26.2	Very low	28.6	Very low	174 Å²	174	136.6 Å²	136.6	91%	0.911	75%	0.745	S	S	*	*			trans	-99.5	59	145.6	-135	137.3	0	0	0	108.9
44	V	24.5	Very low	28.2	Very low	114 Å²	114	134.7 Å²	134.7	69%	0.691	74%	0.739	S	S	*	*			trans	-113.7	81.5	161.7	-176	0	0	0	0	107	N42	N42-V44 VanDerWaalsContact C-N 3.29Å
45	K	27	Very low	28.2	Very low	202 Å²	202	131 Å²	131	88%	0.878	74%	0.736	S	S	*	*			trans	-127.1	81.8	139.1	-76.2	-168.1	178.9	-179.3	0	106.9
46	S	22.2	Very low	28.4	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	74%	0.738	S	S	*	*			trans	-46.4	126.8	154.2	50	0	0	0	0	110.5
47	T	23.7	Very low	28.3	Very low	132 Å²	132	137.2 Å²	137.2	81%	0.81	75%	0.749	S	S	*	*				-159.1	122	128.7	23.9	0	0	0	0	110.6
48	S	25	Very low	28.4	Very low	99 Å²	99	138 Å²	138	69%	0.692	75%	0.75	S	S	*	*			trans	69.5	106.5	148.1	58.3	0	0	0	0	120.9
49	E	26.7	Very low	28.4	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	75%	0.749	S	S	*	*				67.8	96.4	122.7	-65	170.4	-171.4	0	0	119.4
50	N	28.2	Very low	29	Very low	136 Å²	136	138 Å²	138	73%	0.727	75%	0.749	S	S	*	*				177	122.7	103.7	-94.5	-39.2	0	0	0	112.7
51	Q	28.5	Very low	30	Very low	154 Å²	154	135.2 Å²	135.2	72%	0.72	74%	0.741	S	S	*	*			trans	48.7	117.4	134	-58.9	-171.2	13.3	0	0	121
52	N	27.9	Very low	31.2	Very low	137 Å²	137	134.2 Å²	134.2	73%	0.733	73%	0.732	S	S	*	*			trans	86.9	124.6	134.8	-60.5	-12.6	0	0	0	119.8
53	E	29.4	Very low	33.4	Very low	176 Å²	176	138 Å²	138	82%	0.822	74%	0.736	S	S	*	*	S	Bend	trans	81.9	98.1	156.8	-68	175.3	166.2	0	0	118.7	A55	E53-A55 PolarHBondContact O-N 3.25Å
54	T	32.7	Very low	36.1	Very low	109 Å²	109	131.5 Å²	131.5	67%	0.669	70%	0.702	S	S	*	*			trans	47.6	43.1	139.3	50.8	0	0	0	0	117.9	L56 E57	T54-L56 PolarHBondContact O-N 3.38Å; T54-E57 PolarHBondContact O-N 3.24Å
55	A	35.5	Very low	39.1	Very low	82 Å²	82	127 Å²	127	68%	0.678	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-59.8	-16.4	172.8	0	0	0	0	0	114.2	E53	E53-A55 PolarHBondContact O-N 3.25Å
56	L	34.9	Very low	42	Very low	153 Å²	153	117.4 Å²	117.4	80%	0.801	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-75	-22.4	-179.5	-65.4	173.1	0	0	0	113.8	T54	T54-L56 PolarHBondContact O-N 3.38Å
57	E	33	Very low	45.2	Very low	174 Å²	174	113.5 Å²	113.5	81%	0.813	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-87.2	-6.5	-179.1	-73.5	-169.6	163.5	0	0	114.2	T54	T54-E57 PolarHBondContact O-N 3.24Å
58	K	30.9	Very low	48.2	Very low	191 Å²	191	107.2 Å²	107.2	83%	0.83	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-113.8	21.7	177	-85.5	-177	-177.4	171.3	0	114.4	S60	K58-S60 PolarHBondContact O-N 3.16Å
59	I	33.9	Very low	51.1	Low	110 Å²	110	102.9 Å²	102.9	56%	0.564	54%	0.535	S	S	*	.			trans	-74.9	77.2	159	-54.7	170.5	0	0	0	106.3	S61	I59-S61 PolarHBondContact O-N 3.23Å
60	S	40.9	Very low	53.8	Low	105 Å²	105	94.7 Å²	94.7	73%	0.734	50%	0.497	S	S	*	.			trans	-44.3	117.5	160.6	58.6	0	0	0	0	106.1	K58	K58-S60 PolarHBondContact O-N 3.16Å
61	S	47.1	Very low	56.5	Low	82 Å²	82	89.1 Å²	89.1	57%	0.573	47%	0.468	S	S	*	.			trans	-35.5	124	-164.8	-48.6	0	0	0	0	111.2	I59 R63	I59-S61 PolarHBondContact O-N 3.23Å; S61-R63 PolarHBondContact O-N 3.16Å
62	P	52	Low	59.2	Low	70 Å²	70	83.6 Å²	83.6	46%	0.455	44%	0.442	S	S	.	.			trans	-50.1	133.4	-171.4	18.5	-30.2	0	0	0	109.1	L64	P62-L64 PolarHBondContact O-N 3.25Å
63	R	71.7	Confident	61.9	Low	226 Å²	226	82.9 Å²	82.9	85%	0.853	44%	0.438	S	S	*	.			trans	-67.7	91.4	-179.3	-72.9	-172.3	-177.1	167.4	1.9	107.9	S61 C65	S61-R63 PolarHBondContact O-N 3.16Å; R63-C65 PolarHBondContact O-N 3.24Å
64	L	83.2	Confident	64.6	Low	37 Å²	37	77.1 Å²	77.1	19%	0.194	41%	0.413	C	S	.	.			trans	-56	123.3	176	-169.4	67	0	0	0	110.4	F15 N16 P62 I92 V98 P99	F15-L64 HydrophobicContact CB-CD1 3.83Å; F15-L64 HydrophobicContact CD1-CD1 3.88Å; F15-L64 HydrophobicContact CD1-CG 4.48Å; F15-L64 HydrophobicContact CG-CD1 4.32Å; N16-L64 WeakPolarHBondContact OD1-CA 2.9Å; N16-L64 WeakPolarHBondContact OD1-CD1 3.45Å; N16-L64 PolarHBondContact OD1-N 3.04Å; P62-L64 PolarHBondContact O-N 3.25Å; L64-I92 HydrophobicContact CD2-CB 3.76Å; L64-I92 HydrophobicContact CD2-CD1 4.18Å; L64-I92 HydrophobicContact CD2-CG2 3.95Å; L64-V98 HydrophobicContact CB-CG1 4.26Å; L64-V98 HydrophobicContact CB-CG2 4.09Å; L64-V98 HydrophobicContact CD2-CG1 4.07Å; L64-V98 HydrophobicContact CD2-CG2 3.99Å; L64-V98 HydrophobicContact CG-CG1 3.89Å; L64-V98 HydrophobicContact CG-CG2 4.3Å; L64-V98 WeakPolarHBondContact O-CA 3.1Å; L64-V98 WeakPolarHBondContact O-CG1 3.43Å; L64-P99 WeakPolarHBondContact O-CD 3.48Å
65	C	86	Confident	67.2	Low	21 Å²	21	72 Å²	72	14%	0.142	38%	0.381	C	S	.	.			trans	-129.9	144.8	167.7	65.7	0	0	0	0	109.2	F15 N16 C17 R63 P99	F15-C65 WeakPolarHBondContact CA-O 3.18Å; N16-C65 PolarHBondContact N-O 2.99Å; C17-C65 PolarHBondContact SG-SG 2.99Å; R63-C65 PolarHBondContact O-N 3.24Å; C65-P99 WeakPolarHBondContact CA-O 3.19Å; C65-P99 HydrophobicContact CB-CG 3.79Å
66	V	89.6	Confident	69.7	Low	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.2	176.7	-177.5	0	0	0	0	108.3	L13 K14 F15 W82 I92 W93 V98 P99 L100 T101	L13-V66 HydrophobicContact CD1-CG1 3.42Å; L13-V66 VanDerWaalsContact CD1-CG1 3.42Å; L13-V66 HydrophobicContact CG-CG1 4.47Å; K14-V66 WeakPolarHBondContact O-CA 3.38Å; F15-V66 HydrophobicContact CD1-CG2 3.88Å; F15-V66 HydrophobicContact CE1-CG1 4.4Å; F15-V66 HydrophobicContact CE1-CG2 3.6Å; V66-W82 HydrophobicContact CG1-CH2 3.82Å; V66-W82 HydrophobicContact CG1-CZ3 4.18Å; V66-I92 HydrophobicContact CG2-CD1 4Å; V66-W93 HydrophobicContact CB-CH2 4.48Å; V66-W93 HydrophobicContact CG2-CH2 3.77Å; V66-W93 HydrophobicContact CG2-CZ3 4.39Å; V66-V98 HydrophobicContact CG2-CG1 3.82Å; V66-P99 PolarHBondContact N-O 3.32Å; V66-L100 HydrophobicContact CB-CG 4.29Å; V66-L100 CarbonylContact O-C 3.6Å; V66-L100 VanDerWaalsContact O-CA 3.28Å; V66-L100 WeakPolarHBondContact O-CA 3.32Å; V66-T101 PolarHBondContact O-N 3.41Å
67	I	89.2	Confident	72.3	Confident	16 Å²	16	66.9 Å²	66.9	8%	0.082	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	122.5	178.1	-60.3	173.5	0	0	0	107.9	T3 M5 K14 T101	T3-I67 HydrophobicContact CG2-CD1 3.54Å; M5-I67 HydrophobicContact CE-CG2 3.94Å; M5-I67 HydrophobicContact CG-CG2 3.28Å; M5-I67 HydrophobicContact SD-CG2 3.99Å; K14-I67 PolarHBondContact N-O 3.26Å; K14-I67 PolarHBondContact O-N 3.11Å; I67-T101 VanDerWaalsContact CA-O 3.32Å; I67-T101 WeakPolarHBondContact CA-O 3.43Å
68	G	86.7	Confident	75.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	129.6	-170.6	0	0	0	0	0	114.1	M5 I12 T101 L102 T103	M5-G68 WeakPolarHBondContact CE-O 3.48Å; I12-G68 CarbonylContact O-C 3.53Å; I12-G68 VanDerWaalsContact O-CA 3.23Å; I12-G68 WeakPolarHBondContact O-CA 3.44Å; G68-T101 PolarHBondContact N-O 3Å; G68-L102 WeakPolarHBondContact O-CA 3.41Å; G68-T103 PolarHBondContact O-N 3.49Å; G68-T103 VanDerWaalsContact O-N 3.1Å
69	N	86	Confident	78.2	Confident	7 Å²	7	51.6 Å²	51.6	4%	0.037	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	76.9	165.1	-172.4	31	0	0	0	109.4	I7 R9 D11 I12 T103 F145	I7-N69 PolarHBondContact O-ND2 3.29Å; R9-N69 PolarHBondContact O-ND2 3.16Å; D11-N69 PolarHBondContact N-O 3.1Å; I12-N69 PolarHBondContact N-O 3.11Å; I12-N69 PolarHBondContact O-N 3.05Å; N69-T103 VanDerWaalsContact CA-OG1 3.29Å; N69-T103 WeakPolarHBondContact CA-OG1 3.18Å; N69-T103 PolarHBondContact OD1-OG1 3.15Å; N69-F145 WeakPolarHBondContact OD1-CE1 3.5Å
70	L	83.2	Confident	81	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.016	27%	0.269	C	S	.	.			trans	-94.1	147.9	-167.8	-51.9	175.3	0	0	0	110.9	L13 I23 L78 L102	L13-L70 HydrophobicContact CB-CD2 4.1Å; L13-L70 HydrophobicContact CD1-CD2 4.37Å; I23-L70 HydrophobicContact CD1-CB 4.23Å; I23-L70 HydrophobicContact CD1-CD2 3.44Å; I23-L70 VanDerWaalsContact CD1-CD2 3.44Å; I23-L70 HydrophobicContact CD1-CG 4.41Å; I23-L70 HydrophobicContact CG1-CD2 3.72Å; L70-L78 HydrophobicContact CD1-CD2 3.51Å; L70-L102 HydrophobicContact CD1-CD2 4.34Å
71	P	84.1	Confident	83.6	Confident	18 Å²	18	47.6 Å²	47.6	12%	0.117	25%	0.254	C	S	.	.			trans	-57.3	144.7	169.7	-24.2	33.8	0	0	0	111.8	D11 I23 N73 I74 S75	D11-P71 WeakPolarHBondContact OD1-CD 3.48Å; D11-P71 WeakPolarHBondContact OD1-CG 3.36Å; I23-P71 VanDerWaalsContact CD1-CD 3.4Å; I23-P71 HydrophobicContact CD1-CG 4.36Å; P71-N73 VanDerWaalsContact C-N 3.3Å; P71-N73 WeakPolarHBondContact CB-OD1 3.39Å; P71-N73 PolarHBondContact O-N 3.39Å; P71-I74 HydrophobicContact CB-CG1 4.28Å; P71-I74 HydrophobicContact CG-CG1 4.48Å; P71-I74 PolarHBondContact O-N 3.23Å; P71-S75 PolarHBondContact O-N 2.98Å
72	F	84.7	Confident	85.9	Confident	39 Å²	39	44 Å²	44	17%	0.171	23%	0.228	C	C	.	.	H	α-helix	trans	-65.9	-30.4	-172.9	-53.3	-44.1	0	0	0	114.3	I74 S75 Q105 P149 V153	F72-I74 PolarHBondContact O-N 3.39Å; F72-S75 WeakPolarHBondContact CA-OG 3.25Å; F72-S75 PolarHBondContact O-OG 3.31Å; F72-Q105 HydrophobicContact CB-CG 3.88Å; F72-Q105 HydrophobicContact CD1-CG 3.7Å; F72-Q105 HydrophobicContact CD2-CG 3.35Å; F72-Q105 HydrophobicContact CE1-CG 4.03Å; F72-Q105 HydrophobicContact CE2-CG 3.69Å; F72-Q105 HydrophobicContact CG-CG 3.36Å; F72-Q105 HydrophobicContact CZ-CG 4.02Å; F72-P149 HydrophobicContact CE2-CB 3.86Å; F72-P149 HydrophobicContact CE2-CG 4.33Å; F72-V153 HydrophobicContact CE1-CG2 4.3Å; F72-V153 HydrophobicContact CZ-CG2 3.66Å
73	N	84.7	Confident	88	Confident	122 Å²	122	40.8 Å²	40.8	65%	0.652	21%	0.207	S	C	*	.	H	α-helix	trans	-67.6	-22.6	173.6	62.7	-41.2	0	0	0	112.7	P71 P77	P71-N73 VanDerWaalsContact C-N 3.3Å; P71-N73 WeakPolarHBondContact CB-OD1 3.39Å; P71-N73 PolarHBondContact O-N 3.39Å; N73-P77 WeakPolarHBondContact O-CD 3.26Å; N73-P77 VanDerWaalsContact O-CG 3.31Å; N73-P77 WeakPolarHBondContact O-CG 3.19Å
74	I	86.5	Confident	89.2	Confident	55 Å²	55	31.8 Å²	31.8	28%	0.282	17%	0.174	S	C	.	.	H	α-helix	trans	-97.1	-40	177.8	-56.6	-56.3	0	0	0	111.3	I23 P71 F72 T76 P77 L78	I23-I74 HydrophobicContact CG2-CG2 4.28Å; P71-I74 HydrophobicContact CB-CG1 4.28Å; P71-I74 HydrophobicContact CG-CG1 4.48Å; P71-I74 PolarHBondContact O-N 3.23Å; F72-I74 PolarHBondContact O-N 3.39Å; I74-T76 VanDerWaalsContact C-N 3.34Å; I74-T76 PolarHBondContact O-N 3.16Å; I74-P77 VanDerWaalsContact O-CD 3.24Å; I74-P77 WeakPolarHBondContact O-CD 3.27Å; I74-P77 VanDerWaalsContact O-CG 3.3Å; I74-P77 WeakPolarHBondContact O-CG 3.35Å; I74-L78 WeakPolarHBondContact O-CB 3.41Å; I74-L78 PolarHBondContact O-N 2.76Å
75	S	87.2	Confident	89.8	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	17%	0.172	C	C	.	.	H	α-helix	trans	-62.5	-38.3	-171.4	67.8	0	0	0	0	113.3	P71 F72 I79	P71-S75 PolarHBondContact O-N 2.98Å; F72-S75 WeakPolarHBondContact CA-OG 3.25Å; F72-S75 PolarHBondContact O-OG 3.31Å; S75-I79 WeakPolarHBondContact O-CB 3.31Å; S75-I79 WeakPolarHBondContact O-CG2 3.09Å; S75-I79 PolarHBondContact O-N 3.31Å
76	T	87.6	Confident	90.2	Very high	52 Å²	52	30.5 Å²	30.5	32%	0.319	17%	0.166	S	C	.	.	H	α-helix	trans	-69.5	-50	-179.2	-53	0	0	0	0	114	I74 L78 I79 S80	I74-T76 VanDerWaalsContact C-N 3.34Å; I74-T76 PolarHBondContact O-N 3.16Å; T76-L78 VanDerWaalsContact C-N 3.32Å; T76-I79 WeakPolarHBondContact O-CG2 3.21Å; T76-S80 PolarHBondContact O-N 3.07Å; T76-S80 PolarHBondContact O-OG 3.38Å
77	P	91.2	Very high	90.5	Very high	75 Å²	75	31.6 Å²	31.6	49%	0.487	18%	0.175	S	C	.	.	H	α-helix	trans	-64.9	-37.1	173	22.5	-31.4	0	0	0	112	N73 I74 S80 Q81	N73-P77 WeakPolarHBondContact O-CD 3.26Å; N73-P77 VanDerWaalsContact O-CG 3.31Å; N73-P77 WeakPolarHBondContact O-CG 3.19Å; I74-P77 VanDerWaalsContact O-CD 3.24Å; I74-P77 WeakPolarHBondContact O-CD 3.27Å; I74-P77 VanDerWaalsContact O-CG 3.3Å; I74-P77 WeakPolarHBondContact O-CG 3.35Å; P77-S80 WeakPolarHBondContact O-CB 3.35Å; P77-S80 PolarHBondContact O-N 3.06Å; P77-Q81 PolarHBondContact O-N 2.92Å
78	L	92.1	Very high	90.8	Very high	43 Å²	43	34.4 Å²	34.4	23%	0.225	19%	0.188	C	C	.	.	H	α-helix	trans	-64.5	-42.9	179.4	-172.3	65.1	0	0	0	112.4	L70 I74 T76 S80 Q81 W82	L70-L78 HydrophobicContact CD1-CD2 3.51Å; I74-L78 WeakPolarHBondContact O-CB 3.41Å; I74-L78 PolarHBondContact O-N 2.76Å; T76-L78 VanDerWaalsContact C-N 3.32Å; L78-S80 VanDerWaalsContact C-N 3.27Å; L78-S80 PolarHBondContact O-N 3.38Å; L78-Q81 PolarHBondContact O-N 3.33Å; L78-W82 HydrophobicContact CD1-CD2 4.29Å; L78-W82 HydrophobicContact CD1-CZ2 3.98Å; L78-W82 HydrophobicContact CD2-CD2 4.45Å; L78-W82 HydrophobicContact CD2-CE3 4.38Å; L78-W82 HydrophobicContact CD2-CH2 3.47Å; L78-W82 VanDerWaalsContact CD2-CH2 3.47Å; L78-W82 HydrophobicContact CD2-CZ2 3.53Å; L78-W82 HydrophobicContact CD2-CZ3 3.9Å; L78-W82 HydrophobicContact CG-CD2 3.91Å; L78-W82 HydrophobicContact CG-CE3 4.12Å; L78-W82 HydrophobicContact CG-CH2 4.01Å; L78-W82 HydrophobicContact CG-CZ2 3.79Å; L78-W82 HydrophobicContact CG-CZ3 4.16Å; L78-W82 WeakPolarHBondContact O-CB 3.36Å; L78-W82 PolarHBondContact O-N 2.86Å
79	I	94.5	Very high	91.1	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-64.7	-35.2	176.8	-168.3	58.7	0	0	0	111.5	S75 T76 W82 L83 L100 L102 F104 L112 L124 L158	S75-I79 WeakPolarHBondContact O-CB 3.31Å; S75-I79 WeakPolarHBondContact O-CG2 3.09Å; S75-I79 PolarHBondContact O-N 3.31Å; T76-I79 WeakPolarHBondContact O-CG2 3.21Å; I79-W82 PolarHBondContact O-N 3.09Å; I79-L83 HydrophobicContact CG1-CD1 4.36Å; I79-L83 HydrophobicContact CG1-CG 4.41Å; I79-L83 WeakPolarHBondContact O-CB 3.16Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 3.33Å; I79-L100 HydrophobicContact CD1-CD2 4.46Å; I79-L102 HydrophobicContact CD1-CD1 4.24Å; I79-F104 HydrophobicContact CB-CE1 4.21Å; I79-F104 HydrophobicContact CB-CZ 4.18Å; I79-F104 HydrophobicContact CG1-CZ 4.24Å; I79-F104 HydrophobicContact CG2-CE1 4.08Å; I79-F104 HydrophobicContact CG2-CZ 4.43Å; I79-L112 HydrophobicContact CG1-CD2 4.4Å; I79-L124 HydrophobicContact CG2-CD1 4.28Å; I79-L158 HydrophobicContact CD1-CD1 4.31Å; I79-L158 HydrophobicContact CD1-CD2 4.01Å
80	S	93.6	Very high	91.3	Very high	41 Å²	41	42.2 Å²	42.2	29%	0.287	22%	0.217	S	C	.	.	H	α-helix	trans	-64.2	-44.6	175.8	-56.2	0	0	0	0	111.1	T76 P77 L78 L83 H84	T76-S80 PolarHBondContact O-N 3.07Å; T76-S80 PolarHBondContact O-OG 3.38Å; P77-S80 WeakPolarHBondContact O-CB 3.35Å; P77-S80 PolarHBondContact O-N 3.06Å; L78-S80 VanDerWaalsContact C-N 3.27Å; L78-S80 PolarHBondContact O-N 3.38Å; S80-L83 PolarHBondContact O-N 3.25Å; S80-H84 PolarHBondContact O-N 3.18Å; S80-H84 VanDerWaalsContact O-N 3.16Å
81	Q	94.7	Very high	91.6	Very high	90 Å²	90	45 Å²	45	42%	0.421	25%	0.246	S	C	.	.	H	α-helix	trans	-62.8	-45.6	175.1	-178.6	56.8	44.8	0	0	111.9	P77 L78 L83 H84 D85	P77-Q81 PolarHBondContact O-N 2.92Å; L78-Q81 PolarHBondContact O-N 3.33Å; Q81-L83 VanDerWaalsContact C-N 3.33Å; Q81-L83 PolarHBondContact O-N 2.86Å; Q81-H84 VanDerWaalsContact O-CB 3.31Å; Q81-H84 WeakPolarHBondContact O-CB 3.44Å; Q81-H84 PolarHBondContact O-N 2.95Å; Q81-H84 VanDerWaalsContact O-N 3.13Å; Q81-D85 PolarHBondContact NE2-OD1 3.24Å; Q81-D85 PolarHBondContact NE2-OD2 3.46Å; Q81-D85 PolarHBondContact O-N 2.86Å
82	W	95.5	Very high	91.7	Very high	6 Å²	6	45.9 Å²	45.9	2%	0.023	25%	0.25	C	C	.	.	H	α-helix	trans	-65.3	-35.2	177.6	-74	-14.2	0	0	0	112.8	L13 V66 L78 I79 H84 D85 I86 W93 L100 L102	L13-W82 HydrophobicContact CD1-CH2 4.1Å; L13-W82 HydrophobicContact CD2-CH2 4.01Å; L13-W82 HydrophobicContact CD2-CZ2 4.12Å; V66-W82 HydrophobicContact CG1-CH2 3.82Å; V66-W82 HydrophobicContact CG1-CZ3 4.18Å; L78-W82 HydrophobicContact CD1-CD2 4.29Å; L78-W82 HydrophobicContact CD1-CZ2 3.98Å; L78-W82 HydrophobicContact CD2-CD2 4.45Å; L78-W82 HydrophobicContact CD2-CE3 4.38Å; L78-W82 HydrophobicContact CD2-CH2 3.47Å; L78-W82 VanDerWaalsContact CD2-CH2 3.47Å; L78-W82 HydrophobicContact CD2-CZ2 3.53Å; L78-W82 HydrophobicContact CD2-CZ3 3.9Å; L78-W82 HydrophobicContact CG-CD2 3.91Å; L78-W82 HydrophobicContact CG-CE3 4.12Å; L78-W82 HydrophobicContact CG-CH2 4.01Å; L78-W82 HydrophobicContact CG-CZ2 3.79Å; L78-W82 HydrophobicContact CG-CZ3 4.16Å; L78-W82 WeakPolarHBondContact O-CB 3.36Å; L78-W82 PolarHBondContact O-N 2.86Å; I79-W82 PolarHBondContact O-N 3.09Å; W82-H84 VanDerWaalsContact C-N 3.28Å; W82-H84 PolarHBondContact O-N 3.39Å; W82-D85 PolarHBondContact O-N 3.22Å; W82-I86 VanDerWaalsContact O-CB 3.26Å; W82-I86 WeakPolarHBondContact O-CB 3.42Å; W82-I86 WeakPolarHBondContact O-CD1 3.36Å; W82-I86 WeakPolarHBondContact O-CG1 3.12Å; W82-I86 PolarHBondContact O-N 3.21Å; W82-W93 HydrophobicContact CB-CZ2 4.18Å; W82-W93 AromaticContact CD1-CZ2 3.94Å; W82-W93 AromaticContact CD1-NE1 3.82Å; W82-W93 HydrophobicContact CD2-CH2 4.49Å; W82-W93 AromaticContact CD2-CZ2 3.78Å; W82-W93 HydrophobicContact CD2-CZ2 3.78Å; W82-W93 AromaticContact CE2-CZ2 4Å; W82-W93 HydrophobicContact CE3-CZ2 4.35Å; W82-W93 AromaticContact CG-CZ2 3.72Å; W82-W93 HydrophobicContact CG-CZ2 3.72Å; W82-L100 HydrophobicContact CD2-CD2 4.16Å; W82-L100 HydrophobicContact CE3-CD2 3.3Å; W82-L100 HydrophobicContact CZ3-CD2 3.67Å; W82-L102 HydrophobicContact CE3-CD1 4.2Å; W82-L102 HydrophobicContact CZ3-CD1 3.73Å; W82-L102 HydrophobicContact CZ3-CD2 4.08Å
83	L	96.7	Very high	92	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-38.3	172.8	-73	171.9	0	0	0	111.5	I79 S80 Q81 A87 L124 M127	I79-L83 HydrophobicContact CG1-CD1 4.36Å; I79-L83 HydrophobicContact CG1-CG 4.41Å; I79-L83 WeakPolarHBondContact O-CB 3.16Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 3.33Å; S80-L83 PolarHBondContact O-N 3.25Å; Q81-L83 VanDerWaalsContact C-N 3.33Å; Q81-L83 PolarHBondContact O-N 2.86Å; L83-A87 VanDerWaalsContact O-CB 3.27Å; L83-A87 WeakPolarHBondContact O-CB 3.29Å; L83-A87 PolarHBondContact O-N 3.09Å; L83-L124 HydrophobicContact CD1-CD1 4.41Å; L83-M127 HydrophobicContact CD1-CB 4.28Å
84	H	96.3	Very high	92	Very high	38 Å²	38	46.5 Å²	46.5	18%	0.176	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-49.9	172.2	-173.4	-170.7	0	0	0	111.4	S80 Q81 W82 I86 A87 E88 Y170	S80-H84 PolarHBondContact O-N 3.18Å; S80-H84 VanDerWaalsContact O-N 3.16Å; Q81-H84 VanDerWaalsContact O-CB 3.31Å; Q81-H84 WeakPolarHBondContact O-CB 3.44Å; Q81-H84 PolarHBondContact O-N 2.95Å; Q81-H84 VanDerWaalsContact O-N 3.13Å; W82-H84 VanDerWaalsContact C-N 3.28Å; W82-H84 PolarHBondContact O-N 3.39Å; H84-I86 VanDerWaalsContact C-N 3.33Å; H84-I86 PolarHBondContact O-N 3.09Å; H84-A87 WeakPolarHBondContact O-CB 3.35Å; H84-A87 PolarHBondContact O-N 2.99Å; H84-E88 IonicContact CD2-OE1 3.85Å; H84-E88 PolarHBondContact CD2-OE1 2.82Å; H84-E88 IonicContact CE1-OE1 3.02Å; H84-E88 IonicContact NE2-OE1 2.69Å; H84-E88 PolarHBondContact NE2-OE1 3.07Å; H84-E88 PolarHBondContact O-N 2.87Å; H84-Y170 HydrophobicContact CB-CD1 4.15Å; H84-Y170 HydrophobicContact CB-CD2 4.31Å; H84-Y170 HydrophobicContact CB-CE1 3.84Å; H84-Y170 HydrophobicContact CB-CE2 3.98Å; H84-Y170 HydrophobicContact CB-CG 4.4Å; H84-Y170 AromaticContact CD2-CD1 3.34Å; H84-Y170 WeakPolarHBondContact CD2-CD1 3.48Å; H84-Y170 AromaticContact CD2-CE1 3.9Å; H84-Y170 AromaticContact CD2-CG 3.5Å; H84-Y170 AromaticContact CG-CD1 3.69Å; H84-Y170 AromaticContact CG-CE1 3.75Å; H84-Y170 AromaticContact NE2-CD1 3.76Å
85	D	95.5	Very high	91.9	Very high	29 Å²	29	51.6 Å²	51.6	16%	0.155	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-33.3	-179.7	-63.7	-34.8	0	0	0	112.8	Q81 W82 E88 R89 R90	Q81-D85 PolarHBondContact NE2-OD1 3.24Å; Q81-D85 PolarHBondContact NE2-OD2 3.46Å; Q81-D85 PolarHBondContact O-N 2.86Å; W82-D85 PolarHBondContact O-N 3.22Å; D85-E88 CarbonylContact O-C 3.45Å; D85-R89 WeakPolarHBondContact O-CA 3.43Å; D85-R89 PolarHBondContact O-N 3.44Å; D85-R90 HydrophobicContact CB-CB 4.12Å; D85-R90 PolarHBondContact O-N 3.47Å; D85-R90 WeakPolarHBondContact OD1-CD 3.48Å; D85-R90 IonicContact OD1-NH1 3.5Å; D85-R90 PolarHBondContact OD1-NH1 3.46Å
86	I	95.4	Very high	91.6	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-46.5	173	-71.9	161.9	0	0	0	110.5	W82 H84 E88 R89 W93 L100 P160	W82-I86 VanDerWaalsContact O-CB 3.26Å; W82-I86 WeakPolarHBondContact O-CB 3.42Å; W82-I86 WeakPolarHBondContact O-CD1 3.36Å; W82-I86 WeakPolarHBondContact O-CG1 3.12Å; W82-I86 PolarHBondContact O-N 3.21Å; H84-I86 VanDerWaalsContact C-N 3.33Å; H84-I86 PolarHBondContact O-N 3.09Å; I86-E88 VanDerWaalsContact C-N 3.26Å; I86-E88 PolarHBondContact O-N 2.89Å; I86-R89 PolarHBondContact O-N 2.98Å; I86-W93 HydrophobicContact CB-CB 4.44Å; I86-W93 HydrophobicContact CD1-CD2 4.15Å; I86-W93 HydrophobicContact CD1-CE3 4.02Å; I86-W93 HydrophobicContact CD1-CZ3 4.35Å; I86-W93 HydrophobicContact CG1-CB 3.87Å; I86-W93 HydrophobicContact CG1-CD2 3.51Å; I86-W93 HydrophobicContact CG1-CE3 3.68Å; I86-W93 HydrophobicContact CG1-CG 3.59Å; I86-W93 HydrophobicContact CG1-CZ3 4.48Å; I86-L100 HydrophobicContact CD1-CD1 4.18Å; I86-P160 HydrophobicContact CD1-CG 4.11Å; I86-P160 HydrophobicContact CG1-CG 4.31Å; I86-P160 HydrophobicContact CG2-CB 3.92Å; I86-P160 HydrophobicContact CG2-CG 4.29Å
87	A	95.7	Very high	91.5	Very high	23 Å²	23	55 Å²	55	19%	0.19	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-40	178.5	0	0	0	0	0	111.4	L83 H84 Y131 Y170	L83-A87 VanDerWaalsContact O-CB 3.27Å; L83-A87 WeakPolarHBondContact O-CB 3.29Å; L83-A87 PolarHBondContact O-N 3.09Å; H84-A87 WeakPolarHBondContact O-CB 3.35Å; H84-A87 PolarHBondContact O-N 2.99Å; A87-Y131 HydrophobicContact CB-CD1 3.59Å; A87-Y131 HydrophobicContact CB-CD2 4.23Å; A87-Y131 HydrophobicContact CB-CE1 3.36Å; A87-Y131 HydrophobicContact CB-CE2 4.05Å; A87-Y131 HydrophobicContact CB-CG 4.04Å; A87-Y170 HydrophobicContact CB-CD2 3.66Å; A87-Y170 HydrophobicContact CB-CG 4.28Å
88	E	94.4	Very high	91.4	Very high	75 Å²	75	51.7 Å²	51.7	35%	0.35	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	7	-178.9	-65.6	-161.2	-160.3	0	0	114.8	H84 D85 I86 R90	H84-E88 IonicContact CD2-OE1 3.85Å; H84-E88 PolarHBondContact CD2-OE1 2.82Å; H84-E88 IonicContact CE1-OE1 3.02Å; H84-E88 IonicContact NE2-OE1 2.69Å; H84-E88 PolarHBondContact NE2-OE1 3.07Å; H84-E88 PolarHBondContact O-N 2.87Å; D85-E88 CarbonylContact O-C 3.45Å; I86-E88 VanDerWaalsContact C-N 3.26Å; I86-E88 PolarHBondContact O-N 2.89Å; E88-R90 VanDerWaalsContact C-N 3.29Å; E88-R90 HydrophobicContact CB-CG 3.95Å; E88-R90 PolarHBondContact O-N 3.28Å; E88-R90 IonicContact OE1-NH2 3.21Å; E88-R90 PolarHBondContact OE1-NH2 3.43Å; E88-R90 IonicContact OE2-CZ 3.44Å; E88-R90 IonicContact OE2-NE 2.64Å; E88-R90 PolarHBondContact OE2-NE 3.27Å; E88-R90 IonicContact OE2-NH2 3.42Å; E88-R90 PolarHBondContact OE2-NH2 3.04Å
89	R	92.7	Very high	91.4	Very high	71 Å²	71	50.9 Å²	50.9	27%	0.268	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	41.3	178.1	-56.2	-62.9	-166.8	-156.5	3.2	113.1	D85 I86 R94 L161 K162	D85-R89 WeakPolarHBondContact O-CA 3.43Å; D85-R89 PolarHBondContact O-N 3.44Å; I86-R89 PolarHBondContact O-N 2.98Å; R89-R94 VanDerWaalsContact O-CA 3.26Å; R89-R94 WeakPolarHBondContact O-CA 3.48Å; R89-L161 PolarHBondContact NH1-O 2.64Å; R89-L161 PolarHBondContact NH2-O 3.38Å; R89-K162 VanDerWaalsContact NH2-C 3.32Å; R89-K162 PolarHBondContact NH2-O 3.49Å
90	R	91.8	Very high	91.3	Very high	99 Å²	99	50.9 Å²	50.9	37%	0.374	24%	0.242	S	C	.	.			trans	-92.1	153	-179.9	-61.5	174.3	-174.3	169.3	-8.6	112.2	D85 E88 I92 W93	D85-R90 HydrophobicContact CB-CB 4.12Å; D85-R90 PolarHBondContact O-N 3.47Å; D85-R90 WeakPolarHBondContact OD1-CD 3.48Å; D85-R90 IonicContact OD1-NH1 3.5Å; D85-R90 PolarHBondContact OD1-NH1 3.46Å; E88-R90 VanDerWaalsContact C-N 3.29Å; E88-R90 HydrophobicContact CB-CG 3.95Å; E88-R90 PolarHBondContact O-N 3.28Å; E88-R90 IonicContact OE1-NH2 3.21Å; E88-R90 PolarHBondContact OE1-NH2 3.43Å; E88-R90 IonicContact OE2-CZ 3.44Å; E88-R90 IonicContact OE2-NE 2.64Å; E88-R90 PolarHBondContact OE2-NE 3.27Å; E88-R90 IonicContact OE2-NH2 3.42Å; E88-R90 PolarHBondContact OE2-NH2 3.04Å; R90-I92 PolarHBondContact O-N 3.25Å; R90-W93 WeakPolarHBondContact O-CB 3.29Å; R90-W93 VanDerWaalsContact O-CD1 3.29Å; R90-W93 PolarHBondContact O-N 3.09Å
91	G	88.4	Confident	91.3	Very high	61 Å²	61	50.4 Å²	50.4	63%	0.629	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	53.4	-134.6	175.1	0	0	0	0	0	113.6	W93 R94	G91-W93 PolarHBondContact O-N 2.88Å; G91-W93 VanDerWaalsContact O-N 3.1Å; G91-R94 WeakPolarHBondContact O-CB 3.4Å; G91-R94 PolarHBondContact O-N 3.27Å
92	I	87.3	Confident	91.2	Very high	38 Å²	38	46.2 Å²	46.2	20%	0.195	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-63	-16.9	179.3	64	168.6	0	0	0	113.6	F15 W32 L64 V66 R90 R94 V98	F15-I92 HydrophobicContact CD1-CD1 4.44Å; F15-I92 HydrophobicContact CE1-CD1 3.75Å; W32-I92 HydrophobicContact CE3-CG2 3.84Å; W32-I92 HydrophobicContact CH2-CD1 3.73Å; W32-I92 HydrophobicContact CH2-CG1 4.22Å; W32-I92 HydrophobicContact CH2-CG2 4.48Å; W32-I92 HydrophobicContact CZ3-CB 4.43Å; W32-I92 HydrophobicContact CZ3-CD1 3.79Å; W32-I92 HydrophobicContact CZ3-CG1 4.08Å; W32-I92 HydrophobicContact CZ3-CG2 3.53Å; L64-I92 HydrophobicContact CD2-CB 3.76Å; L64-I92 HydrophobicContact CD2-CD1 4.18Å; L64-I92 HydrophobicContact CD2-CG2 3.95Å; V66-I92 HydrophobicContact CG2-CD1 4Å; R90-I92 PolarHBondContact O-N 3.25Å; I92-R94 VanDerWaalsContact C-N 3.32Å; I92-V98 HydrophobicContact CD1-CG1 4.46Å; I92-V98 VanDerWaalsContact O-CG2 3.27Å; I92-V98 WeakPolarHBondContact O-CG2 3.46Å
93	W	89.9	Confident	91.1	Very high	4 Å²	4	46 Å²	46	2%	0.015	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-86	-2	-178.5	-42.6	106.6	0	0	0	113.5	V66 W82 I86 R90 G91 Y95 G96 V98 L100 P160	V66-W93 HydrophobicContact CB-CH2 4.48Å; V66-W93 HydrophobicContact CG2-CH2 3.77Å; V66-W93 HydrophobicContact CG2-CZ3 4.39Å; W82-W93 HydrophobicContact CB-CZ2 4.18Å; W82-W93 AromaticContact CD1-CZ2 3.94Å; W82-W93 AromaticContact CD1-NE1 3.82Å; W82-W93 HydrophobicContact CD2-CH2 4.49Å; W82-W93 AromaticContact CD2-CZ2 3.78Å; W82-W93 HydrophobicContact CD2-CZ2 3.78Å; W82-W93 AromaticContact CE2-CZ2 4Å; W82-W93 HydrophobicContact CE3-CZ2 4.35Å; W82-W93 AromaticContact CG-CZ2 3.72Å; W82-W93 HydrophobicContact CG-CZ2 3.72Å; I86-W93 HydrophobicContact CB-CB 4.44Å; I86-W93 HydrophobicContact CD1-CD2 4.15Å; I86-W93 HydrophobicContact CD1-CE3 4.02Å; I86-W93 HydrophobicContact CD1-CZ3 4.35Å; I86-W93 HydrophobicContact CG1-CB 3.87Å; I86-W93 HydrophobicContact CG1-CD2 3.51Å; I86-W93 HydrophobicContact CG1-CE3 3.68Å; I86-W93 HydrophobicContact CG1-CG 3.59Å; I86-W93 HydrophobicContact CG1-CZ3 4.48Å; R90-W93 WeakPolarHBondContact O-CB 3.29Å; R90-W93 VanDerWaalsContact O-CD1 3.29Å; R90-W93 PolarHBondContact O-N 3.09Å; G91-W93 PolarHBondContact O-N 2.88Å; G91-W93 VanDerWaalsContact O-N 3.1Å; W93-Y95 PolarHBondContact O-N 2.87Å; W93-Y95 VanDerWaalsContact O-N 3.07Å; W93-G96 PolarHBondContact O-N 3.34Å; W93-V98 HydrophobicContact CE3-CB 3.87Å; W93-V98 HydrophobicContact CE3-CG1 4.21Å; W93-V98 HydrophobicContact CH2-CG1 4.32Å; W93-V98 HydrophobicContact CZ3-CB 3.74Å; W93-V98 HydrophobicContact CZ3-CG1 3.64Å; W93-V98 WeakPolarHBondContact CZ3-O 3.41Å; W93-L100 HydrophobicContact CE3-CD1 4.44Å; W93-L100 HydrophobicContact CH2-CD1 3.76Å; W93-L100 HydrophobicContact CH2-CD2 3.42Å; W93-L100 VanDerWaalsContact CH2-CD2 3.42Å; W93-L100 HydrophobicContact CH2-CG 3.54Å; W93-L100 HydrophobicContact CZ2-CD2 4.12Å; W93-L100 HydrophobicContact CZ3-CD1 3.49Å; W93-L100 VanDerWaalsContact CZ3-CD1 3.49Å; W93-L100 HydrophobicContact CZ3-CD2 4.07Å; W93-L100 HydrophobicContact CZ3-CG 3.76Å; W93-P160 HydrophobicContact CE3-CG 4.35Å
94	R	86	Confident	90.9	Very high	169 Å²	169	45.9 Å²	45.9	64%	0.638	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-38.9	-177.1	-176.3	174.5	179.7	161.5	0.6	114.4	R89 G91 I92	R89-R94 VanDerWaalsContact O-CA 3.26Å; R89-R94 WeakPolarHBondContact O-CA 3.48Å; G91-R94 WeakPolarHBondContact O-CB 3.4Å; G91-R94 PolarHBondContact O-N 3.27Å; I92-R94 VanDerWaalsContact C-N 3.32Å
95	Y	82.6	Confident	90.8	Very high	163 Å²	163	47.3 Å²	47.3	64%	0.639	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	1	-179.1	-60	-68.1	0	0	0	114.4	W93 R97	W93-Y95 PolarHBondContact O-N 2.87Å; W93-Y95 VanDerWaalsContact O-N 3.07Å; Y95-R97 VanDerWaalsContact C-N 3.26Å; Y95-R97 PolarHBondContact O-N 3.39Å
96	G	82.5	Confident	90.8	Very high	3 Å²	3	48.8 Å²	48.8	3%	0.031	23%	0.228	C	C	.	.	S	Bend	trans	58.7	31.5	174.6	0	0	0	0	0	115.1	W93	W93-G96 PolarHBondContact O-N 3.34Å
97	R	84.7	Confident	90.8	Very high	122 Å²	122	52.8 Å²	52.8	46%	0.46	25%	0.247	S	C	.	.			trans	-133.9	7.8	-169.9	68.2	-177.4	176.7	96.8	-4	114.9	Y95 P99	Y95-R97 VanDerWaalsContact C-N 3.26Å; Y95-R97 PolarHBondContact O-N 3.39Å; R97-P99 WeakPolarHBondContact O-CD 3.46Å
98	V	89.6	Confident	90.9	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.036	24%	0.242	C	C	.	.			trans	-94.6	103.6	-175.3	-179.8	0	0	0	0	108.5	L64 V66 I92 W93 P160	L64-V98 HydrophobicContact CB-CG1 4.26Å; L64-V98 HydrophobicContact CB-CG2 4.09Å; L64-V98 HydrophobicContact CD2-CG1 4.07Å; L64-V98 HydrophobicContact CD2-CG2 3.99Å; L64-V98 HydrophobicContact CG-CG1 3.89Å; L64-V98 HydrophobicContact CG-CG2 4.3Å; L64-V98 WeakPolarHBondContact O-CA 3.1Å; L64-V98 WeakPolarHBondContact O-CG1 3.43Å; V66-V98 HydrophobicContact CG2-CG1 3.82Å; I92-V98 HydrophobicContact CD1-CG1 4.46Å; I92-V98 VanDerWaalsContact O-CG2 3.27Å; I92-V98 WeakPolarHBondContact O-CG2 3.46Å; W93-V98 HydrophobicContact CE3-CB 3.87Å; W93-V98 HydrophobicContact CE3-CG1 4.21Å; W93-V98 HydrophobicContact CH2-CG1 4.32Å; W93-V98 HydrophobicContact CZ3-CB 3.74Å; W93-V98 HydrophobicContact CZ3-CG1 3.64Å; W93-V98 WeakPolarHBondContact CZ3-O 3.41Å; V98-P160 WeakPolarHBondContact O-CD 3.26Å; V98-P160 VanDerWaalsContact O-CG 3.3Å; V98-P160 WeakPolarHBondContact O-CG 3.39Å
99	P	91.8	Very high	91	Very high	26 Å²	26	48.8 Å²	48.8	17%	0.169	23%	0.225	C	C	.	.			trans	-71.7	147.9	177	30	-36.5	0	0	0	111.3	L64 C65 V66 R97 L158 I159	L64-P99 WeakPolarHBondContact O-CD 3.48Å; C65-P99 WeakPolarHBondContact CA-O 3.19Å; C65-P99 HydrophobicContact CB-CG 3.79Å; V66-P99 PolarHBondContact N-O 3.32Å; R97-P99 WeakPolarHBondContact O-CD 3.46Å; P99-L158 CarbonylContact C-O 3.54Å; P99-L158 WeakPolarHBondContact CA-O 3.43Å; P99-I159 HydrophobicContact CB-CG1 4.24Å
100	L	93	Very high	91.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.5	173.2	-52.8	88.1	0	0	0	109.3	V66 I79 W82 I86 W93 L102 R157 L158 P160	V66-L100 HydrophobicContact CB-CG 4.29Å; V66-L100 CarbonylContact O-C 3.6Å; V66-L100 VanDerWaalsContact O-CA 3.28Å; V66-L100 WeakPolarHBondContact O-CA 3.32Å; I79-L100 HydrophobicContact CD1-CD2 4.46Å; W82-L100 HydrophobicContact CD2-CD2 4.16Å; W82-L100 HydrophobicContact CE3-CD2 3.3Å; W82-L100 HydrophobicContact CZ3-CD2 3.67Å; I86-L100 HydrophobicContact CD1-CD1 4.18Å; W93-L100 HydrophobicContact CE3-CD1 4.44Å; W93-L100 HydrophobicContact CH2-CD1 3.76Å; W93-L100 HydrophobicContact CH2-CD2 3.42Å; W93-L100 VanDerWaalsContact CH2-CD2 3.42Å; W93-L100 HydrophobicContact CH2-CG 3.54Å; W93-L100 HydrophobicContact CZ2-CD2 4.12Å; W93-L100 HydrophobicContact CZ3-CD1 3.49Å; W93-L100 VanDerWaalsContact CZ3-CD1 3.49Å; W93-L100 HydrophobicContact CZ3-CD2 4.07Å; W93-L100 HydrophobicContact CZ3-CG 3.76Å; L100-L102 HydrophobicContact CB-CD1 4.29Å; L100-L102 HydrophobicContact CB-CG 4.26Å; L100-L102 HydrophobicContact CD2-CD1 4.1Å; L100-R157 CarbonylContact O-C 3.51Å; L100-R157 VanDerWaalsContact O-CA 3.25Å; L100-R157 WeakPolarHBondContact O-CA 3.37Å; L100-R157 WeakPolarHBondContact O-CG 3.44Å; L100-L158 HydrophobicContact CB-CB 4.3Å; L100-L158 HydrophobicContact CB-CD1 4.41Å; L100-L158 HydrophobicContact CD1-CB 4.13Å; L100-L158 PolarHBondContact N-O 2.93Å; L100-L158 PolarHBondContact O-N 2.84Å; L100-P160 HydrophobicContact CD1-CG 4.23Å
101	T	93	Very high	91.6	Very high	32 Å²	32	47.8 Å²	47.8	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	107.2	167.5	-56.9	0	0	0	0	108.1	M5 V66 I67 G68 V155 V156	M5-T101 HydrophobicContact SD-CG2 3.87Å; V66-T101 PolarHBondContact O-N 3.41Å; I67-T101 VanDerWaalsContact CA-O 3.32Å; I67-T101 WeakPolarHBondContact CA-O 3.43Å; G68-T101 PolarHBondContact N-O 3Å; T101-V155 HydrophobicContact CG2-CG1 3.81Å; T101-V156 WeakPolarHBondContact CA-O 3.35Å
102	L	93.1	Very high	92	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	149.8	-168.7	-56.7	172.1	0	0	0	110.3	G68 L70 I79 W82 L100 F104 V156	G68-L102 WeakPolarHBondContact O-CA 3.41Å; L70-L102 HydrophobicContact CD1-CD2 4.34Å; I79-L102 HydrophobicContact CD1-CD1 4.24Å; W82-L102 HydrophobicContact CE3-CD1 4.2Å; W82-L102 HydrophobicContact CZ3-CD1 3.73Å; W82-L102 HydrophobicContact CZ3-CD2 4.08Å; L100-L102 HydrophobicContact CB-CD1 4.29Å; L100-L102 HydrophobicContact CB-CG 4.26Å; L100-L102 HydrophobicContact CD2-CD1 4.1Å; L102-F104 HydrophobicContact CB-CD2 4.3Å; L102-F104 HydrophobicContact CB-CE2 3.55Å; L102-F104 HydrophobicContact CB-CZ 3.87Å; L102-F104 HydrophobicContact CD1-CE2 4.2Å; L102-F104 HydrophobicContact CD1-CZ 3.77Å; L102-F104 HydrophobicContact CG-CZ 4.5Å; L102-V156 PolarHBondContact N-O 2.71Å; L102-V156 PolarHBondContact O-N 3.42Å
103	T	91.6	Very high	92.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	141.2	166.8	54.5	0	0	0	0	110.7	M5 G68 N69 I140 V153 G154 V155	M5-T103 HydrophobicContact CE-CG2 3.87Å; G68-T103 PolarHBondContact O-N 3.49Å; G68-T103 VanDerWaalsContact O-N 3.1Å; N69-T103 VanDerWaalsContact CA-OG1 3.29Å; N69-T103 WeakPolarHBondContact CA-OG1 3.18Å; N69-T103 PolarHBondContact OD1-OG1 3.15Å; T103-I140 HydrophobicContact CG2-CD1 4.47Å; T103-V153 HydrophobicContact CG2-CG1 3.9Å; T103-G154 WeakPolarHBondContact CA-O 3.47Å; T103-V155 HydrophobicContact CG2-CG2 4.21Å
104	F	93.6	Very high	92.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	164.6	172.1	-60.7	-87.9	0	0	0	109.4	I79 L102 K106 V108 A109 L112 V153 G154 V156	I79-F104 HydrophobicContact CB-CE1 4.21Å; I79-F104 HydrophobicContact CB-CZ 4.18Å; I79-F104 HydrophobicContact CG1-CZ 4.24Å; I79-F104 HydrophobicContact CG2-CE1 4.08Å; I79-F104 HydrophobicContact CG2-CZ 4.43Å; L102-F104 HydrophobicContact CB-CD2 4.3Å; L102-F104 HydrophobicContact CB-CE2 3.55Å; L102-F104 HydrophobicContact CB-CZ 3.87Å; L102-F104 HydrophobicContact CD1-CE2 4.2Å; L102-F104 HydrophobicContact CD1-CZ 3.77Å; L102-F104 HydrophobicContact CG-CZ 4.5Å; F104-K106 PolarHBondContact O-N 2.9Å; F104-V108 HydrophobicContact CB-CB 4.05Å; F104-V108 HydrophobicContact CB-CG1 4.03Å; F104-V108 HydrophobicContact CD1-CG1 3.84Å; F104-V108 HydrophobicContact CG-CG1 4.14Å; F104-A109 HydrophobicContact CB-CB 4.18Å; F104-L112 HydrophobicContact CD1-CD1 4.23Å; F104-L112 HydrophobicContact CD2-CD1 3.6Å; F104-L112 HydrophobicContact CE1-CD1 4.08Å; F104-L112 HydrophobicContact CE2-CD1 3.4Å; F104-L112 VanDerWaalsContact CE2-CD1 3.4Å; F104-L112 HydrophobicContact CG-CD1 4.01Å; F104-L112 HydrophobicContact CZ-CD1 3.67Å; F104-V153 CarbonylContact O-C 3.38Å; F104-V153 VanDerWaalsContact O-CA 3.31Å; F104-V153 WeakPolarHBondContact O-CA 3.29Å; F104-V153 VanDerWaalsContact O-CG1 3.24Å; F104-V153 WeakPolarHBondContact O-CG1 3.23Å; F104-G154 PolarHBondContact N-O 2.82Å; F104-G154 PolarHBondContact O-N 3.46Å; F104-V156 HydrophobicContact CD2-CB 4.16Å; F104-V156 HydrophobicContact CD2-CG2 4.09Å; F104-V156 HydrophobicContact CE2-CB 4.16Å
105	Q	94	Very high	93.4	Very high	69 Å²	69	41.4 Å²	41.4	32%	0.322	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	141.1	161.2	-65.8	-176.4	-21	0	0	108.7	F72 E107 V108 A109 V151	F72-Q105 HydrophobicContact CB-CG 3.88Å; F72-Q105 HydrophobicContact CD1-CG 3.7Å; F72-Q105 HydrophobicContact CD2-CG 3.35Å; F72-Q105 HydrophobicContact CE1-CG 4.03Å; F72-Q105 HydrophobicContact CE2-CG 3.69Å; F72-Q105 HydrophobicContact CG-CG 3.36Å; F72-Q105 HydrophobicContact CZ-CG 4.02Å; Q105-E107 VanDerWaalsContact C-N 3.27Å; Q105-E107 PolarHBondContact O-N 3.35Å; Q105-V108 HydrophobicContact CB-CG2 4.28Å; Q105-V108 WeakPolarHBondContact O-CA 3.49Å; Q105-V108 PolarHBondContact O-N 3.16Å; Q105-A109 PolarHBondContact O-N 3.24Å; Q105-V151 HydrophobicContact CB-CG2 4.1Å; Q105-V151 HydrophobicContact CG-CG2 3.83Å
106	K	95.3	Very high	94.2	Very high	60 Å²	60	35.2 Å²	35.2	26%	0.261	17%	0.173	S	C	.	.	H	α-helix	trans	-48.3	-47.7	-177.3	175.5	164	177.7	165.4	0	112.7	F104 V108 A109 E110 D139 D152	F104-K106 PolarHBondContact O-N 2.9Å; K106-V108 VanDerWaalsContact C-N 3.33Å; K106-V108 PolarHBondContact O-N 3.05Å; K106-A109 WeakPolarHBondContact O-CB 3.35Å; K106-A109 PolarHBondContact O-N 3.04Å; K106-A109 VanDerWaalsContact O-N 3.12Å; K106-E110 WeakPolarHBondContact CE-OE1 3.42Å; K106-E110 HydrophobicContact CG-CG 4.35Å; K106-E110 WeakPolarHBondContact CG-OE1 3.46Å; K106-E110 WeakPolarHBondContact O-CG 3.32Å; K106-E110 PolarHBondContact O-N 3.44Å; K106-D139 IonicContact NZ-OD2 2.75Å; K106-D139 PolarHBondContact NZ-OD2 3.23Å; K106-D152 HydrophobicContact CB-CB 4.24Å; K106-D152 VanDerWaalsContact CB-O 3.3Å; K106-D152 WeakPolarHBondContact CB-O 3.42Å; K106-D152 HydrophobicContact CD-CB 4.08Å; K106-D152 PolarHBondContact N-O 3Å
107	E	96.6	Very high	94.9	Very high	85 Å²	85	42.9 Å²	42.9	40%	0.397	20%	0.201	S	C	.	.	H	α-helix	trans	-58.8	-40.1	177.4	-174.5	-175.4	-177.5	0	0	113.1	Q105 E110 R111	Q105-E107 VanDerWaalsContact C-N 3.27Å; Q105-E107 PolarHBondContact O-N 3.35Å; E107-E110 PolarHBondContact O-N 2.91Å; E107-R111 WeakPolarHBondContact O-CB 3.49Å; E107-R111 WeakPolarHBondContact O-CG 3.28Å; E107-R111 PolarHBondContact O-N 3.44Å; E107-R111 IonicContact OE1-CZ 3.51Å; E107-R111 IonicContact OE1-NE 3.76Å; E107-R111 PolarHBondContact OE1-NE 3.37Å; E107-R111 IonicContact OE1-NH2 2.72Å; E107-R111 PolarHBondContact OE1-NH2 2.89Å
108	V	96.4	Very high	95.5	Very high	15 Å²	15	40.3 Å²	40.3	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-38.1	177.8	177.1	0	0	0	0	110.8	F104 Q105 K106 R111 L112 L124	F104-V108 HydrophobicContact CB-CB 4.05Å; F104-V108 HydrophobicContact CB-CG1 4.03Å; F104-V108 HydrophobicContact CD1-CG1 3.84Å; F104-V108 HydrophobicContact CG-CG1 4.14Å; Q105-V108 HydrophobicContact CB-CG2 4.28Å; Q105-V108 WeakPolarHBondContact O-CA 3.49Å; Q105-V108 PolarHBondContact O-N 3.16Å; K106-V108 VanDerWaalsContact C-N 3.33Å; K106-V108 PolarHBondContact O-N 3.05Å; V108-R111 PolarHBondContact O-N 3.11Å; V108-L112 HydrophobicContact CG1-CD1 4.44Å; V108-L112 WeakPolarHBondContact O-CG 3.39Å; V108-L112 PolarHBondContact O-N 3.29Å; V108-L124 HydrophobicContact CG1-CD2 3.91Å
109	A	97.3	Very high	95.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-43.5	174.2	0	0	0	0	0	111.7	F104 Q105 K106 L112 A113 Y136 V156	F104-A109 HydrophobicContact CB-CB 4.18Å; Q105-A109 PolarHBondContact O-N 3.24Å; K106-A109 WeakPolarHBondContact O-CB 3.35Å; K106-A109 PolarHBondContact O-N 3.04Å; K106-A109 VanDerWaalsContact O-N 3.12Å; A109-L112 WeakPolarHBondContact O-CB 3.31Å; A109-L112 PolarHBondContact O-N 3.1Å; A109-A113 PolarHBondContact O-N 3.47Å; A109-Y136 HydrophobicContact CB-CD2 4.02Å; A109-Y136 HydrophobicContact CB-CE2 3.39Å; A109-V156 HydrophobicContact CB-CG2 3.43Å; A109-V156 VanDerWaalsContact CB-CG2 3.43Å
110	E	98.2	Very high	96	Very high	62 Å²	62	49.3 Å²	49.3	29%	0.29	24%	0.236	S	C	.	.	H	α-helix	trans	-61.3	-48.2	174.6	-71.7	168.5	169	0	0	110	K106 E107 L112 A113 A114 Q120 Y136	K106-E110 WeakPolarHBondContact CE-OE1 3.42Å; K106-E110 HydrophobicContact CG-CG 4.35Å; K106-E110 WeakPolarHBondContact CG-OE1 3.46Å; K106-E110 WeakPolarHBondContact O-CG 3.32Å; K106-E110 PolarHBondContact O-N 3.44Å; E107-E110 PolarHBondContact O-N 2.91Å; E110-L112 VanDerWaalsContact C-N 3.3Å; E110-L112 PolarHBondContact O-N 3.15Å; E110-A113 CarbonylContact O-C 3.51Å; E110-A113 PolarHBondContact O-N 2.97Å; E110-A113 VanDerWaalsContact O-N 3.12Å; E110-A114 WeakPolarHBondContact O-CA 3.38Å; E110-A114 VanDerWaalsContact O-CB 3.3Å; E110-A114 WeakPolarHBondContact O-CB 3.4Å; E110-A114 PolarHBondContact O-N 2.69Å; E110-Q120 HydrophobicContact CB-CB 4.31Å; E110-Q120 HydrophobicContact CB-CG 4.09Å; E110-Y136 HydrophobicContact CG-CE2 3.9Å
111	R	97.8	Very high	96.3	Very high	86 Å²	86	49.3 Å²	49.3	33%	0.325	24%	0.236	S	C	.	.	H	α-helix	trans	-57.1	-39.6	175	-74.1	168.6	178	-169	1.9	112.7	E107 V108 A113 Q120 S125	E107-R111 WeakPolarHBondContact O-CB 3.49Å; E107-R111 WeakPolarHBondContact O-CG 3.28Å; E107-R111 PolarHBondContact O-N 3.44Å; E107-R111 IonicContact OE1-CZ 3.51Å; E107-R111 IonicContact OE1-NE 3.76Å; E107-R111 PolarHBondContact OE1-NE 3.37Å; E107-R111 IonicContact OE1-NH2 2.72Å; E107-R111 PolarHBondContact OE1-NH2 2.89Å; V108-R111 PolarHBondContact O-N 3.11Å; R111-A113 VanDerWaalsContact C-N 3.33Å; R111-A113 PolarHBondContact O-N 3.4Å; R111-Q120 HydrophobicContact CG-CB 4.14Å; R111-Q120 WeakPolarHBondContact CG-O 3.37Å; R111-S125 WeakPolarHBondContact O-CA 3.1Å; R111-S125 WeakPolarHBondContact O-CB 3.42Å; R111-S125 PolarHBondContact O-N 3.17Å; R111-S125 PolarHBondContact O-OG 3.27Å
112	L	97.8	Very high	96.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-41.3	177.7	-82.6	161.7	0	0	0	112.1	I79 F104 V108 A109 E110 L124 S128 Q129 V134 V156 L158	I79-L112 HydrophobicContact CG1-CD2 4.4Å; F104-L112 HydrophobicContact CD1-CD1 4.23Å; F104-L112 HydrophobicContact CD2-CD1 3.6Å; F104-L112 HydrophobicContact CE1-CD1 4.08Å; F104-L112 HydrophobicContact CE2-CD1 3.4Å; F104-L112 VanDerWaalsContact CE2-CD1 3.4Å; F104-L112 HydrophobicContact CG-CD1 4.01Å; F104-L112 HydrophobicContact CZ-CD1 3.67Å; V108-L112 HydrophobicContact CG1-CD1 4.44Å; V108-L112 WeakPolarHBondContact O-CG 3.39Å; V108-L112 PolarHBondContact O-N 3.29Å; A109-L112 WeakPolarHBondContact O-CB 3.31Å; A109-L112 PolarHBondContact O-N 3.1Å; E110-L112 VanDerWaalsContact C-N 3.3Å; E110-L112 PolarHBondContact O-N 3.15Å; L112-L124 HydrophobicContact CD1-CD2 4.49Å; L112-L124 HydrophobicContact CD2-CD1 3.83Å; L112-L124 HydrophobicContact CD2-CD2 3.86Å; L112-L124 HydrophobicContact CD2-CG 3.58Å; L112-L124 HydrophobicContact CG-CD2 3.72Å; L112-L124 HydrophobicContact CG-CG 3.93Å; L112-S128 PolarHBondContact O-OG 3.31Å; L112-Q129 PolarHBondContact O-NE2 3.2Å; L112-V134 HydrophobicContact CB-CG1 4.2Å; L112-V134 WeakPolarHBondContact O-CG1 3.33Å; L112-V156 HydrophobicContact CB-CG1 4.35Å; L112-V156 HydrophobicContact CD1-CG1 4.42Å; L112-V156 HydrophobicContact CD1-CG2 4.3Å; L112-L158 HydrophobicContact CD2-CD2 4.45Å
113	A	97.8	Very high	96.7	Very high	29 Å²	29	53 Å²	53	24%	0.24	25%	0.248	C	C	.	.	H	α-helix	trans	-95	-6.4	-174.7	0	0	0	0	0	114.4	A109 E110 R111 D115 V134 Y136	A109-A113 PolarHBondContact O-N 3.47Å; E110-A113 CarbonylContact O-C 3.51Å; E110-A113 PolarHBondContact O-N 2.97Å; E110-A113 VanDerWaalsContact O-N 3.12Å; R111-A113 VanDerWaalsContact C-N 3.33Å; R111-A113 PolarHBondContact O-N 3.4Å; A113-D115 PolarHBondContact O-N 2.82Å; A113-V134 HydrophobicContact CB-CG1 4.28Å; A113-Y136 HydrophobicContact CB-CD2 4.32Å
114	A	98.3	Very high	96.9	Very high	3 Å²	3	54.2 Å²	54.2	3%	0.025	26%	0.255	C	S	.	.			trans	-59.1	118.6	-175.9	0	0	0	0	0	112.7	E110 D118 Q120 R121 Q129	E110-A114 WeakPolarHBondContact O-CA 3.38Å; E110-A114 VanDerWaalsContact O-CB 3.3Å; E110-A114 WeakPolarHBondContact O-CB 3.4Å; E110-A114 PolarHBondContact O-N 2.69Å; A114-D118 HydrophobicContact CB-CB 3.94Å; A114-Q120 HydrophobicContact CB-CB 4.09Å; A114-R121 HydrophobicContact CB-CB 4.15Å; A114-R121 PolarHBondContact O-NH1 2.97Å; A114-Q129 PolarHBondContact O-NE2 2.95Å
115	D	97.2	Very high	97.1	Very high	106 Å²	106	54.2 Å²	54.2	57%	0.567	26%	0.255	S	S	*	.			trans	-85	179.4	-179.5	-156.8	-2.9	0	0	0	111.7	A113 W117 D118 R121	A113-D115 PolarHBondContact O-N 2.82Å; D115-W117 PolarHBondContact O-N 2.61Å; D115-D118 WeakPolarHBondContact O-CB 3.48Å; D115-D118 PolarHBondContact O-N 3.41Å; D115-D118 VanDerWaalsContact O-N 3.11Å; D115-R121 VanDerWaalsContact O-CD 3.3Å; D115-R121 WeakPolarHBondContact O-CD 3.42Å; D115-R121 PolarHBondContact O-NH1 2.91Å
116	V	97.9	Very high	97.4	Very high	34 Å²	34	50.9 Å²	50.9	21%	0.206	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	138.6	178	-167.3	0	0	0	0	108.9	D118 I220 T223	V116-D118 PolarHBondContact O-N 2.77Å; V116-I220 WeakPolarHBondContact CG1-O 3.46Å; V116-T223 HydrophobicContact CG2-CG2 4.37Å
117	W	97.5	Very high	97.5	Very high	164 Å²	164	48.3 Å²	48.3	62%	0.621	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.7	-5.8	-174.8	-56.5	95.5	0	0	0	116.7	D115 I220 Q221	D115-W117 PolarHBondContact O-N 2.61Å; W117-I220 PolarHBondContact N-O 3Å; W117-Q221 HydrophobicContact CD2-CG 4.19Å; W117-Q221 HydrophobicContact CE3-CG 3.84Å; W117-Q221 HydrophobicContact CH2-CB 4.03Å; W117-Q221 HydrophobicContact CH2-CG 3.46Å; W117-Q221 VanDerWaalsContact CH2-CG 3.46Å; W117-Q221 HydrophobicContact CZ2-CB 3.86Å; W117-Q221 HydrophobicContact CZ2-CG 3.8Å; W117-Q221 HydrophobicContact CZ3-CB 4.45Å; W117-Q221 HydrophobicContact CZ3-CG 3.5Å; W117-Q221 VanDerWaalsContact CZ3-CG 3.5Å
118	D	97.6	Very high	97.6	Very high	68 Å²	68	44.2 Å²	44.2	36%	0.364	21%	0.209	S	C	.	.			trans	-69.6	137.4	176.4	-168	-70	0	0	0	111.6	A114 D115 V116 Q120 R121	A114-D118 HydrophobicContact CB-CB 3.94Å; D115-D118 WeakPolarHBondContact O-CB 3.48Å; D115-D118 PolarHBondContact O-N 3.41Å; D115-D118 VanDerWaalsContact O-N 3.11Å; V116-D118 PolarHBondContact O-N 2.77Å; D118-Q120 VanDerWaalsContact C-N 3.25Å; D118-Q120 PolarHBondContact O-N 3.5Å; D118-Q120 WeakPolarHBondContact OD1-CA 3.47Å; D118-Q120 VanDerWaalsContact OD1-CB 3.27Å; D118-Q120 WeakPolarHBondContact OD1-CB 3.44Å; D118-Q120 PolarHBondContact OD1-N 3.36Å; D118-R121 HydrophobicContact CB-CB 4.39Å; D118-R121 WeakPolarHBondContact O-CB 3.21Å; D118-R121 PolarHBondContact O-N 3.41Å
119	E	96	Very high	97.7	Very high	165 Å²	165	44.8 Å²	44.8	77%	0.771	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-27.7	-179.4	-64.2	-170.9	169.2	0	0	112.9	R121 R184	E119-R121 VanDerWaalsContact C-N 3.29Å; E119-R184 PolarHBondContact O-NH2 3.02Å
120	Q	97.1	Very high	97.7	Very high	56 Å²	56	44.8 Å²	44.8	26%	0.262	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-4.4	173.7	-62	-65.3	-9.9	0	0	112.4	E110 R111 A114 D118 S122	E110-Q120 HydrophobicContact CB-CB 4.31Å; E110-Q120 HydrophobicContact CB-CG 4.09Å; R111-Q120 HydrophobicContact CG-CB 4.14Å; R111-Q120 WeakPolarHBondContact CG-O 3.37Å; A114-Q120 HydrophobicContact CB-CB 4.09Å; D118-Q120 VanDerWaalsContact C-N 3.25Å; D118-Q120 PolarHBondContact O-N 3.5Å; D118-Q120 WeakPolarHBondContact OD1-CA 3.47Å; D118-Q120 VanDerWaalsContact OD1-CB 3.27Å; D118-Q120 WeakPolarHBondContact OD1-CB 3.44Å; D118-Q120 PolarHBondContact OD1-N 3.36Å; Q120-S122 PolarHBondContact O-N 3.01Å
121	R	98	Very high	97.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.198	C	C	.	.			trans	-59.4	126.7	177.6	-167.7	177.6	-180	88.8	-7.1	110.5	A114 D115 D118 E119 S125 F181 R184 I220 L222	A114-R121 HydrophobicContact CB-CB 4.15Å; A114-R121 PolarHBondContact O-NH1 2.97Å; D115-R121 VanDerWaalsContact O-CD 3.3Å; D115-R121 WeakPolarHBondContact O-CD 3.42Å; D115-R121 PolarHBondContact O-NH1 2.91Å; D118-R121 HydrophobicContact CB-CB 4.39Å; D118-R121 WeakPolarHBondContact O-CB 3.21Å; D118-R121 PolarHBondContact O-N 3.41Å; E119-R121 VanDerWaalsContact C-N 3.29Å; R121-S125 WeakPolarHBondContact CA-OG 3.29Å; R121-F181 HydrophobicContact CG-CE1 4.42Å; R121-F181 HydrophobicContact CG-CZ 4.24Å; R121-F181 WeakPolarHBondContact O-CE1 3.42Å; R121-R184 PolarHBondContact O-NH2 3.11Å; R121-I220 HydrophobicContact CB-CB 4.34Å; R121-I220 HydrophobicContact CB-CG2 4.1Å; R121-I220 WeakPolarHBondContact CD-O 3.19Å; R121-L222 PolarHBondContact NH2-O 3.24Å
122	S	97.4	Very high	97.7	Very high	19 Å²	19	38.1 Å²	38.1	13%	0.133	18%	0.183	C	C	.	.			trans	-145	179.1	-170.3	70.1	0	0	0	0	111.2	Q120 L124 S125 V126 F181	Q120-S122 PolarHBondContact O-N 3.01Å; S122-L124 PolarHBondContact O-N 3.22Å; S122-L124 PolarHBondContact OG-N 2.92Å; S122-S125 PolarHBondContact N-OG 2.91Å; S122-S125 WeakPolarHBondContact O-CB 3.25Å; S122-S125 PolarHBondContact O-N 3.29Å; S122-S125 VanDerWaalsContact O-N 3.14Å; S122-S125 PolarHBondContact O-OG 3.1Å; S122-S125 PolarHBondContact OG-OG 2.9Å; S122-V126 PolarHBondContact O-N 3.21Å; S122-F181 VanDerWaalsContact C-CE1 3.47Å; S122-F181 WeakPolarHBondContact O-CZ 3.37Å
123	R	96.9	Very high	97.6	Very high	91 Å²	91	41 Å²	41	34%	0.343	20%	0.199	S	C	.	.	H	α-helix	trans	-51.7	-41.7	168.8	167.8	177.4	165.3	-141.6	-1.9	111.1	S125 V126 M127 E174 V177 F181	R123-S125 VanDerWaalsContact C-N 3.29Å; R123-S125 PolarHBondContact O-N 3.41Å; R123-V126 PolarHBondContact O-N 2.92Å; R123-M127 HydrophobicContact CG-CG 3.91Å; R123-M127 WeakPolarHBondContact O-CB 3.29Å; R123-M127 VanDerWaalsContact O-CG 3.22Å; R123-M127 WeakPolarHBondContact O-CG 3.41Å; R123-M127 PolarHBondContact O-N 3.03Å; R123-E174 IonicContact CZ-OE1 3.45Å; R123-E174 IonicContact NH2-OE1 2.72Å; R123-E174 PolarHBondContact NH2-OE1 3.47Å; R123-V177 HydrophobicContact CB-CG1 4.13Å; R123-V177 HydrophobicContact CG-CG1 3.93Å; R123-F181 HydrophobicContact CB-CB 4.41Å; R123-F181 HydrophobicContact CB-CD2 4.36Å; R123-F181 HydrophobicContact CB-CG 4.47Å
124	L	96.9	Very high	97.6	Very high	26 Å²	26	40.7 Å²	40.7	14%	0.136	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-36.8	-177.2	-172.8	59.6	0	0	0	111.5	I79 L83 V108 L112 S122 S128	I79-L124 HydrophobicContact CG2-CD1 4.28Å; L83-L124 HydrophobicContact CD1-CD1 4.41Å; V108-L124 HydrophobicContact CG1-CD2 3.91Å; L112-L124 HydrophobicContact CD1-CD2 4.49Å; L112-L124 HydrophobicContact CD2-CD1 3.83Å; L112-L124 HydrophobicContact CD2-CD2 3.86Å; L112-L124 HydrophobicContact CD2-CG 3.58Å; L112-L124 HydrophobicContact CG-CD2 3.72Å; L112-L124 HydrophobicContact CG-CG 3.93Å; S122-L124 PolarHBondContact O-N 3.22Å; S122-L124 PolarHBondContact OG-N 2.92Å; L124-S128 VanDerWaalsContact O-CB 3.25Å; L124-S128 WeakPolarHBondContact O-CB 3.26Å; L124-S128 PolarHBondContact O-N 3.49Å; L124-S128 PolarHBondContact O-OG 3.05Å
125	S	98.4	Very high	97.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-51.3	175.9	-33.8	0	0	0	0	111.4	R111 R121 S122 R123 S128 Q129	R111-S125 WeakPolarHBondContact O-CA 3.1Å; R111-S125 WeakPolarHBondContact O-CB 3.42Å; R111-S125 PolarHBondContact O-N 3.17Å; R111-S125 PolarHBondContact O-OG 3.27Å; R121-S125 WeakPolarHBondContact CA-OG 3.29Å; S122-S125 PolarHBondContact N-OG 2.91Å; S122-S125 WeakPolarHBondContact O-CB 3.25Å; S122-S125 PolarHBondContact O-N 3.29Å; S122-S125 VanDerWaalsContact O-N 3.14Å; S122-S125 PolarHBondContact O-OG 3.1Å; S122-S125 PolarHBondContact OG-OG 2.9Å; R123-S125 VanDerWaalsContact C-N 3.29Å; R123-S125 PolarHBondContact O-N 3.41Å; S125-S128 PolarHBondContact O-N 2.96Å; S125-S128 PolarHBondContact O-OG 3.38Å; S125-Q129 WeakPolarHBondContact O-CB 3.27Å; S125-Q129 WeakPolarHBondContact O-CG 3.38Å; S125-Q129 PolarHBondContact O-N 3.49Å; S125-Q129 PolarHBondContact O-NE2 2.84Å
126	V	98.4	Very high	97.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.9	-41.8	-177.4	179.1	0	0	0	0	110.7	S122 R123 A130 I166 V177 F181 M224 F227	S122-V126 PolarHBondContact O-N 3.21Å; R123-V126 PolarHBondContact O-N 2.92Å; V126-A130 WeakPolarHBondContact O-CB 3.31Å; V126-A130 PolarHBondContact O-N 3.09Å; V126-I166 HydrophobicContact CG1-CD1 4.48Å; V126-V177 HydrophobicContact CB-CG1 3.89Å; V126-V177 HydrophobicContact CB-CG2 4.48Å; V126-V177 HydrophobicContact CG1-CG1 4.04Å; V126-V177 HydrophobicContact CG1-CG2 3.71Å; V126-F181 HydrophobicContact CB-CE2 4.38Å; V126-F181 HydrophobicContact CG2-CE2 3.61Å; V126-F181 HydrophobicContact CG2-CZ 3.81Å; V126-M224 HydrophobicContact CB-SD 4.49Å; V126-M224 HydrophobicContact CG1-CE 4.07Å; V126-M224 HydrophobicContact CG1-SD 4.08Å; V126-M224 WeakPolarHBondContact O-CE 3.45Å; V126-F227 HydrophobicContact CG1-CB 4.29Å; V126-F227 HydrophobicContact CG1-CD1 4.22Å; V126-F227 HydrophobicContact CG1-CD2 3.86Å; V126-F227 HydrophobicContact CG1-CE2 4.22Å; V126-F227 HydrophobicContact CG1-CG 3.86Å; V126-F227 HydrophobicContact CG2-CD2 4Å; V126-F227 HydrophobicContact CG2-CE2 3.63Å; V126-F227 HydrophobicContact CG2-CZ 4.07Å
127	M	98.3	Very high	97.5	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-66.1	-40.9	178.4	-66.2	-57.6	-67.8	0	0	111.9	L83 R123 Y131 Y170 V173 E174 V177	L83-M127 HydrophobicContact CD1-CB 4.28Å; R123-M127 HydrophobicContact CG-CG 3.91Å; R123-M127 WeakPolarHBondContact O-CB 3.29Å; R123-M127 VanDerWaalsContact O-CG 3.22Å; R123-M127 WeakPolarHBondContact O-CG 3.41Å; R123-M127 PolarHBondContact O-N 3.03Å; M127-Y131 HydrophobicContact CE-CE2 4.07Å; M127-Y131 WeakPolarHBondContact O-CD2 3.42Å; M127-Y170 HydrophobicContact CE-CD2 3.96Å; M127-Y170 HydrophobicContact CE-CE1 4.44Å; M127-Y170 HydrophobicContact CE-CE2 3.27Å; M127-V173 HydrophobicContact SD-CG1 4.02Å; M127-E174 HydrophobicContact CE-CB 3.86Å; M127-E174 HydrophobicContact CE-CG 4.38Å; M127-V177 HydrophobicContact CG-CG1 4.29Å; M127-V177 HydrophobicContact SD-CB 4.1Å; M127-V177 HydrophobicContact SD-CG1 4.3Å; M127-V177 HydrophobicContact SD-CG2 4.17Å
128	S	98.1	Very high	97.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-46.6	177.9	63.9	0	0	0	0	111.7	L112 L124 S125 A130 Y131 C132	L112-S128 PolarHBondContact O-OG 3.31Å; L124-S128 VanDerWaalsContact O-CB 3.25Å; L124-S128 WeakPolarHBondContact O-CB 3.26Å; L124-S128 PolarHBondContact O-N 3.49Å; L124-S128 PolarHBondContact O-OG 3.05Å; S125-S128 PolarHBondContact O-N 2.96Å; S125-S128 PolarHBondContact O-OG 3.38Å; S128-A130 VanDerWaalsContact C-N 3.31Å; S128-A130 PolarHBondContact O-N 3.32Å; S128-Y131 PolarHBondContact O-N 2.82Å; S128-C132 WeakPolarHBondContact O-CB 3.47Å; S128-C132 PolarHBondContact O-N 3.12Å
129	Q	98.4	Very high	97.2	Very high	26 Å²	26	44.8 Å²	44.8	12%	0.121	21%	0.209	C	C	.	.	H	α-helix	trans	-71.4	-24.5	-177.9	-65.7	163.4	25.9	0	0	112.6	L112 A114 S125 Y131 C132 V134 L165 M224	L112-Q129 PolarHBondContact O-NE2 3.2Å; A114-Q129 PolarHBondContact O-NE2 2.95Å; S125-Q129 WeakPolarHBondContact O-CB 3.27Å; S125-Q129 WeakPolarHBondContact O-CG 3.38Å; S125-Q129 PolarHBondContact O-N 3.49Å; S125-Q129 PolarHBondContact O-NE2 2.84Å; Q129-Y131 PolarHBondContact O-N 3.36Å; Q129-C132 WeakPolarHBondContact CA-O 3.42Å; Q129-V134 HydrophobicContact CG-CG2 4.19Å; Q129-L165 WeakPolarHBondContact O-CD1 3.37Å; Q129-M224 HydrophobicContact CB-CE 4.11Å; Q129-M224 HydrophobicContact CB-SD 4.07Å
130	A	98.2	Very high	97	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-31.6	174.1	0	0	0	0	0	112.4	V126 S128 P164 L165 I166 M224	V126-A130 WeakPolarHBondContact O-CB 3.31Å; V126-A130 PolarHBondContact O-N 3.09Å; S128-A130 VanDerWaalsContact C-N 3.31Å; S128-A130 PolarHBondContact O-N 3.32Å; A130-P164 CarbonylContact O-C 3.54Å; A130-P164 WeakPolarHBondContact O-CA 3.48Å; A130-L165 PolarHBondContact O-N 3.1Å; A130-I166 HydrophobicContact CB-CB 4.25Å; A130-I166 HydrophobicContact CB-CD1 3.96Å; A130-I166 HydrophobicContact CB-CG1 4.04Å; A130-M224 HydrophobicContact CB-CE 3.89Å
131	Y	97.6	Very high	96.7	Very high	5 Å²	5	38 Å²	38	2%	0.02	18%	0.184	C	C	.	.	H	α-helix	trans	-120.6	-15.2	-171.5	-53.3	-66.7	0	0	0	114.1	A87 M127 S128 Q129 P160 L161 P164 Y170	A87-Y131 HydrophobicContact CB-CD1 3.59Å; A87-Y131 HydrophobicContact CB-CD2 4.23Å; A87-Y131 HydrophobicContact CB-CE1 3.36Å; A87-Y131 HydrophobicContact CB-CE2 4.05Å; A87-Y131 HydrophobicContact CB-CG 4.04Å; M127-Y131 HydrophobicContact CE-CE2 4.07Å; M127-Y131 WeakPolarHBondContact O-CD2 3.42Å; S128-Y131 PolarHBondContact O-N 2.82Å; Q129-Y131 PolarHBondContact O-N 3.36Å; Y131-P160 WeakPolarHBondContact O-CA 3.26Å; Y131-L161 PolarHBondContact O-N 3.2Å; Y131-P164 HydrophobicContact CD1-CB 3.83Å; Y131-P164 HydrophobicContact CD1-CG 4.11Å; Y131-P164 HydrophobicContact CE1-CB 4.15Å; Y131-Y170 AromaticContact CE2-CD2 3.81Å; Y131-Y170 HydrophobicContact CE2-CD2 3.81Å; Y131-Y170 HydrophobicContact CE2-CE2 4.01Å; Y131-Y170 AromaticContact CZ-CD2 3.89Å
132	C	97.6	Very high	96.3	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.02	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	149	-176.7	-60.9	0	0	0	0	112.4	S128 Q129 V134 L158 I159	S128-C132 WeakPolarHBondContact O-CB 3.47Å; S128-C132 PolarHBondContact O-N 3.12Å; Q129-C132 WeakPolarHBondContact CA-O 3.42Å; C132-V134 HydrophobicContact CB-CG2 4.07Å; C132-V134 PolarHBondContact O-N 2.56Å; C132-L158 HydrophobicContact CB-CB 4.07Å; C132-L158 HydrophobicContact CB-CD2 4.28Å; C132-I159 CarbonylContact C-O 3.37Å; C132-I159 WeakPolarHBondContact CA-O 3.31Å
133	D	96.8	Very high	95.8	Very high	61 Å²	61	43.3 Å²	43.3	33%	0.326	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	114	155.3	173.8	25.9	0	0	0	107.8	K135 L158 I159 L161	D133-K135 WeakPolarHBondContact OD1-CE 3.45Å; D133-K135 IonicContact OD1-NZ 2.99Å; D133-K135 WeakPolarHBondContact OD2-CE 3.49Å; D133-K135 IonicContact OD2-NZ 3.61Å; D133-K135 PolarHBondContact OD2-NZ 3.36Å; D133-L158 WeakPolarHBondContact O-CA 3.42Å; D133-I159 HydrophobicContact CB-CB 4.31Å; D133-I159 PolarHBondContact N-O 3.45Å; D133-I159 PolarHBondContact O-N 3.16Å; D133-L161 HydrophobicContact CB-CD2 4.16Å
134	V	98.1	Very high	95.4	Very high	22 Å²	22	40.1 Å²	40.1	13%	0.133	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.9	-172.7	-173.8	0	0	0	0	109.7	L112 A113 Q129 C132 V156 L158	L112-V134 HydrophobicContact CB-CG1 4.2Å; L112-V134 WeakPolarHBondContact O-CG1 3.33Å; A113-V134 HydrophobicContact CB-CG1 4.28Å; Q129-V134 HydrophobicContact CG-CG2 4.19Å; C132-V134 HydrophobicContact CB-CG2 4.07Å; C132-V134 PolarHBondContact O-N 2.56Å; V134-V156 HydrophobicContact CG1-CG1 3.64Å; V134-L158 HydrophobicContact CG1-CG 4.42Å; V134-L158 HydrophobicContact CG2-CD2 4.12Å; V134-L158 HydrophobicContact CG2-CG 4.4Å
135	K	96.8	Very high	94.8	Very high	96 Å²	96	39 Å²	39	42%	0.417	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.6	-178.5	-68	179.6	178	150.9	0	111	D133 M137 V156 R157	D133-K135 WeakPolarHBondContact OD1-CE 3.45Å; D133-K135 IonicContact OD1-NZ 2.99Å; D133-K135 WeakPolarHBondContact OD2-CE 3.49Å; D133-K135 IonicContact OD2-NZ 3.61Å; D133-K135 PolarHBondContact OD2-NZ 3.36Å; K135-M137 HydrophobicContact CB-SD 3.91Å; K135-M137 PolarHBondContact O-N 2.88Å; K135-V156 WeakPolarHBondContact O-CA 3.45Å; K135-R157 PolarHBondContact N-O 3.45Å; K135-R157 PolarHBondContact O-N 3.29Å
136	Y	97.1	Very high	94	Very high	69 Å²	69	44.4 Å²	44.4	27%	0.271	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	118.5	165.8	-160.3	-74.7	0	0	0	108.6	A109 E110 A113 D139 G154 V156	A109-Y136 HydrophobicContact CB-CD2 4.02Å; A109-Y136 HydrophobicContact CB-CE2 3.39Å; E110-Y136 HydrophobicContact CG-CE2 3.9Å; A113-Y136 HydrophobicContact CB-CD2 4.32Å; Y136-D139 WeakPolarHBondContact CE1-OD1 3.41Å; Y136-D139 VanDerWaalsContact CZ-OD1 3.22Å; Y136-D139 PolarHBondContact OH-OD1 2.69Å; Y136-G154 WeakPolarHBondContact OH-CA 3.31Å; Y136-V156 HydrophobicContact CD2-CG2 4.44Å
137	M	95.6	Very high	93.3	Very high	100 Å²	100	48.8 Å²	48.8	49%	0.493	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-51.1	-170.6	-59.8	-60.2	-56.3	0	0	112.3	K135 V155 R157	K135-M137 HydrophobicContact CB-SD 3.91Å; K135-M137 PolarHBondContact O-N 2.88Å; M137-V155 HydrophobicContact CB-CB 4.22Å; M137-V155 HydrophobicContact CB-CG1 4.13Å; M137-V155 WeakPolarHBondContact CB-O 3.47Å; M137-V155 HydrophobicContact CG-CG1 4.39Å; M137-V155 PolarHBondContact N-O 2.89Å; M137-R157 HydrophobicContact CG-CB 3.84Å; M137-R157 HydrophobicContact SD-CB 3.82Å
138	K	94	Very high	92.7	Very high	125 Å²	125	52.9 Å²	52.9	54%	0.543	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	162.6	-179.3	61.9	177.6	-176.7	176.4	0	111.9	V155	K138-V155 HydrophobicContact CG-CB 4.17Å; K138-V155 HydrophobicContact CG-CG2 4.02Å; K138-V155 PolarHBondContact O-N 3.44Å
139	D	94.9	Very high	92.1	Very high	71 Å²	71	54.2 Å²	54.2	38%	0.38	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	148.9	166.7	-67	-11.2	0	0	0	111	K106 Y136 V153	K106-D139 IonicContact NZ-OD2 2.75Å; K106-D139 PolarHBondContact NZ-OD2 3.23Å; Y136-D139 WeakPolarHBondContact CE1-OD1 3.41Å; Y136-D139 VanDerWaalsContact CZ-OD1 3.22Å; Y136-D139 PolarHBondContact OH-OD1 2.69Å; D139-V153 CarbonylContact C-O 3.5Å; D139-V153 WeakPolarHBondContact CA-O 3.43Å
140	I	91.5	Very high	91.8	Very high	8 Å²	8	63.4 Å²	63.4	4%	0.041	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.2	166.9	-57.4	173.9	0	0	0	106.6	I7 T103 G142 A144 F145 V153 V155	I7-I140 HydrophobicContact CB-CD1 4.46Å; I7-I140 HydrophobicContact CD1-CD1 4.46Å; I7-I140 HydrophobicContact CD1-CG2 4.29Å; I7-I140 HydrophobicContact CG2-CD1 3.81Å; T103-I140 HydrophobicContact CG2-CD1 4.47Å; I140-G142 PolarHBondContact O-N 2.87Å; I140-A144 HydrophobicContact CG2-CB 3.74Å; I140-F145 HydrophobicContact CB-CE2 4.16Å; I140-F145 HydrophobicContact CB-CZ 4.33Å; I140-F145 HydrophobicContact CD1-CZ 4.41Å; I140-F145 HydrophobicContact CG2-CE2 3.56Å; I140-F145 HydrophobicContact CG2-CZ 3.88Å; I140-V153 HydrophobicContact CB-CB 4.3Å; I140-V153 PolarHBondContact N-O 3.12Å; I140-V153 PolarHBondContact O-N 3.01Å; I140-V155 HydrophobicContact CD1-CG2 3.48Å; I140-V155 VanDerWaalsContact CD1-CG2 3.48Å; I140-V155 HydrophobicContact CG1-CG2 3.96Å
141	P	92.3	Very high	91.5	Very high	72 Å²	72	66.5 Å²	66.5	47%	0.468	36%	0.359	S	S	.	.			trans	-55.3	138.6	176.1	-25.7	34.3	0	0	0	111.4	T143 A144 D152	P141-T143 PolarHBondContact O-N 3.37Å; P141-T143 VanDerWaalsContact O-N 3.1Å; P141-A144 VanDerWaalsContact O-CB 3.31Å; P141-A144 WeakPolarHBondContact O-CB 3.5Å; P141-A144 PolarHBondContact O-N 3.46Å; P141-D152 WeakPolarHBondContact CA-OD1 3.46Å
142	G	88.2	Confident	91.4	Very high	5 Å²	5	69.6 Å²	69.6	5%	0.052	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-56.3	-28.3	176.4	0	0	0	0	0	113	I140 A144 F145 P149 D152	I140-G142 PolarHBondContact O-N 2.87Å; G142-A144 PolarHBondContact O-N 2.97Å; G142-A144 VanDerWaalsContact O-N 3.11Å; G142-F145 PolarHBondContact O-N 3.46Å; G142-P149 WeakPolarHBondContact O-CD 3.32Å; G142-D152 PolarHBondContact N-OD1 3.38Å
143	T	88.5	Confident	91.1	Very high	124 Å²	124	69.5 Å²	69.5	76%	0.761	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-63.1	-14.7	175.8	54.2	0	0	0	0	114.5	P141 F145	P141-T143 PolarHBondContact O-N 3.37Å; P141-T143 VanDerWaalsContact O-N 3.1Å; T143-F145 VanDerWaalsContact C-N 3.28Å; T143-F145 PolarHBondContact O-N 2.88Å
144	A	87.1	Confident	91	Very high	24 Å²	24	66.6 Å²	66.6	20%	0.198	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-77.8	-9.7	178.1	0	0	0	0	0	114	Y8 I140 P141 G142	Y8-A144 WeakPolarHBondContact CD1-O 3.42Å; I140-A144 HydrophobicContact CG2-CB 3.74Å; P141-A144 VanDerWaalsContact O-CB 3.31Å; P141-A144 WeakPolarHBondContact O-CB 3.5Å; P141-A144 PolarHBondContact O-N 3.46Å; G142-A144 PolarHBondContact O-N 2.97Å; G142-A144 VanDerWaalsContact O-N 3.11Å
145	F	84.5	Confident	90.8	Very high	3 Å²	3	65.9 Å²	65.9	1%	0.013	36%	0.355	C	S	.	.	S	Bend	trans	-107	154.2	-176.6	-59.5	-93.7	0	0	0	111.9	I7 N69 I140 G142 T143 P147 P148 P149 V153	I7-F145 HydrophobicContact CB-CE1 4.42Å; I7-F145 WeakPolarHBondContact O-CD1 3.38Å; I7-F145 WeakPolarHBondContact O-CE1 3.39Å; N69-F145 WeakPolarHBondContact OD1-CE1 3.5Å; I140-F145 HydrophobicContact CB-CE2 4.16Å; I140-F145 HydrophobicContact CB-CZ 4.33Å; I140-F145 HydrophobicContact CD1-CZ 4.41Å; I140-F145 HydrophobicContact CG2-CE2 3.56Å; I140-F145 HydrophobicContact CG2-CZ 3.88Å; G142-F145 PolarHBondContact O-N 3.46Å; T143-F145 VanDerWaalsContact C-N 3.28Å; T143-F145 PolarHBondContact O-N 2.88Å; F145-P147 CarbonylContact O-C 3.57Å; F145-P148 VanDerWaalsContact O-CA 3.3Å; F145-P148 WeakPolarHBondContact O-CA 3.19Å; F145-P149 HydrophobicContact CD2-CG 4.31Å; F145-V153 HydrophobicContact CD2-CG2 3.97Å; F145-V153 HydrophobicContact CE2-CB 3.72Å; F145-V153 HydrophobicContact CE2-CG1 4.23Å; F145-V153 HydrophobicContact CE2-CG2 3.31Å; F145-V153 HydrophobicContact CZ-CB 3.85Å; F145-V153 HydrophobicContact CZ-CG1 3.82Å; F145-V153 HydrophobicContact CZ-CG2 3.68Å
146	V	81.4	Confident	90.8	Very high	114 Å²	114	61.3 Å²	61.3	69%	0.691	34%	0.335	S	S	*	.	S	Bend	trans	-126.4	118	176.2	-175.4	0	0	0	0	110
147	P	85	Confident	90.7	Very high	92 Å²	92	62.7 Å²	62.7	60%	0.597	34%	0.34	S	S	*	.	S	Bend	cis	-66.9	152.4	-9.7	30.5	-35	0	0	0	112	F145 P149	F145-P147 CarbonylContact O-C 3.57Å; P147-P149 WeakPolarHBondContact O-CD 3.36Å
148	P	84.3	Confident	90.8	Very high	90 Å²	90	58 Å²	58	58%	0.584	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-69.7	126.9	-178	27.2	-33.7	0	0	0	110.9	F145	F145-P148 VanDerWaalsContact O-CA 3.3Å; F145-P148 WeakPolarHBondContact O-CA 3.19Å
149	P	87.2	Confident	90.8	Very high	29 Å²	29	54.3 Å²	54.3	19%	0.188	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-66.7	161	170.3	28.9	-36.6	0	0	0	111.7	F72 G142 F145 P147 V151 V153	F72-P149 HydrophobicContact CE2-CB 3.86Å; F72-P149 HydrophobicContact CE2-CG 4.33Å; G142-P149 WeakPolarHBondContact O-CD 3.32Å; F145-P149 HydrophobicContact CD2-CG 4.31Å; P147-P149 WeakPolarHBondContact O-CD 3.36Å; P149-V151 WeakPolarHBondContact CG-O 3.41Å; P149-V151 PolarHBondContact O-N 3.16Å; P149-V153 HydrophobicContact CG-CG2 4.34Å
150	K	90.1	Very high	90.8	Very high	219 Å²	219	51.3 Å²	51.3	95%	0.952	29%	0.287	S	S	*	.	S	Bend	trans	-72.6	-11.3	177.2	-63.9	-176.5	178.8	-179.2	0	114.2
151	V	92.8	Very high	90.9	Very high	64 Å²	64	52.8 Å²	52.8	39%	0.388	30%	0.295	S	S	.	.	S	Bend	trans	-134.2	154.2	-173.3	-62.4	0	0	0	0	109.4	Q105 P149	Q105-V151 HydrophobicContact CB-CG2 4.1Å; Q105-V151 HydrophobicContact CG-CG2 3.83Å; P149-V151 WeakPolarHBondContact CG-O 3.41Å; P149-V151 PolarHBondContact O-N 3.16Å
152	D	94.8	Very high	90.8	Very high	71 Å²	71	59 Å²	59	38%	0.38	31%	0.314	S	S	.	.			trans	-67.5	163.3	172.4	-69.2	-26.5	0	0	0	111.7	K106 P141 G142	K106-D152 HydrophobicContact CB-CB 4.24Å; K106-D152 VanDerWaalsContact CB-O 3.3Å; K106-D152 WeakPolarHBondContact CB-O 3.42Å; K106-D152 HydrophobicContact CD-CB 4.08Å; K106-D152 PolarHBondContact N-O 3Å; P141-D152 WeakPolarHBondContact CA-OD1 3.46Å; G142-D152 PolarHBondContact N-OD1 3.38Å
153	V	92.8	Very high	91	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.5	-175.4	-179.7	0	0	0	0	109.2	F72 T103 F104 D139 I140 F145 P149	F72-V153 HydrophobicContact CE1-CG2 4.3Å; F72-V153 HydrophobicContact CZ-CG2 3.66Å; T103-V153 HydrophobicContact CG2-CG1 3.9Å; F104-V153 CarbonylContact O-C 3.38Å; F104-V153 VanDerWaalsContact O-CA 3.31Å; F104-V153 WeakPolarHBondContact O-CA 3.29Å; F104-V153 VanDerWaalsContact O-CG1 3.24Å; F104-V153 WeakPolarHBondContact O-CG1 3.23Å; D139-V153 CarbonylContact C-O 3.5Å; D139-V153 WeakPolarHBondContact CA-O 3.43Å; I140-V153 HydrophobicContact CB-CB 4.3Å; I140-V153 PolarHBondContact N-O 3.12Å; I140-V153 PolarHBondContact O-N 3.01Å; F145-V153 HydrophobicContact CD2-CG2 3.97Å; F145-V153 HydrophobicContact CE2-CB 3.72Å; F145-V153 HydrophobicContact CE2-CG1 4.23Å; F145-V153 HydrophobicContact CE2-CG2 3.31Å; F145-V153 HydrophobicContact CZ-CB 3.85Å; F145-V153 HydrophobicContact CZ-CG1 3.82Å; F145-V153 HydrophobicContact CZ-CG2 3.68Å; P149-V153 HydrophobicContact CG-CG2 4.34Å
154	G	94.1	Very high	91.4	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.1	171.5	0	0	0	0	0	111	T103 F104 Y136	T103-G154 WeakPolarHBondContact CA-O 3.47Å; F104-G154 PolarHBondContact N-O 2.82Å; F104-G154 PolarHBondContact O-N 3.46Å; Y136-G154 WeakPolarHBondContact OH-CA 3.31Å
155	V	94.5	Very high	91.9	Very high	7 Å²	7	63.8 Å²	63.8	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.9	170.2	-177.4	0	0	0	0	108.7	M5 T101 T103 M137 K138 I140	M5-V155 HydrophobicContact SD-CG1 4.33Å; T101-V155 HydrophobicContact CG2-CG1 3.81Å; T103-V155 HydrophobicContact CG2-CG2 4.21Å; M137-V155 HydrophobicContact CB-CB 4.22Å; M137-V155 HydrophobicContact CB-CG1 4.13Å; M137-V155 WeakPolarHBondContact CB-O 3.47Å; M137-V155 HydrophobicContact CG-CG1 4.39Å; M137-V155 PolarHBondContact N-O 2.89Å; K138-V155 HydrophobicContact CG-CB 4.17Å; K138-V155 HydrophobicContact CG-CG2 4.02Å; K138-V155 PolarHBondContact O-N 3.44Å; I140-V155 HydrophobicContact CD1-CG2 3.48Å; I140-V155 VanDerWaalsContact CD1-CG2 3.48Å; I140-V155 HydrophobicContact CG1-CG2 3.96Å
156	V	96.2	Very high	92.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.1	177.7	-177	0	0	0	0	110	T101 L102 F104 A109 L112 V134 K135 Y136 L158	T101-V156 WeakPolarHBondContact CA-O 3.35Å; L102-V156 PolarHBondContact N-O 2.71Å; L102-V156 PolarHBondContact O-N 3.42Å; F104-V156 HydrophobicContact CD2-CB 4.16Å; F104-V156 HydrophobicContact CD2-CG2 4.09Å; F104-V156 HydrophobicContact CE2-CB 4.16Å; A109-V156 HydrophobicContact CB-CG2 3.43Å; A109-V156 VanDerWaalsContact CB-CG2 3.43Å; L112-V156 HydrophobicContact CB-CG1 4.35Å; L112-V156 HydrophobicContact CD1-CG1 4.42Å; L112-V156 HydrophobicContact CD1-CG2 4.3Å; V134-V156 HydrophobicContact CG1-CG1 3.64Å; K135-V156 WeakPolarHBondContact O-CA 3.45Å; Y136-V156 HydrophobicContact CD2-CG2 4.44Å; V156-L158 HydrophobicContact CB-CD1 4.48Å; V156-L158 HydrophobicContact CG1-CD1 3.89Å; V156-L158 HydrophobicContact CG1-CG 4.24Å
157	R	95.7	Very high	93.2	Very high	98 Å²	98	62 Å²	62	37%	0.37	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.9	170.5	-172.4	175	-175.7	-157.1	0	109.7	L100 K135 M137 I159	L100-R157 CarbonylContact O-C 3.51Å; L100-R157 VanDerWaalsContact O-CA 3.25Å; L100-R157 WeakPolarHBondContact O-CA 3.37Å; L100-R157 WeakPolarHBondContact O-CG 3.44Å; K135-R157 PolarHBondContact N-O 3.45Å; K135-R157 PolarHBondContact O-N 3.29Å; M137-R157 HydrophobicContact CG-CB 3.84Å; M137-R157 HydrophobicContact SD-CB 3.82Å; R157-I159 HydrophobicContact CG-CG1 4.37Å
158	L	96.4	Very high	93.8	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.9	174.3	-59.2	95.6	0	0	0	109.2	I79 P99 L100 L112 C132 D133 V134 V156	I79-L158 HydrophobicContact CD1-CD1 4.31Å; I79-L158 HydrophobicContact CD1-CD2 4.01Å; P99-L158 CarbonylContact C-O 3.54Å; P99-L158 WeakPolarHBondContact CA-O 3.43Å; L100-L158 HydrophobicContact CB-CB 4.3Å; L100-L158 HydrophobicContact CB-CD1 4.41Å; L100-L158 HydrophobicContact CD1-CB 4.13Å; L100-L158 PolarHBondContact N-O 2.93Å; L100-L158 PolarHBondContact O-N 2.84Å; L112-L158 HydrophobicContact CD2-CD2 4.45Å; C132-L158 HydrophobicContact CB-CB 4.07Å; C132-L158 HydrophobicContact CB-CD2 4.28Å; D133-L158 WeakPolarHBondContact O-CA 3.42Å; V134-L158 HydrophobicContact CG1-CG 4.42Å; V134-L158 HydrophobicContact CG2-CD2 4.12Å; V134-L158 HydrophobicContact CG2-CG 4.4Å; V156-L158 HydrophobicContact CB-CD1 4.48Å; V156-L158 HydrophobicContact CG1-CD1 3.89Å; V156-L158 HydrophobicContact CG1-CG 4.24Å
159	I	94.2	Very high	94.5	Very high	49 Å²	49	56.8 Å²	56.8	25%	0.251	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	110.8	176.1	-54.7	175.5	0	0	0	107.5	P99 C132 D133 R157 L161	P99-I159 HydrophobicContact CB-CG1 4.24Å; C132-I159 CarbonylContact C-O 3.37Å; C132-I159 WeakPolarHBondContact CA-O 3.31Å; D133-I159 HydrophobicContact CB-CB 4.31Å; D133-I159 PolarHBondContact N-O 3.45Å; D133-I159 PolarHBondContact O-N 3.16Å; R157-I159 HydrophobicContact CG-CG1 4.37Å; I159-L161 PolarHBondContact O-N 3.19Å
160	P	95.6	Very high	95	Very high	7 Å²	7	55.9 Å²	55.9	5%	0.045	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	135.6	176.6	-29.2	36.5	0	0	0	112.2	I86 W93 V98 L100 Y131	I86-P160 HydrophobicContact CD1-CG 4.11Å; I86-P160 HydrophobicContact CG1-CG 4.31Å; I86-P160 HydrophobicContact CG2-CB 3.92Å; I86-P160 HydrophobicContact CG2-CG 4.29Å; W93-P160 HydrophobicContact CE3-CG 4.35Å; V98-P160 WeakPolarHBondContact O-CD 3.26Å; V98-P160 VanDerWaalsContact O-CG 3.3Å; V98-P160 WeakPolarHBondContact O-CG 3.39Å; L100-P160 HydrophobicContact CD1-CG 4.23Å; Y131-P160 WeakPolarHBondContact O-CA 3.26Å
161	L	94.1	Very high	95.3	Very high	40 Å²	40	47.7 Å²	47.7	21%	0.209	25%	0.247	C	C	.	.			trans	-78.7	141.3	178.1	-60.7	171.9	0	0	0	110.1	R89 Y131 D133 I159 Q163 L165	R89-L161 PolarHBondContact NH1-O 2.64Å; R89-L161 PolarHBondContact NH2-O 3.38Å; Y131-L161 PolarHBondContact O-N 3.2Å; D133-L161 HydrophobicContact CB-CD2 4.16Å; I159-L161 PolarHBondContact O-N 3.19Å; L161-Q163 VanDerWaalsContact CB-O 3.28Å; L161-Q163 WeakPolarHBondContact CB-O 3.24Å; L161-Q163 PolarHBondContact O-N 3.45Å; L161-L165 HydrophobicContact CD1-CD1 4.46Å; L161-L165 HydrophobicContact CD1-CD2 4.25Å; L161-L165 HydrophobicContact CD1-CG 3.73Å
162	K	89.8	Confident	95.6	Very high	201 Å²	201	47 Å²	47	87%	0.874	24%	0.237	S	C	*	.	S	Bend	trans	-61	-37.4	172.8	-70.4	-175.6	-179.9	179.5	0	111.8	R89	R89-K162 VanDerWaalsContact NH2-C 3.32Å; R89-K162 PolarHBondContact NH2-O 3.49Å
163	Q	92.1	Very high	95.8	Very high	147 Å²	147	43.6 Å²	43.6	69%	0.687	22%	0.219	S	C	*	.	S	Bend	trans	-125.8	123.9	169.4	-175.1	175.2	13	0	0	107.5	L161	L161-Q163 VanDerWaalsContact CB-O 3.28Å; L161-Q163 WeakPolarHBondContact CB-O 3.24Å; L161-Q163 PolarHBondContact O-N 3.45Å
164	P	95.7	Very high	96	Very high	29 Å²	29	46.1 Å²	46.1	19%	0.188	23%	0.231	C	C	.	.			trans	-54.9	144.3	172.9	-26.6	36	0	0	0	111.7	A130 Y131 I166	A130-P164 CarbonylContact O-C 3.54Å; A130-P164 WeakPolarHBondContact O-CA 3.48Å; Y131-P164 HydrophobicContact CD1-CB 3.83Å; Y131-P164 HydrophobicContact CD1-CG 4.11Å; Y131-P164 HydrophobicContact CE1-CB 4.15Å; P164-I166 PolarHBondContact O-N 2.92Å
165	L	97.6	Very high	96.2	Very high	79 Å²	79	47 Å²	47	41%	0.414	24%	0.235	S	C	.	.	S	Bend	trans	-64.7	-29.2	170.8	-65.1	-174.9	0	0	0	111.3	Q129 A130 L161 P167 M224 R228	Q129-L165 WeakPolarHBondContact O-CD1 3.37Å; A130-L165 PolarHBondContact O-N 3.1Å; L161-L165 HydrophobicContact CD1-CD1 4.46Å; L161-L165 HydrophobicContact CD1-CD2 4.25Å; L161-L165 HydrophobicContact CD1-CG 3.73Å; L165-P167 WeakPolarHBondContact O-CD 3.35Å; L165-M224 HydrophobicContact CD1-CB 4.01Å; L165-M224 HydrophobicContact CD1-CE 4.44Å; L165-M224 HydrophobicContact CD1-CG 4.11Å; L165-R228 WeakPolarHBondContact O-CD 3.3Å; L165-R228 WeakPolarHBondContact O-CG 3.17Å
166	I	98	Very high	96.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-116.8	89.7	174.9	-52.3	-177.9	0	0	0	108.6	V126 A130 P164 V168 V173 M224 F227 R228 C231	V126-I166 HydrophobicContact CG1-CD1 4.48Å; A130-I166 HydrophobicContact CB-CB 4.25Å; A130-I166 HydrophobicContact CB-CD1 3.96Å; A130-I166 HydrophobicContact CB-CG1 4.04Å; P164-I166 PolarHBondContact O-N 2.92Å; I166-V168 HydrophobicContact CG2-CB 4.1Å; I166-V168 HydrophobicContact CG2-CG2 4.16Å; I166-V168 PolarHBondContact O-N 3.05Å; I166-V173 HydrophobicContact CD1-CG1 4.17Å; I166-V173 HydrophobicContact CG2-CG1 4.09Å; I166-V173 HydrophobicContact CG2-CG2 3.58Å; I166-M224 HydrophobicContact CD1-CE 3.97Å; I166-M224 HydrophobicContact CG1-CE 4.3Å; I166-F227 HydrophobicContact CD1-CB 3.82Å; I166-R228 HydrophobicContact CG1-CB 4.01Å; I166-C231 HydrophobicContact CG2-CB 3.79Å
167	P	96.2	Very high	96.5	Very high	79 Å²	79	46.6 Å²	46.6	51%	0.513	23%	0.233	S	C	.	.			trans	-82.6	54.7	-178.9	35.8	-36.5	0	0	0	111.5	L165	L165-P167 WeakPolarHBondContact O-CD 3.35Å
168	V	98.1	Very high	96.6	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.067	24%	0.237	C	C	.	.	S	Bend	trans	-119	145.6	176.8	173.4	0	0	0	0	107.6	I166 Y170 V173 C231 F232 H235	I166-V168 HydrophobicContact CG2-CB 4.1Å; I166-V168 HydrophobicContact CG2-CG2 4.16Å; I166-V168 PolarHBondContact O-N 3.05Å; V168-Y170 PolarHBondContact O-N 2.69Å; V168-V173 HydrophobicContact CB-CG2 3.68Å; V168-V173 HydrophobicContact CG1-CG2 3.94Å; V168-V173 WeakPolarHBondContact O-CG2 3.27Å; V168-C231 HydrophobicContact CB-CB 4.25Å; V168-C231 HydrophobicContact CG1-CB 4.3Å; V168-C231 HydrophobicContact CG2-CB 4.01Å; V168-F232 HydrophobicContact CG2-CB 4.3Å; V168-H235 HydrophobicContact CG1-CB 3.67Å
169	P	97.5	Very high	96.7	Very high	61 Å²	61	48.4 Å²	48.4	40%	0.396	24%	0.24	S	C	.	.			trans	-56.7	136.4	-177.6	-21.7	31.4	0	0	0	111.9	P171 Y172 V173	P169-P171 VanDerWaalsContact C-CD 3.43Å; P169-P171 VanDerWaalsContact O-N 3.15Å; P169-Y172 HydrophobicContact CB-CD2 3.91Å; P169-Y172 HydrophobicContact CB-CE2 4.21Å; P169-Y172 HydrophobicContact CG-CD2 4.29Å; P169-Y172 HydrophobicContact CG-CE2 4.45Å; P169-Y172 PolarHBondContact O-N 3.29Å; P169-V173 PolarHBondContact O-N 3.15Å
170	Y	98	Very high	96.9	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.039	23%	0.228	C	C	.	.	H	α-helix	trans	-49.2	-44.8	-166.8	178	-85.8	0	0	0	114.6	H84 A87 M127 Y131 V168 Y172 V173 E174	H84-Y170 HydrophobicContact CB-CD1 4.15Å; H84-Y170 HydrophobicContact CB-CD2 4.31Å; H84-Y170 HydrophobicContact CB-CE1 3.84Å; H84-Y170 HydrophobicContact CB-CE2 3.98Å; H84-Y170 HydrophobicContact CB-CG 4.4Å; H84-Y170 AromaticContact CD2-CD1 3.34Å; H84-Y170 WeakPolarHBondContact CD2-CD1 3.48Å; H84-Y170 AromaticContact CD2-CE1 3.9Å; H84-Y170 AromaticContact CD2-CG 3.5Å; H84-Y170 AromaticContact CG-CD1 3.69Å; H84-Y170 AromaticContact CG-CE1 3.75Å; H84-Y170 AromaticContact NE2-CD1 3.76Å; A87-Y170 HydrophobicContact CB-CD2 3.66Å; A87-Y170 HydrophobicContact CB-CG 4.28Å; M127-Y170 HydrophobicContact CE-CD2 3.96Å; M127-Y170 HydrophobicContact CE-CE1 4.44Å; M127-Y170 HydrophobicContact CE-CE2 3.27Å; Y131-Y170 AromaticContact CE2-CD2 3.81Å; Y131-Y170 HydrophobicContact CE2-CD2 3.81Å; Y131-Y170 HydrophobicContact CE2-CE2 4.01Å; Y131-Y170 AromaticContact CZ-CD2 3.89Å; V168-Y170 PolarHBondContact O-N 2.69Å; Y170-Y172 VanDerWaalsContact C-N 3.28Å; Y170-Y172 PolarHBondContact O-N 3.29Å; Y170-V173 PolarHBondContact O-N 3.41Å; Y170-E174 HydrophobicContact CD1-CB 4.38Å; Y170-E174 HydrophobicContact CE1-CB 3.97Å; Y170-E174 HydrophobicContact CE1-CG 4.34Å; Y170-E174 WeakPolarHBondContact O-CB 3.47Å; Y170-E174 PolarHBondContact O-N 3.18Å; Y170-E174 PolarHBondContact OH-OE1 2.86Å
171	P	97.7	Very high	97	Very high	48 Å²	48	46.7 Å²	46.7	31%	0.312	23%	0.23	S	C	.	.	H	α-helix	trans	-60.1	-33.3	-178.3	-25.9	36.1	0	0	0	114.3	P169 K175 F245	P169-P171 VanDerWaalsContact C-CD 3.43Å; P169-P171 VanDerWaalsContact O-N 3.15Å; P171-K175 VanDerWaalsContact O-CB 3.31Å; P171-K175 WeakPolarHBondContact O-CB 3.38Å; P171-K175 PolarHBondContact O-N 2.93Å; P171-F245 HydrophobicContact CB-CE2 4.22Å; P171-F245 HydrophobicContact CB-CZ 3.76Å
172	Y	98.4	Very high	97	Very high	48 Å²	48	49.2 Å²	49.2	19%	0.188	24%	0.24	C	C	.	.	H	α-helix	trans	-72.8	-43	178.2	-61.9	-89.9	0	0	0	111.3	P169 Y170 K175 L176 Y234 H235 C238 F245	P169-Y172 HydrophobicContact CB-CD2 3.91Å; P169-Y172 HydrophobicContact CB-CE2 4.21Å; P169-Y172 HydrophobicContact CG-CD2 4.29Å; P169-Y172 HydrophobicContact CG-CE2 4.45Å; P169-Y172 PolarHBondContact O-N 3.29Å; Y170-Y172 VanDerWaalsContact C-N 3.28Å; Y170-Y172 PolarHBondContact O-N 3.29Å; Y172-K175 PolarHBondContact O-N 2.99Å; Y172-L176 WeakPolarHBondContact O-CB 3.41Å; Y172-L176 PolarHBondContact O-N 3.44Å; Y172-Y234 HydrophobicContact CD1-CD1 4.39Å; Y172-Y234 HydrophobicContact CD1-CE1 4.13Å; Y172-H235 HydrophobicContact CD1-CB 4.41Å; Y172-H235 AromaticContact CD1-ND1 3.61Å; Y172-H235 AromaticContact CD2-CE1 3.87Å; Y172-H235 AromaticContact CD2-ND1 3.31Å; Y172-H235 VanDerWaalsContact CD2-ND1 3.31Å; Y172-H235 WeakPolarHBondContact CD2-ND1 3.45Å; Y172-H235 AromaticContact CE1-ND1 3.59Å; Y172-H235 AromaticContact CE2-CE1 3.49Å; Y172-H235 VanDerWaalsContact CE2-CE1 3.49Å; Y172-H235 WeakPolarHBondContact CE2-CE1 3.27Å; Y172-H235 AromaticContact CE2-ND1 3.28Å; Y172-H235 VanDerWaalsContact CE2-ND1 3.28Å; Y172-H235 WeakPolarHBondContact CE2-ND1 3.47Å; Y172-H235 HydrophobicContact CG-CB 4.36Å; Y172-H235 AromaticContact CG-ND1 3.48Å; Y172-H235 AromaticContact CZ-CE1 3.77Å; Y172-H235 AromaticContact CZ-ND1 3.43Å; Y172-C238 HydrophobicContact CD1-CB 4.15Å; Y172-C238 HydrophobicContact CE1-CB 3.56Å; Y172-F245 AromaticContact CD1-CD2 3.46Å; Y172-F245 HydrophobicContact CD1-CD2 3.46Å; Y172-F245 VanDerWaalsContact CD1-CD2 3.46Å; Y172-F245 AromaticContact CD1-CE2 3.79Å; Y172-F245 HydrophobicContact CD1-CE2 3.79Å; Y172-F245 HydrophobicContact CD1-CG 4.39Å; Y172-F245 HydrophobicContact CE1-CB 4.15Å; Y172-F245 AromaticContact CE1-CD2 3.32Å; Y172-F245 HydrophobicContact CE1-CD2 3.32Å; Y172-F245 AromaticContact CE1-CE2 3.9Å; Y172-F245 HydrophobicContact CE1-CE2 3.9Å; Y172-F245 AromaticContact CE1-CG 3.83Å; Y172-F245 HydrophobicContact CE1-CG 3.83Å; Y172-F245 HydrophobicContact CG-CD2 4.26Å; Y172-F245 HydrophobicContact CG-CE2 4.14Å
173	V	98.6	Very high	97.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-48.7	175.6	-176	0	0	0	0	109.7	M127 I166 V168 P169 Y170 K175 L176 V177 C231	M127-V173 HydrophobicContact SD-CG1 4.02Å; I166-V173 HydrophobicContact CD1-CG1 4.17Å; I166-V173 HydrophobicContact CG2-CG1 4.09Å; I166-V173 HydrophobicContact CG2-CG2 3.58Å; V168-V173 HydrophobicContact CB-CG2 3.68Å; V168-V173 HydrophobicContact CG1-CG2 3.94Å; V168-V173 WeakPolarHBondContact O-CG2 3.27Å; P169-V173 PolarHBondContact O-N 3.15Å; Y170-V173 PolarHBondContact O-N 3.41Å; V173-K175 PolarHBondContact O-N 3.23Å; V173-L176 PolarHBondContact O-N 3.13Å; V173-V177 HydrophobicContact CG1-CG2 4.15Å; V173-V177 WeakPolarHBondContact O-CB 3.46Å; V173-V177 VanDerWaalsContact O-CG2 3.24Å; V173-V177 WeakPolarHBondContact O-CG2 3.31Å; V173-V177 PolarHBondContact O-N 3.29Å; V173-C231 HydrophobicContact CG2-CB 4.34Å
174	E	98.2	Very high	97.3	Very high	54 Å²	54	40.9 Å²	40.9	25%	0.252	20%	0.199	S	C	.	.	H	α-helix	trans	-60.5	-46.3	179.6	-179.1	172.1	-121	0	0	112	R123 M127 Y170 R178	R123-E174 IonicContact CZ-OE1 3.45Å; R123-E174 IonicContact NH2-OE1 2.72Å; R123-E174 PolarHBondContact NH2-OE1 3.47Å; M127-E174 HydrophobicContact CE-CB 3.86Å; M127-E174 HydrophobicContact CE-CG 4.38Å; Y170-E174 HydrophobicContact CD1-CB 4.38Å; Y170-E174 HydrophobicContact CE1-CB 3.97Å; Y170-E174 HydrophobicContact CE1-CG 4.34Å; Y170-E174 WeakPolarHBondContact O-CB 3.47Å; Y170-E174 PolarHBondContact O-N 3.18Å; Y170-E174 PolarHBondContact OH-OE1 2.86Å; E174-R178 WeakPolarHBondContact O-CB 3.34Å; E174-R178 PolarHBondContact O-N 3.06Å
175	K	98.2	Very high	97.2	Very high	17 Å²	17	47.8 Å²	47.8	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-47.3	178.8	-175.3	174.4	176.1	-174.4	0	111.2	P171 Y172 V173 R178 Q179 L195 Y234 V244 F245 F247	P171-K175 VanDerWaalsContact O-CB 3.31Å; P171-K175 WeakPolarHBondContact O-CB 3.38Å; P171-K175 PolarHBondContact O-N 2.93Å; Y172-K175 PolarHBondContact O-N 2.99Å; V173-K175 PolarHBondContact O-N 3.23Å; K175-R178 PolarHBondContact O-N 2.95Å; K175-Q179 WeakPolarHBondContact O-CG 3.43Å; K175-Q179 PolarHBondContact O-N 3.28Å; K175-Q179 VanDerWaalsContact O-N 3.12Å; K175-L195 HydrophobicContact CD-CD2 4.38Å; K175-L195 HydrophobicContact CG-CD2 3.94Å; K175-Y234 WeakPolarHBondContact CD-OH 3.11Å; K175-Y234 WeakPolarHBondContact CE-OH 3.41Å; K175-Y234 PolarHBondContact NZ-OH 2.6Å; K175-V244 PolarHBondContact NZ-O 3.28Å; K175-V244 VanDerWaalsContact NZ-O 3.16Å; K175-F245 HydrophobicContact CD-CD2 4.27Å; K175-F245 HydrophobicContact CD-CE2 4.21Å; K175-F245 VanDerWaalsContact NZ-C 3.32Å; K175-F245 PolarHBondContact NZ-O 2.94Å; K175-F247 PolarHBondContact NZ-O 3.4Å
176	L	98.7	Very high	97.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-50.6	-179.8	-174.1	149.1	0	0	0	111.8	Y172 V173 R178 Q179 A180 L192 L195 F227 L230 Y234	Y172-L176 WeakPolarHBondContact O-CB 3.41Å; Y172-L176 PolarHBondContact O-N 3.44Å; V173-L176 PolarHBondContact O-N 3.13Å; L176-R178 VanDerWaalsContact C-N 3.29Å; L176-R178 PolarHBondContact O-N 3.16Å; L176-Q179 PolarHBondContact O-N 2.9Å; L176-Q179 VanDerWaalsContact O-N 3.16Å; L176-A180 WeakPolarHBondContact O-CB 3.34Å; L176-A180 PolarHBondContact O-N 2.9Å; L176-L192 HydrophobicContact CD2-CD2 4.25Å; L176-L192 HydrophobicContact CG-CD2 4.09Å; L176-L195 HydrophobicContact CB-CD1 4.37Å; L176-L195 HydrophobicContact CD1-CD1 4.23Å; L176-L195 HydrophobicContact CG-CD1 4.04Å; L176-F227 HydrophobicContact CD2-CD1 4.08Å; L176-F227 HydrophobicContact CD2-CE1 4.4Å; L176-L230 HydrophobicContact CD1-CB 4.03Å; L176-L230 HydrophobicContact CD2-CB 4.4Å; L176-Y234 HydrophobicContact CB-CD1 4.3Å; L176-Y234 HydrophobicContact CD1-CD1 4.25Å; L176-Y234 HydrophobicContact CD1-CG 4.06Å
177	V	98.3	Very high	97.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-38.2	-179.5	176.4	0	0	0	0	110.5	R123 V126 M127 V173 Q179 A180 F181 F227	R123-V177 HydrophobicContact CB-CG1 4.13Å; R123-V177 HydrophobicContact CG-CG1 3.93Å; V126-V177 HydrophobicContact CB-CG1 3.89Å; V126-V177 HydrophobicContact CB-CG2 4.48Å; V126-V177 HydrophobicContact CG1-CG1 4.04Å; V126-V177 HydrophobicContact CG1-CG2 3.71Å; M127-V177 HydrophobicContact CG-CG1 4.29Å; M127-V177 HydrophobicContact SD-CB 4.1Å; M127-V177 HydrophobicContact SD-CG1 4.3Å; M127-V177 HydrophobicContact SD-CG2 4.17Å; V173-V177 HydrophobicContact CG1-CG2 4.15Å; V173-V177 WeakPolarHBondContact O-CB 3.46Å; V173-V177 VanDerWaalsContact O-CG2 3.24Å; V173-V177 WeakPolarHBondContact O-CG2 3.31Å; V173-V177 PolarHBondContact O-N 3.29Å; V177-Q179 PolarHBondContact O-N 3.45Å; V177-A180 PolarHBondContact O-N 3.13Å; V177-F181 HydrophobicContact CG1-CD2 3.89Å; V177-F181 HydrophobicContact CG1-CE2 4.07Å; V177-F181 WeakPolarHBondContact O-CD2 3.47Å; V177-F181 PolarHBondContact O-N 3.32Å; V177-F181 VanDerWaalsContact O-N 3.13Å; V177-F227 HydrophobicContact CG2-CD1 4.13Å; V177-F227 HydrophobicContact CG2-CE1 4.36Å
178	R	97.8	Very high	97.2	Very high	124 Å²	124	49.9 Å²	49.9	47%	0.468	23%	0.228	S	C	.	.	H	α-helix	trans	-57.5	-47.1	173.6	177	174.3	60.9	154.7	-2.1	111.8	E174 K175 L176 H182	E174-R178 WeakPolarHBondContact O-CB 3.34Å; E174-R178 PolarHBondContact O-N 3.06Å; K175-R178 PolarHBondContact O-N 2.95Å; L176-R178 VanDerWaalsContact C-N 3.29Å; L176-R178 PolarHBondContact O-N 3.16Å; R178-H182 PolarHBondContact O-N 3.16Å; R178-H182 VanDerWaalsContact O-N 3.16Å
179	Q	97.9	Very high	97.2	Very high	13 Å²	13	49.4 Å²	49.4	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-69.4	-38.5	178.4	-65.4	-53.8	-26	0	0	112.3	K175 L176 V177 F181 H182 T194 L195	K175-Q179 WeakPolarHBondContact O-CG 3.43Å; K175-Q179 PolarHBondContact O-N 3.28Å; K175-Q179 VanDerWaalsContact O-N 3.12Å; L176-Q179 PolarHBondContact O-N 2.9Å; L176-Q179 VanDerWaalsContact O-N 3.16Å; V177-Q179 PolarHBondContact O-N 3.45Å; Q179-F181 VanDerWaalsContact C-N 3.28Å; Q179-F181 PolarHBondContact O-N 3.41Å; Q179-H182 WeakPolarHBondContact O-CB 3.46Å; Q179-H182 PolarHBondContact O-N 3.16Å; Q179-H182 VanDerWaalsContact O-N 3.16Å; Q179-T194 WeakPolarHBondContact CG-OG1 3.28Å; Q179-T194 PolarHBondContact OE1-OG1 2.73Å; Q179-L195 HydrophobicContact CB-CD2 4.06Å; Q179-L195 HydrophobicContact CB-CG 4.15Å; Q179-L195 HydrophobicContact CG-CD2 3.55Å; Q179-L195 HydrophobicContact CG-CG 4.06Å
180	A	98	Very high	97.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.1	-42.5	176.5	0	0	0	0	0	112.5	L176 V177 I188 L192 C219 F227	L176-A180 WeakPolarHBondContact O-CB 3.34Å; L176-A180 PolarHBondContact O-N 2.9Å; V177-A180 PolarHBondContact O-N 3.13Å; A180-I188 HydrophobicContact CB-CD1 3.78Å; A180-L192 HydrophobicContact CB-CD2 4.03Å; A180-C219 HydrophobicContact CB-CB 4.5Å; A180-C219 VanDerWaalsContact O-CB 3.3Å; A180-C219 WeakPolarHBondContact O-CB 3.45Å; A180-F227 HydrophobicContact CB-CE1 3.83Å; A180-F227 HydrophobicContact CB-CZ 4.35Å
181	F	97.7	Very high	97.2	Very high	20 Å²	20	49 Å²	49	9%	0.088	22%	0.216	C	C	.	.	H	α-helix	trans	-91.5	-3.3	-179.1	-76.9	-87.3	0	0	0	114.6	R121 S122 R123 V126 V177 Q179 F183 R184 C219 I220 F227	R121-F181 HydrophobicContact CG-CE1 4.42Å; R121-F181 HydrophobicContact CG-CZ 4.24Å; R121-F181 WeakPolarHBondContact O-CE1 3.42Å; S122-F181 VanDerWaalsContact C-CE1 3.47Å; S122-F181 WeakPolarHBondContact O-CZ 3.37Å; R123-F181 HydrophobicContact CB-CB 4.41Å; R123-F181 HydrophobicContact CB-CD2 4.36Å; R123-F181 HydrophobicContact CB-CG 4.47Å; V126-F181 HydrophobicContact CB-CE2 4.38Å; V126-F181 HydrophobicContact CG2-CE2 3.61Å; V126-F181 HydrophobicContact CG2-CZ 3.81Å; V177-F181 HydrophobicContact CG1-CD2 3.89Å; V177-F181 HydrophobicContact CG1-CE2 4.07Å; V177-F181 WeakPolarHBondContact O-CD2 3.47Å; V177-F181 PolarHBondContact O-N 3.32Å; V177-F181 VanDerWaalsContact O-N 3.13Å; Q179-F181 VanDerWaalsContact C-N 3.28Å; Q179-F181 PolarHBondContact O-N 3.41Å; F181-F183 VanDerWaalsContact C-N 3.29Å; F181-F183 PolarHBondContact O-N 3.28Å; F181-R184 HydrophobicContact CD1-CG 4.39Å; F181-R184 VanDerWaalsContact O-CG 3.28Å; F181-R184 WeakPolarHBondContact O-CG 3.47Å; F181-C219 HydrophobicContact CD1-CB 4.21Å; F181-C219 WeakPolarHBondContact CD1-SG 3.48Å; F181-C219 HydrophobicContact CD2-CB 4.49Å; F181-C219 HydrophobicContact CE1-CB 4.12Å; F181-C219 VanDerWaalsContact CE1-SG 3.57Å; F181-C219 HydrophobicContact CE2-CB 4.41Å; F181-C219 HydrophobicContact CG-CB 4.39Å; F181-C219 HydrophobicContact CZ-CB 4.23Å; F181-I220 HydrophobicContact CE1-CG2 4.3Å; F181-F227 HydrophobicContact CE2-CE1 4.44Å; F181-F227 HydrophobicContact CE2-CE2 4.41Å; F181-F227 AromaticContact CE2-CZ 3.74Å; F181-F227 HydrophobicContact CE2-CZ 3.74Å; F181-F227 HydrophobicContact CZ-CZ 4.31Å
182	H	95.4	Very high	97.2	Very high	92 Å²	92	46.8 Å²	46.8	43%	0.426	20%	0.201	S	C	.	.	H	α-helix	trans	-63.6	-36.9	179.2	-164.3	91.2	0	0	0	111.8	R178 Q179	R178-H182 PolarHBondContact O-N 3.16Å; R178-H182 VanDerWaalsContact O-N 3.16Å; Q179-H182 WeakPolarHBondContact O-CB 3.46Å; Q179-H182 PolarHBondContact O-N 3.16Å; Q179-H182 VanDerWaalsContact O-N 3.16Å
183	F	93.9	Very high	97.2	Very high	73 Å²	73	44.9 Å²	44.9	32%	0.32	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	65	177.5	-58.6	-65.2	0	0	0	111.8	F181 Q185 K186 C191 T194	F181-F183 VanDerWaalsContact C-N 3.29Å; F181-F183 PolarHBondContact O-N 3.28Å; F183-Q185 VanDerWaalsContact C-N 3.27Å; F183-Q185 PolarHBondContact O-N 3.31Å; F183-K186 HydrophobicContact CB-CB 4.03Å; F183-K186 HydrophobicContact CB-CG 3.82Å; F183-K186 WeakPolarHBondContact O-CB 3.09Å; F183-K186 PolarHBondContact O-N 2.88Å; F183-C191 PolarHBondContact O-SG 3.2Å; F183-T194 HydrophobicContact CE2-CG2 3.93Å
184	R	92.5	Very high	97.1	Very high	101 Å²	101	45 Å²	45	38%	0.381	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.9	-42.6	-169.8	-63.3	-178.4	70.5	-162.6	2	115.9	E119 R121 F181 K186	E119-R184 PolarHBondContact O-NH2 3.02Å; R121-R184 PolarHBondContact O-NH2 3.11Å; F181-R184 HydrophobicContact CD1-CG 4.39Å; F181-R184 VanDerWaalsContact O-CG 3.28Å; F181-R184 WeakPolarHBondContact O-CG 3.47Å; R184-K186 VanDerWaalsContact C-N 3.34Å
185	Q	94.3	Very high	97.1	Very high	173 Å²	173	42.4 Å²	42.4	81%	0.808	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-2.8	-175.8	-64.5	179.2	-13.4	0	0	114	F183	F183-Q185 VanDerWaalsContact C-N 3.27Å; F183-Q185 PolarHBondContact O-N 3.31Å
186	K	96.9	Very high	97	Very high	125 Å²	125	41.7 Å²	41.7	54%	0.543	18%	0.179	S	C	.	.	S	Bend	trans	-92.3	157.8	178.6	-59.2	-58.2	-177.9	-171	0	110.4	F183 R184 R190	F183-K186 HydrophobicContact CB-CB 4.03Å; F183-K186 HydrophobicContact CB-CG 3.82Å; F183-K186 WeakPolarHBondContact O-CB 3.09Å; F183-K186 PolarHBondContact O-N 2.88Å; R184-K186 VanDerWaalsContact C-N 3.34Å; K186-R190 HydrophobicContact CB-CB 4.21Å
187	Q	97.6	Very high	96.9	Very high	78 Å²	78	42.5 Å²	42.5	36%	0.364	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-60.7	142.4	171	-60.1	-177.6	-58.8	0	0	109.6	V189 R190 C191 K217	Q187-V189 HydrophobicContact CB-CG1 4.18Å; Q187-V189 PolarHBondContact O-N 2.69Å; Q187-V189 VanDerWaalsContact O-N 3.12Å; Q187-R190 WeakPolarHBondContact O-CA 3.09Å; Q187-R190 WeakPolarHBondContact O-CB 3.33Å; Q187-R190 PolarHBondContact O-N 3.41Å; Q187-C191 PolarHBondContact O-N 3.17Å; Q187-K217 CarbonylContact C-O 3.42Å; Q187-K217 WeakPolarHBondContact CA-O 3.44Å
188	I	98.1	Very high	96.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-31	-172.1	-170.9	66.1	0	0	0	111.7	A180 R190 C191 L192 F208 Q214 P215 K217 C219 L222	A180-I188 HydrophobicContact CB-CD1 3.78Å; I188-R190 VanDerWaalsContact C-N 3.26Å; I188-R190 PolarHBondContact O-N 3.18Å; I188-C191 HydrophobicContact CD1-CB 4.27Å; I188-C191 WeakPolarHBondContact O-CB 3.18Å; I188-C191 PolarHBondContact O-N 2.99Å; I188-C191 VanDerWaalsContact O-N 3.09Å; I188-L192 HydrophobicContact CD1-CD1 4.14Å; I188-L192 HydrophobicContact CD1-CD2 4.4Å; I188-L192 HydrophobicContact CD1-CG 3.99Å; I188-L192 HydrophobicContact CG1-CD1 3.82Å; I188-L192 HydrophobicContact CG1-CG 3.99Å; I188-L192 WeakPolarHBondContact O-CG 3.43Å; I188-L192 PolarHBondContact O-N 3.23Å; I188-F208 HydrophobicContact CB-CZ 4.41Å; I188-F208 HydrophobicContact CG1-CE1 4.33Å; I188-F208 HydrophobicContact CG1-CZ 4.18Å; I188-F208 HydrophobicContact CG2-CE1 3.58Å; I188-F208 HydrophobicContact CG2-CZ 3.79Å; I188-Q214 WeakPolarHBondContact CG2-O 3.44Å; I188-P215 WeakPolarHBondContact CG2-O 3.3Å; I188-K217 VanDerWaalsContact CB-O 3.31Å; I188-K217 WeakPolarHBondContact CB-O 3.25Å; I188-K217 HydrophobicContact CG2-CB 4.43Å; I188-K217 WeakPolarHBondContact CG2-O 3.27Å; I188-K217 PolarHBondContact N-O 2.85Å; I188-C219 HydrophobicContact CD1-CB 4.32Å; I188-L222 HydrophobicContact CB-CD1 4.2Å; I188-L222 HydrophobicContact CD1-CD2 4.02Å; I188-L222 HydrophobicContact CG1-CD1 4.18Å; I188-L222 HydrophobicContact CG1-CD2 3.85Å; I188-L222 HydrophobicContact CG2-CD1 4.3Å
189	V	97.6	Very high	96.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-36.1	172.6	68.3	0	0	0	0	112.9	Q187 E193 V204 F208 P215 L275 A277 V280	Q187-V189 HydrophobicContact CB-CG1 4.18Å; Q187-V189 PolarHBondContact O-N 2.69Å; Q187-V189 VanDerWaalsContact O-N 3.12Å; V189-E193 WeakPolarHBondContact O-CB 3.2Å; V189-E193 PolarHBondContact O-N 3.28Å; V189-V204 HydrophobicContact CG2-CG1 4.01Å; V189-F208 HydrophobicContact CB-CE2 3.89Å; V189-F208 HydrophobicContact CB-CZ 4.13Å; V189-F208 HydrophobicContact CG2-CD2 4.28Å; V189-F208 HydrophobicContact CG2-CE2 3.9Å; V189-P215 HydrophobicContact CB-CB 3.8Å; V189-P215 HydrophobicContact CG1-CB 4.32Å; V189-P215 WeakPolarHBondContact CG1-O 3.46Å; V189-P215 HydrophobicContact CG2-CB 4.3Å; V189-P215 PolarHBondContact N-O 3.38Å; V189-L275 HydrophobicContact CG2-CD2 4.39Å; V189-L275 HydrophobicContact CG2-CG 4.39Å; V189-A277 HydrophobicContact CG1-CB 4.01Å; V189-V280 HydrophobicContact CG2-CG2 3.94Å
190	R	97	Very high	96.5	Very high	64 Å²	64	42.4 Å²	42.4	24%	0.242	19%	0.19	C	C	.	.	H	α-helix	trans	-77.3	-25.8	176.4	-60	-56.4	-173.1	-170.5	-4.1	112.7	K186 Q187 I188 E193 L275	K186-R190 HydrophobicContact CB-CB 4.21Å; Q187-R190 WeakPolarHBondContact O-CA 3.09Å; Q187-R190 WeakPolarHBondContact O-CB 3.33Å; Q187-R190 PolarHBondContact O-N 3.41Å; I188-R190 VanDerWaalsContact C-N 3.26Å; I188-R190 PolarHBondContact O-N 3.18Å; R190-E193 IonicContact CZ-OE2 3.36Å; R190-E193 IonicContact NH1-OE2 2.69Å; R190-E193 PolarHBondContact NH1-OE2 3.02Å; R190-E193 WeakPolarHBondContact O-CG 3.22Å; R190-L275 PolarHBondContact NH1-O 2.85Å; R190-L275 PolarHBondContact NH2-O 3.41Å
191	C	97.8	Very high	96.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-75.3	-43.9	173.3	-54.8	0	0	0	0	110.5	F183 Q187 I188 T194	F183-C191 PolarHBondContact O-SG 3.2Å; Q187-C191 PolarHBondContact O-N 3.17Å; I188-C191 HydrophobicContact CD1-CB 4.27Å; I188-C191 WeakPolarHBondContact O-CB 3.18Å; I188-C191 PolarHBondContact O-N 2.99Å; I188-C191 VanDerWaalsContact O-N 3.09Å; C191-T194 PolarHBondContact O-OG1 2.87Å
192	L	98.3	Very high	96.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-86.3	-13.7	-175.1	-59.3	-174.7	0	0	0	113.8	L176 A180 I188 T194 L195 L207 F208 L230	L176-L192 HydrophobicContact CD2-CD2 4.25Å; L176-L192 HydrophobicContact CG-CD2 4.09Å; A180-L192 HydrophobicContact CB-CD2 4.03Å; I188-L192 HydrophobicContact CD1-CD1 4.14Å; I188-L192 HydrophobicContact CD1-CD2 4.4Å; I188-L192 HydrophobicContact CD1-CG 3.99Å; I188-L192 HydrophobicContact CG1-CD1 3.82Å; I188-L192 HydrophobicContact CG1-CG 3.99Å; I188-L192 WeakPolarHBondContact O-CG 3.43Å; I188-L192 PolarHBondContact O-N 3.23Å; L192-T194 PolarHBondContact O-N 3.19Å; L192-T194 VanDerWaalsContact O-N 3.15Å; L192-L195 HydrophobicContact CB-CD1 4.32Å; L192-L195 HydrophobicContact CD2-CD1 3.87Å; L192-L195 WeakPolarHBondContact O-CB 3.26Å; L192-L195 PolarHBondContact O-N 3.35Å; L192-L195 VanDerWaalsContact O-N 3.1Å; L192-L207 HydrophobicContact CB-CD2 4.17Å; L192-L207 HydrophobicContact CD1-CD2 4.01Å; L192-F208 HydrophobicContact CB-CE2 4.33Å; L192-F208 HydrophobicContact CB-CZ 4.29Å; L192-F208 HydrophobicContact CD1-CE1 4.41Å; L192-F208 HydrophobicContact CD1-CE2 4.44Å; L192-F208 HydrophobicContact CD1-CZ 3.81Å; L192-F208 HydrophobicContact CG-CZ 4.38Å; L192-L230 HydrophobicContact CD1-CD1 3.92Å; L192-L230 HydrophobicContact CD1-CD2 4.03Å
193	E	97.3	Very high	96.4	Very high	8 Å²	8	41 Å²	41	4%	0.037	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-59.6	-22.1	169.2	76.1	-178.5	-170	0	0	112.1	V189 R190 L195 F196 V204 W258 R261 Q265 L275	V189-E193 WeakPolarHBondContact O-CB 3.2Å; V189-E193 PolarHBondContact O-N 3.28Å; R190-E193 IonicContact CZ-OE2 3.36Å; R190-E193 IonicContact NH1-OE2 2.69Å; R190-E193 PolarHBondContact NH1-OE2 3.02Å; R190-E193 WeakPolarHBondContact O-CG 3.22Å; E193-L195 PolarHBondContact O-N 3.35Å; E193-F196 PolarHBondContact O-N 3.38Å; E193-V204 HydrophobicContact CB-CG2 4.21Å; E193-W258 HydrophobicContact CG-CH2 3.82Å; E193-W258 HydrophobicContact CG-CZ3 4.06Å; E193-W258 WeakPolarHBondContact OE1-CH2 3.18Å; E193-R261 IonicContact OE1-NE 3.84Å; E193-R261 PolarHBondContact OE1-NE 2.9Å; E193-R261 VanDerWaalsContact OE1-NE 3.11Å; E193-Q265 PolarHBondContact OE2-NE2 3.41Å; E193-L275 HydrophobicContact CB-CD2 3.91Å
194	T	97.1	Very high	96.6	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.012	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-72.7	-13.4	177.7	67.7	0	0	0	0	113.8	Q179 F183 C191 L192 F196 F247 Y249 W258	Q179-T194 WeakPolarHBondContact CG-OG1 3.28Å; Q179-T194 PolarHBondContact OE1-OG1 2.73Å; F183-T194 HydrophobicContact CE2-CG2 3.93Å; C191-T194 PolarHBondContact O-OG1 2.87Å; L192-T194 PolarHBondContact O-N 3.19Å; L192-T194 VanDerWaalsContact O-N 3.15Å; T194-F196 PolarHBondContact O-N 2.83Å; T194-F247 WeakPolarHBondContact O-CE1 3.4Å; T194-Y249 HydrophobicContact CG2-CD1 4.09Å; T194-Y249 HydrophobicContact CG2-CE1 3.8Å; T194-W258 HydrophobicContact CG2-CH2 3.54Å; T194-W258 HydrophobicContact CG2-CZ2 4.08Å; T194-W258 HydrophobicContact CG2-CZ3 4.14Å
195	L	97.9	Very high	96.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-75.4	-15.1	176.5	-71.2	171.3	0	0	0	112.8	K175 L176 Q179 L192 E193 Y234 F247	K175-L195 HydrophobicContact CD-CD2 4.38Å; K175-L195 HydrophobicContact CG-CD2 3.94Å; L176-L195 HydrophobicContact CB-CD1 4.37Å; L176-L195 HydrophobicContact CD1-CD1 4.23Å; L176-L195 HydrophobicContact CG-CD1 4.04Å; Q179-L195 HydrophobicContact CB-CD2 4.06Å; Q179-L195 HydrophobicContact CB-CG 4.15Å; Q179-L195 HydrophobicContact CG-CD2 3.55Å; Q179-L195 HydrophobicContact CG-CG 4.06Å; L192-L195 HydrophobicContact CB-CD1 4.32Å; L192-L195 HydrophobicContact CD2-CD1 3.87Å; L192-L195 WeakPolarHBondContact O-CB 3.26Å; L192-L195 PolarHBondContact O-N 3.35Å; L192-L195 VanDerWaalsContact O-N 3.1Å; E193-L195 PolarHBondContact O-N 3.35Å; L195-Y234 HydrophobicContact CB-CE2 4.08Å; L195-Y234 HydrophobicContact CD1-CD2 4.16Å; L195-Y234 HydrophobicContact CD1-CE2 4.16Å; L195-Y234 HydrophobicContact CD2-CE2 4.25Å; L195-Y234 HydrophobicContact CG-CE2 4.42Å; L195-F247 WeakPolarHBondContact O-CD1 3.25Å
196	F	97.8	Very high	97	Very high	1 Å²	1	28 Å²	28	0%	0.004	13%	0.129	C	C	.	.	S	Bend	trans	-127.9	151.3	-170.6	-53.5	-81.6	0	0	0	111.8	E193 T194 L203 V204 L207 Y234 I237 V244 F247	E193-F196 PolarHBondContact O-N 3.38Å; T194-F196 PolarHBondContact O-N 2.83Å; F196-L203 HydrophobicContact CB-CB 4.49Å; F196-L203 HydrophobicContact CD1-CB 3.58Å; F196-L203 HydrophobicContact CD1-CD1 3.71Å; F196-L203 HydrophobicContact CD1-CG 4.31Å; F196-L203 HydrophobicContact CE1-CB 3.85Å; F196-L203 HydrophobicContact CE1-CD1 4.34Å; F196-L203 HydrophobicContact CG-CB 3.98Å; F196-L203 HydrophobicContact CG-CD1 4.48Å; F196-L203 HydrophobicContact CZ-CB 4.45Å; F196-V204 HydrophobicContact CB-CG2 4.39Å; F196-V204 HydrophobicContact CD2-CG2 3.68Å; F196-V204 HydrophobicContact CE2-CG2 4.32Å; F196-V204 HydrophobicContact CG-CG2 4.33Å; F196-L207 HydrophobicContact CE2-CB 4.43Å; F196-L207 HydrophobicContact CE2-CD2 3.8Å; F196-L207 HydrophobicContact CZ-CB 4.31Å; F196-L207 HydrophobicContact CZ-CD2 4.06Å; F196-Y234 HydrophobicContact CE1-CD2 4.17Å; F196-Y234 HydrophobicContact CE1-CE2 4.21Å; F196-Y234 AromaticContact CZ-CD2 3.91Å; F196-Y234 HydrophobicContact CZ-CD2 3.91Å; F196-Y234 HydrophobicContact CZ-CE2 4.25Å; F196-I237 HydrophobicContact CE1-CD1 4.29Å; F196-I237 HydrophobicContact CE1-CG2 4.04Å; F196-I237 HydrophobicContact CZ-CD1 4.27Å; F196-V244 HydrophobicContact CD1-CG1 3.59Å; F196-V244 HydrophobicContact CE1-CG1 3.64Å; F196-F247 WeakPolarHBondContact O-CE1 3.45Å; F196-F247 WeakPolarHBondContact O-CZ 3.48Å
197	P	96.2	Very high	97.1	Very high	17 Å²	17	22.1 Å²	22.1	11%	0.11	10%	0.103	C	C	.	.			trans	-52.8	139.6	170.6	-26	34.5	0	0	0	112.4	N199 R200 F247	P197-N199 WeakPolarHBondContact CB-OD1 3.49Å; P197-N199 PolarHBondContact O-N 2.84Å; P197-N199 VanDerWaalsContact O-N 3.13Å; P197-R200 HydrophobicContact CB-CB 4.41Å; P197-R200 HydrophobicContact CB-CG 4.25Å; P197-R200 PolarHBondContact O-N 3.32Å; P197-F247 HydrophobicContact CB-CD2 4.4Å; P197-F247 HydrophobicContact CB-CE2 4.08Å; P197-F247 HydrophobicContact CB-CZ 4.46Å; P197-F247 HydrophobicContact CG-CD2 3.75Å; P197-F247 HydrophobicContact CG-CE2 3.94Å; P197-F247 HydrophobicContact CG-CG 4.15Å; P197-F247 HydrophobicContact CG-CZ 4.5Å
198	S	94.5	Very high	97.1	Very high	6 Å²	6	18.4 Å²	18.4	4%	0.042	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.8	-175.8	-64.8	0	0	0	0	114.2	R200 R261 I264	S198-R200 VanDerWaalsContact C-N 3.31Å; S198-R261 WeakPolarHBondContact OG-CB 3.36Å; S198-I264 WeakPolarHBondContact O-CG2 3.1Å
199	N	94.6	Very high	97	Very high	70 Å²	70	23.6 Å²	23.6	37%	0.374	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	3.4	172.9	64.5	-41.6	0	0	0	113.8	P197 P201 I264	P197-N199 WeakPolarHBondContact CB-OD1 3.49Å; P197-N199 PolarHBondContact O-N 2.84Å; P197-N199 VanDerWaalsContact O-N 3.13Å; N199-P201 WeakPolarHBondContact O-CD 3.28Å; N199-I264 HydrophobicContact CB-CG2 3.82Å
200	R	95.8	Very high	97	Very high	60 Å²	60	27.6 Å²	27.6	23%	0.226	13%	0.127	C	C	.	.			trans	-123.3	52.7	179	-60.2	-161.1	71.8	-175.7	-6.7	113.5	P197 S198 E202 L203 E241	P197-R200 HydrophobicContact CB-CB 4.41Å; P197-R200 HydrophobicContact CB-CG 4.25Å; P197-R200 PolarHBondContact O-N 3.32Å; S198-R200 VanDerWaalsContact C-N 3.31Å; R200-E202 WeakPolarHBondContact CA-OE1 3.4Å; R200-E202 WeakPolarHBondContact CA-OE2 3.45Å; R200-E202 VanDerWaalsContact CB-OE1 3.3Å; R200-E202 WeakPolarHBondContact CB-OE1 3.31Å; R200-E202 IonicContact CZ-OE1 2.99Å; R200-E202 IonicContact NE-OE1 2.97Å; R200-E202 PolarHBondContact NE-OE1 2.95Å; R200-E202 IonicContact NH2-OE1 4Å; R200-E202 PolarHBondContact O-N 3.42Å; R200-L203 HydrophobicContact CB-CD1 3.96Å; R200-L203 HydrophobicContact CB-CG 4.24Å; R200-L203 PolarHBondContact O-N 2.86Å; R200-E241 IonicContact CZ-OE1 3.39Å; R200-E241 IonicContact CZ-OE2 3.92Å; R200-E241 VanDerWaalsContact NH1-CD 3.26Å; R200-E241 IonicContact NH1-OE1 3.75Å; R200-E241 PolarHBondContact NH1-OE1 2.83Å; R200-E241 IonicContact NH1-OE2 3.98Å; R200-E241 PolarHBondContact NH1-OE2 3.25Å; R200-E241 VanDerWaalsContact NH2-CD 3.25Å; R200-E241 IonicContact NH2-OE1 2.89Å; R200-E241 PolarHBondContact NH2-OE1 2.8Å; R200-E241 IonicContact NH2-OE2 2.79Å; R200-E241 PolarHBondContact NH2-OE2 2.73Å
201	P	96.3	Very high	97	Very high	2 Å²	2	25 Å²	25	1%	0.013	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-20.3	-179.1	27.9	-34.7	0	0	0	114	N199 L203 V204 I205 Q265 M268 L269	N199-P201 WeakPolarHBondContact O-CD 3.28Å; P201-L203 PolarHBondContact O-N 3.18Å; P201-V204 WeakPolarHBondContact O-CB 3.48Å; P201-V204 PolarHBondContact O-N 3.07Å; P201-V204 VanDerWaalsContact O-N 3.15Å; P201-I205 PolarHBondContact O-N 2.87Å; P201-I205 VanDerWaalsContact O-N 3.16Å; P201-Q265 HydrophobicContact CB-CG 4.23Å; P201-M268 HydrophobicContact CG-CB 3.76Å; P201-L269 HydrophobicContact CB-CD1 3.92Å; P201-L269 HydrophobicContact CB-CD2 4.02Å; P201-L269 HydrophobicContact CB-CG 3.94Å; P201-L269 HydrophobicContact CG-CD1 4.13Å; P201-L269 HydrophobicContact CG-CD2 3.71Å; P201-L269 HydrophobicContact CG-CG 3.59Å
202	E	96	Very high	97	Very high	78 Å²	78	27.5 Å²	27.5	36%	0.364	15%	0.146	S	C	.	.	H	α-helix	trans	-58.8	-35.2	174.4	72.7	-71	169.9	0	0	112.4	R200 V204 I205 Q206	R200-E202 WeakPolarHBondContact CA-OE1 3.4Å; R200-E202 WeakPolarHBondContact CA-OE2 3.45Å; R200-E202 VanDerWaalsContact CB-OE1 3.3Å; R200-E202 WeakPolarHBondContact CB-OE1 3.31Å; R200-E202 IonicContact CZ-OE1 2.99Å; R200-E202 IonicContact NE-OE1 2.97Å; R200-E202 PolarHBondContact NE-OE1 2.95Å; R200-E202 IonicContact NH2-OE1 4Å; R200-E202 PolarHBondContact O-N 3.42Å; E202-V204 VanDerWaalsContact C-N 3.31Å; E202-V204 PolarHBondContact O-N 2.85Å; E202-I205 PolarHBondContact O-N 3.34Å; E202-Q206 WeakPolarHBondContact O-CB 3.48Å; E202-Q206 PolarHBondContact O-N 2.9Å
203	L	97.7	Very high	96.9	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-67.2	-33.8	177.1	-63.7	179.5	0	0	0	111.7	F196 R200 P201 L207 I237 V244	F196-L203 HydrophobicContact CB-CB 4.49Å; F196-L203 HydrophobicContact CD1-CB 3.58Å; F196-L203 HydrophobicContact CD1-CD1 3.71Å; F196-L203 HydrophobicContact CD1-CG 4.31Å; F196-L203 HydrophobicContact CE1-CB 3.85Å; F196-L203 HydrophobicContact CE1-CD1 4.34Å; F196-L203 HydrophobicContact CG-CB 3.98Å; F196-L203 HydrophobicContact CG-CD1 4.48Å; F196-L203 HydrophobicContact CZ-CB 4.45Å; R200-L203 HydrophobicContact CB-CD1 3.96Å; R200-L203 HydrophobicContact CB-CG 4.24Å; R200-L203 PolarHBondContact O-N 2.86Å; P201-L203 PolarHBondContact O-N 3.18Å; L203-L207 WeakPolarHBondContact O-CB 3.18Å; L203-L207 PolarHBondContact O-N 3.32Å; L203-I237 HydrophobicContact CD2-CG2 4.14Å; L203-V244 HydrophobicContact CD1-CG2 4.08Å
204	V	98	Very high	96.9	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-68.4	-42.8	174.4	-168.3	0	0	0	0	110.3	V189 E193 F196 P201 E202 L207 F208 L275	V189-V204 HydrophobicContact CG2-CG1 4.01Å; E193-V204 HydrophobicContact CB-CG2 4.21Å; F196-V204 HydrophobicContact CB-CG2 4.39Å; F196-V204 HydrophobicContact CD2-CG2 3.68Å; F196-V204 HydrophobicContact CE2-CG2 4.32Å; F196-V204 HydrophobicContact CG-CG2 4.33Å; P201-V204 WeakPolarHBondContact O-CB 3.48Å; P201-V204 PolarHBondContact O-N 3.07Å; P201-V204 VanDerWaalsContact O-N 3.15Å; E202-V204 VanDerWaalsContact C-N 3.31Å; E202-V204 PolarHBondContact O-N 2.85Å; V204-L207 WeakPolarHBondContact O-CB 3.08Å; V204-L207 PolarHBondContact O-N 3.14Å; V204-F208 HydrophobicContact CG1-CD2 4.08Å; V204-F208 HydrophobicContact CG1-CE2 3.97Å; V204-F208 WeakPolarHBondContact O-CD2 3.34Å; V204-F208 PolarHBondContact O-N 3.2Å; V204-L275 HydrophobicContact CB-CD1 4.28Å; V204-L275 HydrophobicContact CB-CD2 3.92Å; V204-L275 HydrophobicContact CG1-CD1 4.47Å; V204-L275 HydrophobicContact CG1-CD2 3.88Å; V204-L275 HydrophobicContact CG2-CD2 3.96Å
205	I	97	Very high	96.9	Very high	14 Å²	14	29.3 Å²	29.3	7%	0.072	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-48.4	175.7	-66.6	167.1	0	0	0	109.8	P201 E202 L207 F208 K209 L269 L275 V280 E283	P201-I205 PolarHBondContact O-N 2.87Å; P201-I205 VanDerWaalsContact O-N 3.16Å; E202-I205 PolarHBondContact O-N 3.34Å; I205-L207 VanDerWaalsContact C-N 3.32Å; I205-L207 PolarHBondContact O-N 3.27Å; I205-F208 PolarHBondContact O-N 3.42Å; I205-K209 WeakPolarHBondContact O-CB 3.21Å; I205-K209 PolarHBondContact O-N 3.1Å; I205-L269 HydrophobicContact CD1-CD1 4.39Å; I205-L269 HydrophobicContact CD1-CD2 3.64Å; I205-L275 HydrophobicContact CD1-CD1 4.41Å; I205-L275 HydrophobicContact CG1-CD1 3.9Å; I205-V280 HydrophobicContact CG1-CG2 4.03Å; I205-E283 HydrophobicContact CD1-CG 4.46Å; I205-E283 HydrophobicContact CG2-CB 3.6Å; I205-E283 HydrophobicContact CG2-CG 3.69Å
206	Q	97.3	Very high	96.9	Very high	57 Å²	57	30.6 Å²	30.6	27%	0.266	17%	0.165	S	C	.	.	H	α-helix	trans	-55.8	-46.4	176.6	-176.5	-175.3	-1.9	0	0	111.4	E202 F208 K209 E210 I237	E202-Q206 WeakPolarHBondContact O-CB 3.48Å; E202-Q206 PolarHBondContact O-N 2.9Å; Q206-F208 PolarHBondContact O-N 3.33Å; Q206-K209 PolarHBondContact O-N 2.77Å; Q206-E210 HydrophobicContact CG-CG 4.21Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.11Å; Q206-E210 PolarHBondContact NE2-OE1 3.27Å; Q206-E210 WeakPolarHBondContact O-CB 3.2Å; Q206-E210 PolarHBondContact O-N 2.93Å; Q206-I237 HydrophobicContact CG-CD1 4.43Å
207	L	98.5	Very high	96.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-53.1	-53.2	179	176.9	64.7	0	0	0	111.8	L192 F196 L203 V204 I205 A211 L230 V233 I237	L192-L207 HydrophobicContact CB-CD2 4.17Å; L192-L207 HydrophobicContact CD1-CD2 4.01Å; F196-L207 HydrophobicContact CE2-CB 4.43Å; F196-L207 HydrophobicContact CE2-CD2 3.8Å; F196-L207 HydrophobicContact CZ-CB 4.31Å; F196-L207 HydrophobicContact CZ-CD2 4.06Å; L203-L207 WeakPolarHBondContact O-CB 3.18Å; L203-L207 PolarHBondContact O-N 3.32Å; V204-L207 WeakPolarHBondContact O-CB 3.08Å; V204-L207 PolarHBondContact O-N 3.14Å; I205-L207 VanDerWaalsContact C-N 3.32Å; I205-L207 PolarHBondContact O-N 3.27Å; L207-A211 WeakPolarHBondContact O-CB 3.3Å; L207-A211 PolarHBondContact O-N 3.39Å; L207-A211 VanDerWaalsContact O-N 3.1Å; L207-L230 HydrophobicContact CD1-CD2 4.03Å; L207-L230 WeakPolarHBondContact CD1-O 3.3Å; L207-L230 HydrophobicContact CD2-CD2 4.21Å; L207-L230 HydrophobicContact CG-CD2 3.8Å; L207-V233 HydrophobicContact CD1-CB 3.97Å; L207-V233 HydrophobicContact CD1-CG1 3.87Å; L207-I237 HydrophobicContact CB-CD1 4.4Å
208	F	98.3	Very high	96.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-73.8	-34.1	-178.9	-77.1	-76.6	0	0	0	113	I188 V189 L192 V204 I205 Q206 G212 V213 P215 L230 V280 I284	I188-F208 HydrophobicContact CB-CZ 4.41Å; I188-F208 HydrophobicContact CG1-CE1 4.33Å; I188-F208 HydrophobicContact CG1-CZ 4.18Å; I188-F208 HydrophobicContact CG2-CE1 3.58Å; I188-F208 HydrophobicContact CG2-CZ 3.79Å; V189-F208 HydrophobicContact CB-CE2 3.89Å; V189-F208 HydrophobicContact CB-CZ 4.13Å; V189-F208 HydrophobicContact CG2-CD2 4.28Å; V189-F208 HydrophobicContact CG2-CE2 3.9Å; L192-F208 HydrophobicContact CB-CE2 4.33Å; L192-F208 HydrophobicContact CB-CZ 4.29Å; L192-F208 HydrophobicContact CD1-CE1 4.41Å; L192-F208 HydrophobicContact CD1-CE2 4.44Å; L192-F208 HydrophobicContact CD1-CZ 3.81Å; L192-F208 HydrophobicContact CG-CZ 4.38Å; V204-F208 HydrophobicContact CG1-CD2 4.08Å; V204-F208 HydrophobicContact CG1-CE2 3.97Å; V204-F208 WeakPolarHBondContact O-CD2 3.34Å; V204-F208 PolarHBondContact O-N 3.2Å; I205-F208 PolarHBondContact O-N 3.42Å; Q206-F208 PolarHBondContact O-N 3.33Å; F208-G212 PolarHBondContact O-N 3.14Å; F208-V213 HydrophobicContact CD1-CB 4.15Å; F208-V213 HydrophobicContact CD1-CG1 4.35Å; F208-V213 WeakPolarHBondContact CD1-O 3.12Å; F208-V213 HydrophobicContact CE1-CG1 4.29Å; F208-V213 PolarHBondContact O-N 3.43Å; F208-P215 HydrophobicContact CD1-CB 4.12Å; F208-P215 HydrophobicContact CD2-CB 4.47Å; F208-P215 HydrophobicContact CE1-CB 4.33Å; F208-P215 HydrophobicContact CG-CB 4.2Å; F208-L230 HydrophobicContact CD1-CD2 4.21Å; F208-L230 HydrophobicContact CE1-CD2 4.15Å; F208-V280 HydrophobicContact CB-CG1 3.42Å; F208-V280 VanDerWaalsContact CB-CG1 3.42Å; F208-V280 HydrophobicContact CD2-CG1 4.18Å; F208-V280 HydrophobicContact CG-CG1 3.97Å; F208-I284 HydrophobicContact CB-CD1 4.32Å
209	K	96.4	Very high	97.1	Very high	110 Å²	110	35.2 Å²	35.2	48%	0.478	18%	0.183	S	C	.	.	H	α-helix	trans	-65.2	-48.8	178.9	-175.3	173.3	-177.8	163.7	0	112.2	I205 Q206 E283 I284	I205-K209 WeakPolarHBondContact O-CB 3.21Å; I205-K209 PolarHBondContact O-N 3.1Å; Q206-K209 PolarHBondContact O-N 2.77Å; K209-E283 WeakPolarHBondContact CD-O 3.39Å; K209-E283 WeakPolarHBondContact CE-O 3.47Å; K209-E283 PolarHBondContact NZ-O 2.88Å; K209-E283 VanDerWaalsContact NZ-O 3.14Å; K209-I284 HydrophobicContact CB-CG1 4.31Å
210	E	97.1	Very high	97.2	Very high	83 Å²	83	33.4 Å²	33.4	39%	0.388	17%	0.173	S	C	.	.	H	α-helix	trans	-73.1	-35.1	178.2	-67.6	-172.9	-153.6	0	0	112.1	Q206 G212 V233 R236	Q206-E210 HydrophobicContact CG-CG 4.21Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.11Å; Q206-E210 PolarHBondContact NE2-OE1 3.27Å; Q206-E210 WeakPolarHBondContact O-CB 3.2Å; Q206-E210 PolarHBondContact O-N 2.93Å; E210-G212 VanDerWaalsContact C-N 3.3Å; E210-G212 PolarHBondContact O-N 3.26Å; E210-V233 HydrophobicContact CB-CB 4.41Å; E210-V233 HydrophobicContact CB-CG1 3.83Å; E210-V233 HydrophobicContact CB-CG2 3.63Å; E210-R236 IonicContact OE1-NH1 3.06Å; E210-R236 IonicContact OE2-CZ 2.62Å; E210-R236 IonicContact OE2-NH1 3.07Å; E210-R236 PolarHBondContact OE2-NH1 2.62Å
211	A	97.9	Very high	97.3	Very high	10 Å²	10	32.4 Å²	32.4	8%	0.083	17%	0.171	C	C	.	.	H	α-helix	trans	-76.3	-16.2	179.3	0	0	0	0	0	113.3	L207 V213 D229 L230 V233	L207-A211 WeakPolarHBondContact O-CB 3.3Å; L207-A211 PolarHBondContact O-N 3.39Å; L207-A211 VanDerWaalsContact O-N 3.1Å; A211-V213 HydrophobicContact CB-CG2 4.02Å; A211-V213 PolarHBondContact O-N 3.28Å; A211-D229 HydrophobicContact CB-CB 4.27Å; A211-L230 HydrophobicContact CB-CD2 3.81Å; A211-L230 HydrophobicContact CB-CG 4.1Å; A211-V233 HydrophobicContact CB-CG2 4.11Å
212	G	96.1	Very high	97.4	Very high	53 Å²	53	32.3 Å²	32.3	55%	0.546	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	21.8	-176.9	0	0	0	0	0	114.2	F208 E210	F208-G212 PolarHBondContact O-N 3.14Å; E210-G212 VanDerWaalsContact C-N 3.3Å; E210-G212 PolarHBondContact O-N 3.26Å
213	V	97.4	Very high	97.5	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	17%	0.169	C	C	.	.			trans	-94.9	140	-175.2	177.7	0	0	0	0	111.4	F208 A211 P215 L222 E226 L230	F208-V213 HydrophobicContact CD1-CB 4.15Å; F208-V213 HydrophobicContact CD1-CG1 4.35Å; F208-V213 WeakPolarHBondContact CD1-O 3.12Å; F208-V213 HydrophobicContact CE1-CG1 4.29Å; F208-V213 PolarHBondContact O-N 3.43Å; A211-V213 HydrophobicContact CB-CG2 4.02Å; A211-V213 PolarHBondContact O-N 3.28Å; V213-P215 VanDerWaalsContact O-CD 3.29Å; V213-P215 WeakPolarHBondContact O-CD 3.14Å; V213-L222 HydrophobicContact CG1-CD2 4.39Å; V213-L222 HydrophobicContact CG1-CG 4.41Å; V213-E226 HydrophobicContact CG1-CB 4.27Å; V213-E226 HydrophobicContact CG1-CG 4.44Å; V213-E226 HydrophobicContact CG2-CB 3.76Å; V213-E226 HydrophobicContact CG2-CG 3.96Å; V213-L230 HydrophobicContact CB-CD1 4.38Å; V213-L230 HydrophobicContact CB-CD2 4.3Å; V213-L230 HydrophobicContact CB-CG 4.27Å; V213-L230 HydrophobicContact CG1-CD1 4.12Å; V213-L230 HydrophobicContact CG2-CD1 4.2Å; V213-L230 HydrophobicContact CG2-CD2 4.33Å; V213-L230 HydrophobicContact CG2-CG 3.87Å
214	Q	97.1	Very high	97.5	Very high	46 Å²	46	32.2 Å²	32.2	22%	0.215	17%	0.174	C	C	.	.			trans	-68.9	116.3	177.5	-69.9	-56.3	-54	0	0	111.9	I188 A216 K217 Y285	I188-Q214 WeakPolarHBondContact CG2-O 3.44Å; Q214-A216 PolarHBondContact O-N 2.87Å; Q214-A216 VanDerWaalsContact O-N 3.15Å; Q214-K217 HydrophobicContact CB-CD 4.04Å; Q214-K217 HydrophobicContact CB-CG 3.89Å; Q214-K217 PolarHBondContact O-N 3.42Å; Q214-Y285 PolarHBondContact NE2-OH 3.1Å
215	P	97.2	Very high	97.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.2	-176	28.2	-37.3	0	0	0	113.7	I188 V189 F208 V213 A277 V280	I188-P215 WeakPolarHBondContact CG2-O 3.3Å; V189-P215 HydrophobicContact CB-CB 3.8Å; V189-P215 HydrophobicContact CG1-CB 4.32Å; V189-P215 WeakPolarHBondContact CG1-O 3.46Å; V189-P215 HydrophobicContact CG2-CB 4.3Å; V189-P215 PolarHBondContact N-O 3.38Å; F208-P215 HydrophobicContact CD1-CB 4.12Å; F208-P215 HydrophobicContact CD2-CB 4.47Å; F208-P215 HydrophobicContact CE1-CB 4.33Å; F208-P215 HydrophobicContact CG-CB 4.2Å; V213-P215 VanDerWaalsContact O-CD 3.29Å; V213-P215 WeakPolarHBondContact O-CD 3.14Å; P215-A277 HydrophobicContact CB-CB 4.23Å; P215-A277 HydrophobicContact CG-CB 4.23Å; P215-A277 VanDerWaalsContact CG-O 3.29Å; P215-A277 WeakPolarHBondContact CG-O 3.45Å; P215-V280 HydrophobicContact CB-CB 3.97Å; P215-V280 HydrophobicContact CB-CG1 3.81Å; P215-V280 HydrophobicContact CG-CB 3.84Å; P215-V280 HydrophobicContact CG-CG1 3.76Å
216	A	97.2	Very high	97.6	Very high	28 Å²	28	34.9 Å²	34.9	23%	0.231	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-13.9	-177.8	0	0	0	0	0	114.1	Q214 A277	Q214-A216 PolarHBondContact O-N 2.87Å; Q214-A216 VanDerWaalsContact O-N 3.15Å; A216-A277 HydrophobicContact CB-CB 4.04Å
217	K	97.6	Very high	97.7	Very high	55 Å²	55	32.1 Å²	32.1	24%	0.239	18%	0.179	C	C	.	.	S	Bend	trans	-64.7	155.8	178.8	-76.8	-178.2	174.9	-173.6	0	111.2	Q187 I188 Q214 Q221 L222 E226	Q187-K217 CarbonylContact C-O 3.42Å; Q187-K217 WeakPolarHBondContact CA-O 3.44Å; I188-K217 VanDerWaalsContact CB-O 3.31Å; I188-K217 WeakPolarHBondContact CB-O 3.25Å; I188-K217 HydrophobicContact CG2-CB 4.43Å; I188-K217 WeakPolarHBondContact CG2-O 3.27Å; I188-K217 PolarHBondContact N-O 2.85Å; Q214-K217 HydrophobicContact CB-CD 4.04Å; Q214-K217 HydrophobicContact CB-CG 3.89Å; Q214-K217 PolarHBondContact O-N 3.42Å; K217-Q221 HydrophobicContact CB-CB 4.24Å; K217-Q221 HydrophobicContact CD-CB 4.46Å; K217-Q221 HydrophobicContact CG-CB 4.38Å; K217-L222 HydrophobicContact CB-CD1 3.63Å; K217-L222 HydrophobicContact CD-CD1 4.16Å; K217-E226 IonicContact NZ-OE1 2.6Å; K217-E226 PolarHBondContact NZ-OE1 2.8Å; K217-E226 IonicContact NZ-OE2 3.85Å; K217-E226 PolarHBondContact NZ-OE2 3.48Å
218	Q	97.5	Very high	97.7	Very high	67 Å²	67	36.6 Å²	36.6	31%	0.313	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-89.8	161.6	165.9	-62.2	-177.8	33.5	0	0	110.5	I220 Q221 L222	Q218-I220 PolarHBondContact O-N 3.27Å; Q218-I220 VanDerWaalsContact O-N 3.14Å; Q218-Q221 HydrophobicContact CB-CG 4.21Å; Q218-Q221 WeakPolarHBondContact O-CB 3.33Å; Q218-Q221 PolarHBondContact O-N 3.4Å; Q218-L222 VanDerWaalsContact O-CD1 3.23Å; Q218-L222 WeakPolarHBondContact O-CD1 3.47Å
219	C	97.2	Very high	97.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56.9	-33.5	-177.3	64.8	0	0	0	0	113.5	A180 F181 I188 Q221 L222	A180-C219 HydrophobicContact CB-CB 4.5Å; A180-C219 VanDerWaalsContact O-CB 3.3Å; A180-C219 WeakPolarHBondContact O-CB 3.45Å; F181-C219 HydrophobicContact CD1-CB 4.21Å; F181-C219 WeakPolarHBondContact CD1-SG 3.48Å; F181-C219 HydrophobicContact CD2-CB 4.49Å; F181-C219 HydrophobicContact CE1-CB 4.12Å; F181-C219 VanDerWaalsContact CE1-SG 3.57Å; F181-C219 HydrophobicContact CE2-CB 4.41Å; F181-C219 HydrophobicContact CG-CB 4.39Å; F181-C219 HydrophobicContact CZ-CB 4.23Å; I188-C219 HydrophobicContact CD1-CB 4.32Å; C219-Q221 PolarHBondContact O-N 3.04Å; C219-L222 PolarHBondContact O-N 3.3Å
220	I	97.5	Very high	97.8	Very high	32 Å²	32	33.7 Å²	33.7	16%	0.164	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-71.9	-17.2	179.3	66.4	171.7	0	0	0	113.4	V116 W117 R121 F181 Q218	V116-I220 WeakPolarHBondContact CG1-O 3.46Å; W117-I220 PolarHBondContact N-O 3Å; R121-I220 HydrophobicContact CB-CB 4.34Å; R121-I220 HydrophobicContact CB-CG2 4.1Å; R121-I220 WeakPolarHBondContact CD-O 3.19Å; F181-I220 HydrophobicContact CE1-CG2 4.3Å; Q218-I220 PolarHBondContact O-N 3.27Å; Q218-I220 VanDerWaalsContact O-N 3.14Å
221	Q	98.2	Very high	97.9	Very high	38 Å²	38	29.7 Å²	29.7	18%	0.178	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-91.9	-9.7	-178	-53.1	178.2	-29.1	0	0	112.4	W117 K217 Q218 C219	W117-Q221 HydrophobicContact CD2-CG 4.19Å; W117-Q221 HydrophobicContact CE3-CG 3.84Å; W117-Q221 HydrophobicContact CH2-CB 4.03Å; W117-Q221 HydrophobicContact CH2-CG 3.46Å; W117-Q221 VanDerWaalsContact CH2-CG 3.46Å; W117-Q221 HydrophobicContact CZ2-CB 3.86Å; W117-Q221 HydrophobicContact CZ2-CG 3.8Å; W117-Q221 HydrophobicContact CZ3-CB 4.45Å; W117-Q221 HydrophobicContact CZ3-CG 3.5Å; W117-Q221 VanDerWaalsContact CZ3-CG 3.5Å; K217-Q221 HydrophobicContact CB-CB 4.24Å; K217-Q221 HydrophobicContact CD-CB 4.46Å; K217-Q221 HydrophobicContact CG-CB 4.38Å; Q218-Q221 HydrophobicContact CB-CG 4.21Å; Q218-Q221 WeakPolarHBondContact O-CB 3.33Å; Q218-Q221 PolarHBondContact O-N 3.4Å; C219-Q221 PolarHBondContact O-N 3.04Å
222	L	98.3	Very high	98	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.19	C	C	.	.			trans	-78.4	127	179.3	-91	68.4	0	0	0	110.3	R121 I188 V213 K217 Q218 C219 E226 F227 L230	R121-L222 PolarHBondContact NH2-O 3.24Å; I188-L222 HydrophobicContact CB-CD1 4.2Å; I188-L222 HydrophobicContact CD1-CD2 4.02Å; I188-L222 HydrophobicContact CG1-CD1 4.18Å; I188-L222 HydrophobicContact CG1-CD2 3.85Å; I188-L222 HydrophobicContact CG2-CD1 4.3Å; V213-L222 HydrophobicContact CG1-CD2 4.39Å; V213-L222 HydrophobicContact CG1-CG 4.41Å; K217-L222 HydrophobicContact CB-CD1 3.63Å; K217-L222 HydrophobicContact CD-CD1 4.16Å; Q218-L222 VanDerWaalsContact O-CD1 3.23Å; Q218-L222 WeakPolarHBondContact O-CD1 3.47Å; C219-L222 PolarHBondContact O-N 3.3Å; L222-E226 WeakPolarHBondContact CA-OE2 3.5Å; L222-E226 HydrophobicContact CB-CB 4.41Å; L222-E226 HydrophobicContact CG-CB 4.2Å; L222-F227 HydrophobicContact CB-CD2 3.81Å; L222-F227 HydrophobicContact CB-CE2 3.4Å; L222-F227 HydrophobicContact CB-CZ 3.9Å; L222-F227 HydrophobicContact CD2-CD1 4.37Å; L222-F227 HydrophobicContact CD2-CE1 4.08Å; L222-F227 HydrophobicContact CD2-CE2 4.23Å; L222-F227 HydrophobicContact CD2-CZ 4.01Å; L222-F227 HydrophobicContact CG-CE2 4.47Å; L222-L230 HydrophobicContact CD2-CD1 3.57Å
223	T	98.3	Very high	98.1	Very high	54 Å²	54	33.1 Å²	33.1	33%	0.331	17%	0.165	S	C	.	.			trans	-71.9	164.8	171.5	67.4	0	0	0	0	111.4	V116 S225 E226 F227	V116-T223 HydrophobicContact CG2-CG2 4.37Å; T223-S225 PolarHBondContact O-N 2.96Å; T223-E226 PolarHBondContact N-OE2 2.97Å; T223-E226 PolarHBondContact O-N 3.48Å; T223-E226 WeakPolarHBondContact OG1-CG 3.4Å; T223-E226 PolarHBondContact OG1-N 3Å; T223-E226 PolarHBondContact OG1-OE2 3.46Å; T223-F227 WeakPolarHBondContact O-CD2 3.32Å; T223-F227 PolarHBondContact O-N 3.41Å
224	M	98.2	Very high	98.2	Very high	26 Å²	26	33.1 Å²	33.1	13%	0.128	17%	0.165	C	C	.	.	H	α-helix	trans	-62	-31.6	173.8	-67.1	-53.7	-62.2	0	0	112.7	V126 Q129 A130 L165 I166 R228	V126-M224 HydrophobicContact CB-SD 4.49Å; V126-M224 HydrophobicContact CG1-CE 4.07Å; V126-M224 HydrophobicContact CG1-SD 4.08Å; V126-M224 WeakPolarHBondContact O-CE 3.45Å; Q129-M224 HydrophobicContact CB-CE 4.11Å; Q129-M224 HydrophobicContact CB-SD 4.07Å; A130-M224 HydrophobicContact CB-CE 3.89Å; L165-M224 HydrophobicContact CD1-CB 4.01Å; L165-M224 HydrophobicContact CD1-CE 4.44Å; L165-M224 HydrophobicContact CD1-CG 4.11Å; I166-M224 HydrophobicContact CD1-CE 3.97Å; I166-M224 HydrophobicContact CG1-CE 4.3Å; M224-R228 WeakPolarHBondContact O-CB 3.31Å; M224-R228 PolarHBondContact O-N 3Å
225	S	98.4	Very high	98.2	Very high	50 Å²	50	32.3 Å²	32.3	35%	0.35	16%	0.161	S	C	.	.	H	α-helix	trans	-65.1	-44.5	173.5	-170	0	0	0	0	111.2	T223 F227 R228 D229	T223-S225 PolarHBondContact O-N 2.96Å; S225-F227 VanDerWaalsContact C-N 3.35Å; S225-F227 PolarHBondContact O-N 2.91Å; S225-R228 VanDerWaalsContact O-CB 3.32Å; S225-R228 WeakPolarHBondContact O-CB 3.21Å; S225-R228 PolarHBondContact O-N 3.02Å; S225-R228 VanDerWaalsContact O-N 3.16Å; S225-R228 PolarHBondContact OG-NH2 3.5Å; S225-D229 PolarHBondContact O-N 2.89Å; S225-D229 VanDerWaalsContact O-OD2 3.05Å; S225-D229 PolarHBondContact OG-OD2 3.11Å
226	E	98.7	Very high	98.3	Very high	22 Å²	22	37.8 Å²	37.8	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-40.1	178.7	-69.6	175.4	113.5	0	0	111.8	V213 K217 L222 T223 D229 L230	V213-E226 HydrophobicContact CG1-CB 4.27Å; V213-E226 HydrophobicContact CG1-CG 4.44Å; V213-E226 HydrophobicContact CG2-CB 3.76Å; V213-E226 HydrophobicContact CG2-CG 3.96Å; K217-E226 IonicContact NZ-OE1 2.6Å; K217-E226 PolarHBondContact NZ-OE1 2.8Å; K217-E226 IonicContact NZ-OE2 3.85Å; K217-E226 PolarHBondContact NZ-OE2 3.48Å; L222-E226 WeakPolarHBondContact CA-OE2 3.5Å; L222-E226 HydrophobicContact CB-CB 4.41Å; L222-E226 HydrophobicContact CG-CB 4.2Å; T223-E226 PolarHBondContact N-OE2 2.97Å; T223-E226 PolarHBondContact O-N 3.48Å; T223-E226 WeakPolarHBondContact OG1-CG 3.4Å; T223-E226 PolarHBondContact OG1-N 3Å; T223-E226 PolarHBondContact OG1-OE2 3.46Å; E226-D229 PolarHBondContact O-N 3.42Å; E226-L230 WeakPolarHBondContact O-CB 3.24Å; E226-L230 VanDerWaalsContact O-CG 3.31Å; E226-L230 WeakPolarHBondContact O-CG 3.43Å; E226-L230 PolarHBondContact O-N 2.92Å
227	F	98.7	Very high	98.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.5	-42.4	171.7	-84.8	-68.3	0	0	0	112.3	V126 I166 L176 V177 A180 F181 L222 T223 S225 D229 L230 C231	V126-F227 HydrophobicContact CG1-CB 4.29Å; V126-F227 HydrophobicContact CG1-CD1 4.22Å; V126-F227 HydrophobicContact CG1-CD2 3.86Å; V126-F227 HydrophobicContact CG1-CE2 4.22Å; V126-F227 HydrophobicContact CG1-CG 3.86Å; V126-F227 HydrophobicContact CG2-CD2 4Å; V126-F227 HydrophobicContact CG2-CE2 3.63Å; V126-F227 HydrophobicContact CG2-CZ 4.07Å; I166-F227 HydrophobicContact CD1-CB 3.82Å; L176-F227 HydrophobicContact CD2-CD1 4.08Å; L176-F227 HydrophobicContact CD2-CE1 4.4Å; V177-F227 HydrophobicContact CG2-CD1 4.13Å; V177-F227 HydrophobicContact CG2-CE1 4.36Å; A180-F227 HydrophobicContact CB-CE1 3.83Å; A180-F227 HydrophobicContact CB-CZ 4.35Å; F181-F227 HydrophobicContact CE2-CE1 4.44Å; F181-F227 HydrophobicContact CE2-CE2 4.41Å; F181-F227 AromaticContact CE2-CZ 3.74Å; F181-F227 HydrophobicContact CE2-CZ 3.74Å; F181-F227 HydrophobicContact CZ-CZ 4.31Å; L222-F227 HydrophobicContact CB-CD2 3.81Å; L222-F227 HydrophobicContact CB-CE2 3.4Å; L222-F227 HydrophobicContact CB-CZ 3.9Å; L222-F227 HydrophobicContact CD2-CD1 4.37Å; L222-F227 HydrophobicContact CD2-CE1 4.08Å; L222-F227 HydrophobicContact CD2-CE2 4.23Å; L222-F227 HydrophobicContact CD2-CZ 4.01Å; L222-F227 HydrophobicContact CG-CE2 4.47Å; T223-F227 WeakPolarHBondContact O-CD2 3.32Å; T223-F227 PolarHBondContact O-N 3.41Å; S225-F227 VanDerWaalsContact C-N 3.35Å; S225-F227 PolarHBondContact O-N 2.91Å; F227-D229 PolarHBondContact O-N 3.36Å; F227-L230 PolarHBondContact O-N 3.02Å; F227-C231 WeakPolarHBondContact O-CB 3.15Å; F227-C231 PolarHBondContact O-N 3.46Å; F227-C231 PolarHBondContact O-SG 2.85Å
228	R	98.7	Very high	98.4	Very high	93 Å²	93	34.1 Å²	34.1	35%	0.351	16%	0.161	S	C	.	.	H	α-helix	trans	-55.4	-51.5	175.1	179.1	-168.4	68.8	-147	-7.1	111.2	L165 I166 M224 S225 C231 F232	L165-R228 WeakPolarHBondContact O-CD 3.3Å; L165-R228 WeakPolarHBondContact O-CG 3.17Å; I166-R228 HydrophobicContact CG1-CB 4.01Å; M224-R228 WeakPolarHBondContact O-CB 3.31Å; M224-R228 PolarHBondContact O-N 3Å; S225-R228 VanDerWaalsContact O-CB 3.32Å; S225-R228 WeakPolarHBondContact O-CB 3.21Å; S225-R228 PolarHBondContact O-N 3.02Å; S225-R228 VanDerWaalsContact O-N 3.16Å; S225-R228 PolarHBondContact OG-NH2 3.5Å; R228-C231 PolarHBondContact O-N 3.48Å; R228-F232 PolarHBondContact O-N 3.35Å
229	D	98.7	Very high	98.4	Very high	49 Å²	49	37 Å²	37	26%	0.262	17%	0.174	S	C	.	.	H	α-helix	trans	-68.4	-39.3	-173.2	-56.9	-25.1	0	0	0	110.4	A211 S225 E226 F227 F232 V233	A211-D229 HydrophobicContact CB-CB 4.27Å; S225-D229 PolarHBondContact O-N 2.89Å; S225-D229 VanDerWaalsContact O-OD2 3.05Å; S225-D229 PolarHBondContact OG-OD2 3.11Å; E226-D229 PolarHBondContact O-N 3.42Å; F227-D229 PolarHBondContact O-N 3.36Å; D229-F232 PolarHBondContact O-N 2.85Å; D229-V233 WeakPolarHBondContact O-CG2 3.36Å; D229-V233 PolarHBondContact O-N 2.88Å; D229-V233 VanDerWaalsContact O-N 3.11Å
230	L	98.8	Very high	98.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-43.9	170.7	-75.3	167.4	0	0	0	112.8	L176 L192 L207 F208 A211 V213 L222 E226 F227 F232 Y234	L176-L230 HydrophobicContact CD1-CB 4.03Å; L176-L230 HydrophobicContact CD2-CB 4.4Å; L192-L230 HydrophobicContact CD1-CD1 3.92Å; L192-L230 HydrophobicContact CD1-CD2 4.03Å; L207-L230 HydrophobicContact CD1-CD2 4.03Å; L207-L230 WeakPolarHBondContact CD1-O 3.3Å; L207-L230 HydrophobicContact CD2-CD2 4.21Å; L207-L230 HydrophobicContact CG-CD2 3.8Å; F208-L230 HydrophobicContact CD1-CD2 4.21Å; F208-L230 HydrophobicContact CE1-CD2 4.15Å; A211-L230 HydrophobicContact CB-CD2 3.81Å; A211-L230 HydrophobicContact CB-CG 4.1Å; V213-L230 HydrophobicContact CB-CD1 4.38Å; V213-L230 HydrophobicContact CB-CD2 4.3Å; V213-L230 HydrophobicContact CB-CG 4.27Å; V213-L230 HydrophobicContact CG1-CD1 4.12Å; V213-L230 HydrophobicContact CG2-CD1 4.2Å; V213-L230 HydrophobicContact CG2-CD2 4.33Å; V213-L230 HydrophobicContact CG2-CG 3.87Å; L222-L230 HydrophobicContact CD2-CD1 3.57Å; E226-L230 WeakPolarHBondContact O-CB 3.24Å; E226-L230 VanDerWaalsContact O-CG 3.31Å; E226-L230 WeakPolarHBondContact O-CG 3.43Å; E226-L230 PolarHBondContact O-N 2.92Å; F227-L230 PolarHBondContact O-N 3.02Å; L230-F232 VanDerWaalsContact C-N 3.34Å; L230-Y234 VanDerWaalsContact O-CB 3.26Å; L230-Y234 WeakPolarHBondContact O-CB 3.36Å; L230-Y234 PolarHBondContact O-N 2.93Å
231	C	98.8	Very high	98.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.2	-37.8	179.1	-68.8	0	0	0	0	111.8	I166 V168 V173 F227 R228 H235	I166-C231 HydrophobicContact CG2-CB 3.79Å; V168-C231 HydrophobicContact CB-CB 4.25Å; V168-C231 HydrophobicContact CG1-CB 4.3Å; V168-C231 HydrophobicContact CG2-CB 4.01Å; V173-C231 HydrophobicContact CG2-CB 4.34Å; F227-C231 WeakPolarHBondContact O-CB 3.15Å; F227-C231 PolarHBondContact O-N 3.46Å; F227-C231 PolarHBondContact O-SG 2.85Å; R228-C231 PolarHBondContact O-N 3.48Å; C231-H235 VanDerWaalsContact O-CB 3.27Å; C231-H235 WeakPolarHBondContact O-CB 3.4Å; C231-H235 PolarHBondContact O-N 2.52Å
232	F	98.6	Very high	98.1	Very high	130 Å²	130	44.9 Å²	44.9	57%	0.57	22%	0.221	S	C	*	.	H	α-helix	trans	-63.3	-49	177.9	-177.5	-96.8	0	0	0	111.3	V168 R228 D229 L230 H235 R236	V168-F232 HydrophobicContact CG2-CB 4.3Å; R228-F232 PolarHBondContact O-N 3.35Å; D229-F232 PolarHBondContact O-N 2.85Å; L230-F232 VanDerWaalsContact C-N 3.34Å; F232-H235 PolarHBondContact O-N 3.21Å; F232-R236 PolarHBondContact O-N 3.45Å
233	V	98.7	Very high	98	Very high	5 Å²	5	49.1 Å²	49.1	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-43.5	177.8	176.4	0	0	0	0	111.2	L207 E210 A211 D229 H235 R236 I237	L207-V233 HydrophobicContact CD1-CB 3.97Å; L207-V233 HydrophobicContact CD1-CG1 3.87Å; E210-V233 HydrophobicContact CB-CB 4.41Å; E210-V233 HydrophobicContact CB-CG1 3.83Å; E210-V233 HydrophobicContact CB-CG2 3.63Å; A211-V233 HydrophobicContact CB-CG2 4.11Å; D229-V233 WeakPolarHBondContact O-CG2 3.36Å; D229-V233 PolarHBondContact O-N 2.88Å; D229-V233 VanDerWaalsContact O-N 3.11Å; V233-H235 PolarHBondContact O-N 2.71Å; V233-R236 WeakPolarHBondContact O-CB 3.37Å; V233-R236 PolarHBondContact O-N 2.85Å; V233-I237 HydrophobicContact CG1-CD1 3.99Å; V233-I237 HydrophobicContact CG1-CG1 4.45Å; V233-I237 WeakPolarHBondContact O-CG1 3.3Å; V233-I237 PolarHBondContact O-N 2.99Å
234	Y	98.8	Very high	97.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.2	-45.7	176.3	177.8	-116.9	0	0	0	112.1	Y172 K175 L176 L195 F196 L230 R236 I237 C238 V244	Y172-Y234 HydrophobicContact CD1-CD1 4.39Å; Y172-Y234 HydrophobicContact CD1-CE1 4.13Å; K175-Y234 WeakPolarHBondContact CD-OH 3.11Å; K175-Y234 WeakPolarHBondContact CE-OH 3.41Å; K175-Y234 PolarHBondContact NZ-OH 2.6Å; L176-Y234 HydrophobicContact CB-CD1 4.3Å; L176-Y234 HydrophobicContact CD1-CD1 4.25Å; L176-Y234 HydrophobicContact CD1-CG 4.06Å; L195-Y234 HydrophobicContact CB-CE2 4.08Å; L195-Y234 HydrophobicContact CD1-CD2 4.16Å; L195-Y234 HydrophobicContact CD1-CE2 4.16Å; L195-Y234 HydrophobicContact CD2-CE2 4.25Å; L195-Y234 HydrophobicContact CG-CE2 4.42Å; F196-Y234 HydrophobicContact CE1-CD2 4.17Å; F196-Y234 HydrophobicContact CE1-CE2 4.21Å; F196-Y234 AromaticContact CZ-CD2 3.91Å; F196-Y234 HydrophobicContact CZ-CD2 3.91Å; F196-Y234 HydrophobicContact CZ-CE2 4.25Å; L230-Y234 VanDerWaalsContact O-CB 3.26Å; L230-Y234 WeakPolarHBondContact O-CB 3.36Å; L230-Y234 PolarHBondContact O-N 2.93Å; Y234-R236 VanDerWaalsContact C-N 3.33Å; Y234-R236 PolarHBondContact O-N 3.31Å; Y234-I237 PolarHBondContact O-N 3.08Å; Y234-C238 VanDerWaalsContact CE2-SG 3.55Å; Y234-C238 PolarHBondContact O-N 3.4Å; Y234-C238 PolarHBondContact O-SG 2.72Å; Y234-V244 HydrophobicContact CE2-CG1 3.86Å; Y234-V244 PolarHBondContact OH-O 3.24Å
235	H	98.6	Very high	97.9	Very high	29 Å²	29	48 Å²	48	13%	0.134	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-43.9	176.9	-179.5	57	0	0	0	111.8	V168 Y172 C231 F232 V233 C238 Q239	V168-H235 HydrophobicContact CG1-CB 3.67Å; Y172-H235 HydrophobicContact CD1-CB 4.41Å; Y172-H235 AromaticContact CD1-ND1 3.61Å; Y172-H235 AromaticContact CD2-CE1 3.87Å; Y172-H235 AromaticContact CD2-ND1 3.31Å; Y172-H235 VanDerWaalsContact CD2-ND1 3.31Å; Y172-H235 WeakPolarHBondContact CD2-ND1 3.45Å; Y172-H235 AromaticContact CE1-ND1 3.59Å; Y172-H235 AromaticContact CE2-CE1 3.49Å; Y172-H235 VanDerWaalsContact CE2-CE1 3.49Å; Y172-H235 WeakPolarHBondContact CE2-CE1 3.27Å; Y172-H235 AromaticContact CE2-ND1 3.28Å; Y172-H235 VanDerWaalsContact CE2-ND1 3.28Å; Y172-H235 WeakPolarHBondContact CE2-ND1 3.47Å; Y172-H235 HydrophobicContact CG-CB 4.36Å; Y172-H235 AromaticContact CG-ND1 3.48Å; Y172-H235 AromaticContact CZ-CE1 3.77Å; Y172-H235 AromaticContact CZ-ND1 3.43Å; C231-H235 VanDerWaalsContact O-CB 3.27Å; C231-H235 WeakPolarHBondContact O-CB 3.4Å; C231-H235 PolarHBondContact O-N 2.52Å; F232-H235 PolarHBondContact O-N 3.21Å; V233-H235 PolarHBondContact O-N 2.71Å; H235-C238 PolarHBondContact O-N 2.96Å; H235-Q239 PolarHBondContact NE2-NE2 3.07Å; H235-Q239 VanDerWaalsContact NE2-NE2 3.17Å; H235-Q239 WeakPolarHBondContact O-CG 3.42Å; H235-Q239 PolarHBondContact O-N 3.32Å
236	R	98.4	Very high	97.8	Very high	116 Å²	116	52 Å²	52	44%	0.438	25%	0.25	S	S	.	.	H	α-helix	trans	-60.8	-44.7	175.5	-176.3	-172.2	178.9	-156.5	1.9	112.3	E210 F232 V233 Y234 C238 Q239 I240	E210-R236 IonicContact OE1-NH1 3.06Å; E210-R236 IonicContact OE2-CZ 2.62Å; E210-R236 IonicContact OE2-NH1 3.07Å; E210-R236 PolarHBondContact OE2-NH1 2.62Å; F232-R236 PolarHBondContact O-N 3.45Å; V233-R236 WeakPolarHBondContact O-CB 3.37Å; V233-R236 PolarHBondContact O-N 2.85Å; Y234-R236 VanDerWaalsContact C-N 3.33Å; Y234-R236 PolarHBondContact O-N 3.31Å; R236-C238 VanDerWaalsContact C-N 3.31Å; R236-C238 PolarHBondContact O-N 2.84Å; R236-Q239 WeakPolarHBondContact O-CB 3.06Å; R236-Q239 PolarHBondContact O-N 3.43Å; R236-Q239 VanDerWaalsContact O-N 3.1Å; R236-I240 HydrophobicContact CG-CD1 4.45Å; R236-I240 PolarHBondContact O-N 2.93Å
237	I	98.5	Very high	97.7	Very high	3 Å²	3	52 Å²	52	2%	0.015	25%	0.25	C	S	.	.	H	α-helix	trans	-57.8	-47.4	175.7	-68.7	167.1	0	0	0	109.6	F196 L203 Q206 L207 V233 Y234 Q239 I240 E241 V244	F196-I237 HydrophobicContact CE1-CD1 4.29Å; F196-I237 HydrophobicContact CE1-CG2 4.04Å; F196-I237 HydrophobicContact CZ-CD1 4.27Å; L203-I237 HydrophobicContact CD2-CG2 4.14Å; Q206-I237 HydrophobicContact CG-CD1 4.43Å; L207-I237 HydrophobicContact CB-CD1 4.4Å; V233-I237 HydrophobicContact CG1-CD1 3.99Å; V233-I237 HydrophobicContact CG1-CG1 4.45Å; V233-I237 WeakPolarHBondContact O-CG1 3.3Å; V233-I237 PolarHBondContact O-N 2.99Å; Y234-I237 PolarHBondContact O-N 3.08Å; I237-Q239 PolarHBondContact O-N 3.31Å; I237-I240 PolarHBondContact O-N 2.83Å; I237-I240 VanDerWaalsContact O-N 3.11Å; I237-E241 PolarHBondContact O-N 3.23Å; I237-V244 HydrophobicContact CG2-CG1 4.34Å; I237-V244 HydrophobicContact CG2-CG2 4.36Å
238	C	98.3	Very high	97.6	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.02	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-22.9	177.4	-65	0	0	0	0	114.3	Y172 Y234 H235 R236 E241 P242 F245	Y172-C238 HydrophobicContact CD1-CB 4.15Å; Y172-C238 HydrophobicContact CE1-CB 3.56Å; Y234-C238 VanDerWaalsContact CE2-SG 3.55Å; Y234-C238 PolarHBondContact O-N 3.4Å; Y234-C238 PolarHBondContact O-SG 2.72Å; H235-C238 PolarHBondContact O-N 2.96Å; R236-C238 VanDerWaalsContact C-N 3.31Å; R236-C238 PolarHBondContact O-N 2.84Å; C238-E241 CarbonylContact O-C 3.48Å; C238-P242 VanDerWaalsContact O-CA 3.31Å; C238-P242 WeakPolarHBondContact O-CA 3.49Å; C238-F245 HydrophobicContact CB-CB 4.16Å
239	Q	97.8	Very high	97.4	Very high	126 Å²	126	51 Å²	51	59%	0.589	25%	0.251	S	S	*	.	H	α-helix	trans	-75	-33.1	173.5	-74.1	178.1	-33.8	0	0	112.2	H235 R236 I237	H235-Q239 PolarHBondContact NE2-NE2 3.07Å; H235-Q239 VanDerWaalsContact NE2-NE2 3.17Å; H235-Q239 WeakPolarHBondContact O-CG 3.42Å; H235-Q239 PolarHBondContact O-N 3.32Å; R236-Q239 WeakPolarHBondContact O-CB 3.06Å; R236-Q239 PolarHBondContact O-N 3.43Å; R236-Q239 VanDerWaalsContact O-N 3.1Å; I237-Q239 PolarHBondContact O-N 3.31Å
240	I	97.7	Very high	97.2	Very high	109 Å²	109	53 Å²	53	56%	0.559	26%	0.259	S	S	*	.	H	α-helix	trans	-79.2	-37.7	176.2	-60.7	169.3	0	0	0	109.9	R236 I237	R236-I240 HydrophobicContact CG-CD1 4.45Å; R236-I240 PolarHBondContact O-N 2.93Å; I237-I240 PolarHBondContact O-N 2.83Å; I237-I240 VanDerWaalsContact O-N 3.11Å
241	E	96.2	Very high	97	Very high	41 Å²	41	55.6 Å²	55.6	19%	0.192	28%	0.275	C	S	.	.			trans	-129.6	84.5	-174.8	-57.9	-176.4	-178.2	0	0	110.3	R200 I237 C238 D243 V244	R200-E241 IonicContact CZ-OE1 3.39Å; R200-E241 IonicContact CZ-OE2 3.92Å; R200-E241 VanDerWaalsContact NH1-CD 3.26Å; R200-E241 IonicContact NH1-OE1 3.75Å; R200-E241 PolarHBondContact NH1-OE1 2.83Å; R200-E241 IonicContact NH1-OE2 3.98Å; R200-E241 PolarHBondContact NH1-OE2 3.25Å; R200-E241 VanDerWaalsContact NH2-CD 3.25Å; R200-E241 IonicContact NH2-OE1 2.89Å; R200-E241 PolarHBondContact NH2-OE1 2.8Å; R200-E241 IonicContact NH2-OE2 2.79Å; R200-E241 PolarHBondContact NH2-OE2 2.73Å; I237-E241 PolarHBondContact O-N 3.23Å; C238-E241 CarbonylContact O-C 3.48Å; E241-D243 PolarHBondContact O-N 2.88Å; E241-D243 VanDerWaalsContact O-N 3.15Å; E241-V244 HydrophobicContact CB-CG2 3.8Å; E241-V244 WeakPolarHBondContact O-CB 3.28Å; E241-V244 PolarHBondContact O-N 2.8Å; E241-V244 VanDerWaalsContact O-N 3.11Å
242	P	93.4	Very high	96.8	Very high	87 Å²	87	66.7 Å²	66.7	57%	0.565	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28	-174.2	-27.8	36.7	0	0	0	114.7	C238 V244 F245	C238-P242 VanDerWaalsContact O-CA 3.31Å; C238-P242 WeakPolarHBondContact O-CA 3.49Å; P242-V244 PolarHBondContact O-N 3.36Å; P242-F245 PolarHBondContact O-N 2.84Å; P242-F245 VanDerWaalsContact O-N 3.16Å
243	D	94.8	Very high	96.6	Very high	89 Å²	89	66.3 Å²	66.3	48%	0.476	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-25.9	178.2	61	-60.4	0	0	0	113.2	E241 F245 D246 F247	E241-D243 PolarHBondContact O-N 2.88Å; E241-D243 VanDerWaalsContact O-N 3.15Å; D243-F245 VanDerWaalsContact C-N 3.29Å; D243-F245 PolarHBondContact O-N 3.39Å; D243-D246 PolarHBondContact O-N 3.01Å; D243-F247 PolarHBondContact O-N 2.78Å
244	V	97	Very high	96.4	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-32.4	177.5	176.9	0	0	0	0	111.9	K175 F196 L203 Y234 I237 E241 P242	K175-V244 PolarHBondContact NZ-O 3.28Å; K175-V244 VanDerWaalsContact NZ-O 3.16Å; F196-V244 HydrophobicContact CD1-CG1 3.59Å; F196-V244 HydrophobicContact CE1-CG1 3.64Å; L203-V244 HydrophobicContact CD1-CG2 4.08Å; Y234-V244 HydrophobicContact CE2-CG1 3.86Å; Y234-V244 PolarHBondContact OH-O 3.24Å; I237-V244 HydrophobicContact CG2-CG1 4.34Å; I237-V244 HydrophobicContact CG2-CG2 4.36Å; E241-V244 HydrophobicContact CB-CG2 3.8Å; E241-V244 WeakPolarHBondContact O-CB 3.28Å; E241-V244 PolarHBondContact O-N 2.8Å; E241-V244 VanDerWaalsContact O-N 3.11Å; P242-V244 PolarHBondContact O-N 3.36Å
245	F	97.9	Very high	96.2	Very high	57 Å²	57	69.9 Å²	69.9	25%	0.25	34%	0.343	C	S	.	.	H	α-helix	trans	-72.9	-33	178.2	-176.9	-101.9	0	0	0	112.6	P171 Y172 K175 C238 P242 D243	P171-F245 HydrophobicContact CB-CE2 4.22Å; P171-F245 HydrophobicContact CB-CZ 3.76Å; Y172-F245 AromaticContact CD1-CD2 3.46Å; Y172-F245 HydrophobicContact CD1-CD2 3.46Å; Y172-F245 VanDerWaalsContact CD1-CD2 3.46Å; Y172-F245 AromaticContact CD1-CE2 3.79Å; Y172-F245 HydrophobicContact CD1-CE2 3.79Å; Y172-F245 HydrophobicContact CD1-CG 4.39Å; Y172-F245 HydrophobicContact CE1-CB 4.15Å; Y172-F245 AromaticContact CE1-CD2 3.32Å; Y172-F245 HydrophobicContact CE1-CD2 3.32Å; Y172-F245 AromaticContact CE1-CE2 3.9Å; Y172-F245 HydrophobicContact CE1-CE2 3.9Å; Y172-F245 AromaticContact CE1-CG 3.83Å; Y172-F245 HydrophobicContact CE1-CG 3.83Å; Y172-F245 HydrophobicContact CG-CD2 4.26Å; Y172-F245 HydrophobicContact CG-CE2 4.14Å; K175-F245 HydrophobicContact CD-CD2 4.27Å; K175-F245 HydrophobicContact CD-CE2 4.21Å; K175-F245 VanDerWaalsContact NZ-C 3.32Å; K175-F245 PolarHBondContact NZ-O 2.94Å; C238-F245 HydrophobicContact CB-CB 4.16Å; P242-F245 PolarHBondContact O-N 2.84Å; P242-F245 VanDerWaalsContact O-N 3.16Å; D243-F245 VanDerWaalsContact C-N 3.29Å; D243-F245 PolarHBondContact O-N 3.39Å
246	D	96.2	Very high	96	Very high	132 Å²	132	72 Å²	72	71%	0.706	36%	0.36	S	S	*	.	H	α-helix	trans	-87.9	-13.7	178.4	-66	-38.1	0	0	0	112.9	D243 D248	D243-D246 PolarHBondContact O-N 3.01Å; D246-D248 PolarHBondContact O-N 2.81Å
247	F	96.7	Very high	95.8	Very high	22 Å²	22	69.7 Å²	69.7	10%	0.096	36%	0.356	C	S	.	.			trans	-58	128.9	177.5	176.5	-98.5	0	0	0	112.7	K175 T194 L195 F196 P197 D243 N254	K175-F247 PolarHBondContact NZ-O 3.4Å; T194-F247 WeakPolarHBondContact O-CE1 3.4Å; L195-F247 WeakPolarHBondContact O-CD1 3.25Å; F196-F247 WeakPolarHBondContact O-CE1 3.45Å; F196-F247 WeakPolarHBondContact O-CZ 3.48Å; P197-F247 HydrophobicContact CB-CD2 4.4Å; P197-F247 HydrophobicContact CB-CE2 4.08Å; P197-F247 HydrophobicContact CB-CZ 4.46Å; P197-F247 HydrophobicContact CG-CD2 3.75Å; P197-F247 HydrophobicContact CG-CE2 3.94Å; P197-F247 HydrophobicContact CG-CG 4.15Å; P197-F247 HydrophobicContact CG-CZ 4.5Å; D243-F247 PolarHBondContact O-N 2.78Å; F247-N254 HydrophobicContact CE2-CB 4.17Å; F247-N254 VanDerWaalsContact CE2-ND2 3.29Å; F247-N254 WeakPolarHBondContact CE2-ND2 3.33Å
248	D	96.6	Very high	95.6	Very high	61 Å²	61	70.7 Å²	70.7	33%	0.326	36%	0.359	S	S	.	.			trans	-135.3	117.1	169.9	177.6	4.8	0	0	0	110.1	D246 Q250 T251 N254	D246-D248 PolarHBondContact O-N 2.81Å; D248-Q250 PolarHBondContact O-N 2.85Å; D248-Q250 WeakPolarHBondContact OD1-CB 3.49Å; D248-Q250 PolarHBondContact OD1-N 3.24Å; D248-T251 HydrophobicContact CB-CG2 3.81Å; D248-T251 WeakPolarHBondContact O-CG2 3.44Å; D248-T251 PolarHBondContact O-N 2.94Å; D248-T251 PolarHBondContact O-OG1 3.12Å; D248-N254 PolarHBondContact O-ND2 3.41Å
249	Y	94.8	Very high	95.4	Very high	12 Å²	12	78.5 Å²	78.5	5%	0.047	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.1	-178.4	80.5	-83.4	0	0	0	113.7	T194 W258	T194-Y249 HydrophobicContact CG2-CD1 4.09Å; T194-Y249 HydrophobicContact CG2-CE1 3.8Å; Y249-W258 AromaticContact CD2-CD1 3.9Å; Y249-W258 AromaticContact CD2-CD2 3.54Å; Y249-W258 HydrophobicContact CD2-CD2 3.54Å; Y249-W258 AromaticContact CD2-CE2 3.62Å; Y249-W258 HydrophobicContact CD2-CE3 4.01Å; Y249-W258 AromaticContact CD2-CG 3.76Å; Y249-W258 HydrophobicContact CD2-CG 3.76Å; Y249-W258 HydrophobicContact CD2-CZ2 4.18Å; Y249-W258 AromaticContact CD2-NE1 3.8Å; Y249-W258 HydrophobicContact CE2-CD2 4.23Å; Y249-W258 AromaticContact CE2-CE2 3.81Å; Y249-W258 HydrophobicContact CE2-CZ2 4.14Å; Y249-W258 AromaticContact CE2-NE1 3.81Å; Y249-W258 HydrophobicContact CG-CD2 4.26Å; Y249-W258 HydrophobicContact CG-CE3 4.29Å
250	Q	94.4	Very high	95.3	Very high	91 Å²	91	76.8 Å²	76.8	43%	0.425	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-11.5	-177.9	-58	-175.3	-11.6	0	0	113	D248	D248-Q250 PolarHBondContact O-N 2.85Å; D248-Q250 WeakPolarHBondContact OD1-CB 3.49Å; D248-Q250 PolarHBondContact OD1-N 3.24Å
251	T	95.5	Very high	95.2	Very high	55 Å²	55	74.2 Å²	74.2	34%	0.337	37%	0.368	S	S	.	.	S	Bend	trans	-64.8	148.8	178.5	61.1	0	0	0	0	111.3	D248 V253 N254 L255	D248-T251 HydrophobicContact CB-CG2 3.81Å; D248-T251 WeakPolarHBondContact O-CG2 3.44Å; D248-T251 PolarHBondContact O-N 2.94Å; D248-T251 PolarHBondContact O-OG1 3.12Å; T251-V253 PolarHBondContact O-N 3.28Å; T251-V253 VanDerWaalsContact O-N 3.09Å; T251-N254 PolarHBondContact O-N 2.94Å; T251-N254 WeakPolarHBondContact OG1-CB 3.41Å; T251-N254 PolarHBondContact OG1-ND2 2.91Å; T251-N254 VanDerWaalsContact OG1-ND2 3.09Å; T251-L255 WeakPolarHBondContact O-CG 3.5Å; T251-L255 PolarHBondContact O-N 3.29Å
252	R	94.9	Very high	95.2	Very high	233 Å²	233	78.4 Å²	78.4	88%	0.879	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-33.6	-178.6	-70.2	-169.6	-177.9	-164.5	2	113.5	P256	R252-P256 WeakPolarHBondContact O-CD 3.48Å
253	V	93.9	Very high	95.3	Very high	121 Å²	121	80.3 Å²	80.3	73%	0.733	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-37.8	179.1	-178.7	0	0	0	0	111.5	T251	T251-V253 PolarHBondContact O-N 3.28Å; T251-V253 VanDerWaalsContact O-N 3.09Å
254	N	94.6	Very high	95.3	Very high	33 Å²	33	77.1 Å²	77.1	18%	0.176	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-20.2	-174.4	-66.1	-27.2	0	0	0	113.9	F247 D248 T251 L257 W258	F247-N254 HydrophobicContact CE2-CB 4.17Å; F247-N254 VanDerWaalsContact CE2-ND2 3.29Å; F247-N254 WeakPolarHBondContact CE2-ND2 3.33Å; D248-N254 PolarHBondContact O-ND2 3.41Å; T251-N254 PolarHBondContact O-N 2.94Å; T251-N254 WeakPolarHBondContact OG1-CB 3.41Å; T251-N254 PolarHBondContact OG1-ND2 2.91Å; T251-N254 VanDerWaalsContact OG1-ND2 3.09Å; N254-L257 WeakPolarHBondContact O-CB 3.18Å; N254-L257 PolarHBondContact O-N 2.84Å; N254-L257 VanDerWaalsContact O-N 3.09Å; N254-W258 PolarHBondContact O-N 3.19Å
255	L	94.2	Very high	95.3	Very high	47 Å²	47	77.4 Å²	77.4	25%	0.246	37%	0.369	C	S	.	.	H	α-helix	trans	-53.1	-44.6	-179.4	-81.6	173.9	0	0	0	114.1	T251 L257 W258 Y259	T251-L255 WeakPolarHBondContact O-CG 3.5Å; T251-L255 PolarHBondContact O-N 3.29Å; L255-L257 VanDerWaalsContact C-N 3.32Å; L255-L257 PolarHBondContact O-N 3.48Å; L255-W258 PolarHBondContact O-N 3.04Å; L255-Y259 HydrophobicContact CB-CD2 4.44Å; L255-Y259 HydrophobicContact CB-CE2 4.03Å; L255-Y259 HydrophobicContact CD2-CE2 4.27Å; L255-Y259 WeakPolarHBondContact O-CD2 3.41Å; L255-Y259 PolarHBondContact O-N 3.27Å
256	P	94.2	Very high	95.2	Very high	73 Å²	73	80.4 Å²	80.4	47%	0.474	38%	0.379	S	S	.	.	H	α-helix	trans	-60	-39.2	176.5	-25.1	35.5	0	0	0	113.5	R252 N260	R252-P256 WeakPolarHBondContact O-CD 3.48Å; P256-N260 PolarHBondContact O-N 3.04Å; P256-N260 PolarHBondContact O-ND2 2.77Å
257	L	93.7	Very high	95.2	Very high	69 Å²	69	79.5 Å²	79.5	36%	0.361	37%	0.37	S	S	.	.	H	α-helix	trans	-66.7	-42.6	175.1	-64.4	175	0	0	0	110.6	N254 L255 N260 R261 I264	N254-L257 WeakPolarHBondContact O-CB 3.18Å; N254-L257 PolarHBondContact O-N 2.84Å; N254-L257 VanDerWaalsContact O-N 3.09Å; L255-L257 VanDerWaalsContact C-N 3.32Å; L255-L257 PolarHBondContact O-N 3.48Å; L257-N260 CarbonylContact O-C 3.58Å; L257-N260 PolarHBondContact O-N 3.03Å; L257-R261 WeakPolarHBondContact O-CA 3.5Å; L257-R261 PolarHBondContact O-N 3.12Å; L257-I264 HydrophobicContact CB-CD1 4.28Å; L257-I264 HydrophobicContact CD2-CD1 3.81Å
258	W	94.5	Very high	95.1	Very high	23 Å²	23	83.4 Å²	83.4	9%	0.087	39%	0.39	C	S	.	.	H	α-helix	trans	-64.1	-41.2	178.8	179.8	-106.1	0	0	0	113.2	E193 T194 Y249 N254 L255 N260 R261	E193-W258 HydrophobicContact CG-CH2 3.82Å; E193-W258 HydrophobicContact CG-CZ3 4.06Å; E193-W258 WeakPolarHBondContact OE1-CH2 3.18Å; T194-W258 HydrophobicContact CG2-CH2 3.54Å; T194-W258 HydrophobicContact CG2-CZ2 4.08Å; T194-W258 HydrophobicContact CG2-CZ3 4.14Å; Y249-W258 AromaticContact CD2-CD1 3.9Å; Y249-W258 AromaticContact CD2-CD2 3.54Å; Y249-W258 HydrophobicContact CD2-CD2 3.54Å; Y249-W258 AromaticContact CD2-CE2 3.62Å; Y249-W258 HydrophobicContact CD2-CE3 4.01Å; Y249-W258 AromaticContact CD2-CG 3.76Å; Y249-W258 HydrophobicContact CD2-CG 3.76Å; Y249-W258 HydrophobicContact CD2-CZ2 4.18Å; Y249-W258 AromaticContact CD2-NE1 3.8Å; Y249-W258 HydrophobicContact CE2-CD2 4.23Å; Y249-W258 AromaticContact CE2-CE2 3.81Å; Y249-W258 HydrophobicContact CE2-CZ2 4.14Å; Y249-W258 AromaticContact CE2-NE1 3.81Å; Y249-W258 HydrophobicContact CG-CD2 4.26Å; Y249-W258 HydrophobicContact CG-CE3 4.29Å; N254-W258 PolarHBondContact O-N 3.19Å; L255-W258 PolarHBondContact O-N 3.04Å; W258-N260 VanDerWaalsContact C-N 3.29Å; W258-N260 PolarHBondContact O-N 2.97Å; W258-R261 VanDerWaalsContact O-CB 3.29Å; W258-R261 WeakPolarHBondContact O-CB 3.43Å; W258-R261 WeakPolarHBondContact O-CD 2.73Å; W258-R261 WeakPolarHBondContact O-CG 3Å; W258-R261 PolarHBondContact O-N 2.93Å; W258-R261 PolarHBondContact O-NH1 2.91Å
259	Y	95.1	Very high	95	Very high	167 Å²	167	81.6 Å²	81.6	66%	0.655	38%	0.38	S	S	*	.	H	α-helix	trans	-63.8	-36.9	175.6	-69.7	-47.7	0	0	0	111.7	L255	L255-Y259 HydrophobicContact CB-CD2 4.44Å; L255-Y259 HydrophobicContact CB-CE2 4.03Å; L255-Y259 HydrophobicContact CD2-CE2 4.27Å; L255-Y259 WeakPolarHBondContact O-CD2 3.41Å; L255-Y259 PolarHBondContact O-N 3.27Å
260	N	95.8	Very high	94.9	Very high	90 Å²	90	88.4 Å²	88.4	48%	0.481	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	4.4	176.9	-68.2	-64.9	0	0	0	113.9	P256 L257 W258 K262 K263 I264	P256-N260 PolarHBondContact O-N 3.04Å; P256-N260 PolarHBondContact O-ND2 2.77Å; L257-N260 CarbonylContact O-C 3.58Å; L257-N260 PolarHBondContact O-N 3.03Å; W258-N260 VanDerWaalsContact C-N 3.29Å; W258-N260 PolarHBondContact O-N 2.97Å; N260-K262 VanDerWaalsContact C-N 3.26Å; N260-K262 PolarHBondContact O-N 2.79Å; N260-K263 WeakPolarHBondContact O-CB 3.23Å; N260-K263 PolarHBondContact O-N 2.97Å; N260-I264 HydrophobicContact CB-CD1 4.01Å; N260-I264 HydrophobicContact CB-CG1 4.32Å; N260-I264 PolarHBondContact O-N 2.84Å
261	R	96	Very high	94.6	Very high	55 Å²	55	84.9 Å²	84.9	21%	0.208	40%	0.403	C	S	.	.	H	α-helix	trans	-54.4	-38.3	-168.6	75.3	-171.3	178.9	-76.8	4.2	113.8	E193 S198 L257 W258 K263 I264 Q265	E193-R261 IonicContact OE1-NE 3.84Å; E193-R261 PolarHBondContact OE1-NE 2.9Å; E193-R261 VanDerWaalsContact OE1-NE 3.11Å; S198-R261 WeakPolarHBondContact OG-CB 3.36Å; L257-R261 WeakPolarHBondContact O-CA 3.5Å; L257-R261 PolarHBondContact O-N 3.12Å; W258-R261 VanDerWaalsContact O-CB 3.29Å; W258-R261 WeakPolarHBondContact O-CB 3.43Å; W258-R261 WeakPolarHBondContact O-CD 2.73Å; W258-R261 WeakPolarHBondContact O-CG 3Å; W258-R261 PolarHBondContact O-N 2.93Å; W258-R261 PolarHBondContact O-NH1 2.91Å; R261-K263 VanDerWaalsContact C-N 3.3Å; R261-K263 PolarHBondContact O-N 3.31Å; R261-I264 PolarHBondContact O-N 2.84Å; R261-Q265 WeakPolarHBondContact O-CB 3.49Å; R261-Q265 WeakPolarHBondContact O-CG 3.43Å; R261-Q265 PolarHBondContact O-N 3.09Å
262	K	94.8	Very high	94.4	Very high	130 Å²	130	87.7 Å²	87.7	57%	0.565	42%	0.422	S	S	*	.	H	α-helix	trans	-62.9	-38.9	-179.9	-70.5	-176	178.8	178.3	0	111.7	N260 R266	N260-K262 VanDerWaalsContact C-N 3.26Å; N260-K262 PolarHBondContact O-N 2.79Å; K262-R266 WeakPolarHBondContact O-CD 3.2Å; K262-R266 WeakPolarHBondContact O-CG 3.37Å; K262-R266 PolarHBondContact O-N 2.99Å
263	K	96	Very high	94.1	Very high	126 Å²	126	80.7 Å²	80.7	55%	0.548	41%	0.405	S	S	.	.	H	α-helix	trans	-68.6	-50.5	175.9	178.7	-179.4	170.4	-177.7	0	109.8	N260 R261 Q265 R266 E267	N260-K263 WeakPolarHBondContact O-CB 3.23Å; N260-K263 PolarHBondContact O-N 2.97Å; R261-K263 VanDerWaalsContact C-N 3.3Å; R261-K263 PolarHBondContact O-N 3.31Å; K263-Q265 VanDerWaalsContact C-N 3.35Å; K263-Q265 PolarHBondContact O-N 3.28Å; K263-R266 WeakPolarHBondContact O-CB 3.37Å; K263-R266 PolarHBondContact O-N 3.45Å; K263-R266 VanDerWaalsContact O-N 3.1Å; K263-E267 WeakPolarHBondContact CE-OE1 3.33Å; K263-E267 WeakPolarHBondContact CG-OE1 3.47Å; K263-E267 IonicContact NZ-OE1 3.11Å; K263-E267 PolarHBondContact O-N 3.05Å; K263-E267 VanDerWaalsContact O-N 3.1Å
264	I	95.7	Very high	94	Very high	23 Å²	23	74.9 Å²	74.9	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-57.7	-46.7	179.6	-62.6	170.1	0	0	0	111.1	S198 N199 L257 N260 R261 R266 E267 M268	S198-I264 WeakPolarHBondContact O-CG2 3.1Å; N199-I264 HydrophobicContact CB-CG2 3.82Å; L257-I264 HydrophobicContact CB-CD1 4.28Å; L257-I264 HydrophobicContact CD2-CD1 3.81Å; N260-I264 HydrophobicContact CB-CD1 4.01Å; N260-I264 HydrophobicContact CB-CG1 4.32Å; N260-I264 PolarHBondContact O-N 2.84Å; R261-I264 PolarHBondContact O-N 2.84Å; I264-R266 VanDerWaalsContact C-N 3.29Å; I264-R266 PolarHBondContact O-N 3.22Å; I264-E267 PolarHBondContact O-N 3.43Å; I264-M268 HydrophobicContact CG2-CG 4.04Å; I264-M268 WeakPolarHBondContact O-CB 3.38Å; I264-M268 VanDerWaalsContact O-CG 3.29Å; I264-M268 WeakPolarHBondContact O-CG 3.32Å; I264-M268 PolarHBondContact O-N 3.02Å
265	Q	96.3	Very high	94	Very high	6 Å²	6	73.3 Å²	73.3	3%	0.028	36%	0.362	C	S	.	.	H	α-helix	trans	-63.4	-32.4	179	-72	170.9	-14.4	0	0	112.8	E193 P201 R261 K263 L269 L275	E193-Q265 PolarHBondContact OE2-NE2 3.41Å; P201-Q265 HydrophobicContact CB-CG 4.23Å; R261-Q265 WeakPolarHBondContact O-CB 3.49Å; R261-Q265 WeakPolarHBondContact O-CG 3.43Å; R261-Q265 PolarHBondContact O-N 3.09Å; K263-Q265 VanDerWaalsContact C-N 3.35Å; K263-Q265 PolarHBondContact O-N 3.28Å; Q265-L269 VanDerWaalsContact O-CB 3.27Å; Q265-L269 WeakPolarHBondContact O-CB 3.45Å; Q265-L269 WeakPolarHBondContact O-CG 3.14Å; Q265-L269 PolarHBondContact O-N 2.9Å; Q265-L269 VanDerWaalsContact O-N 3.12Å; Q265-L275 HydrophobicContact CB-CB 4.47Å; Q265-L275 HydrophobicContact CG-CB 4.36Å
266	R	96	Very high	94	Very high	120 Å²	120	72.5 Å²	72.5	45%	0.453	36%	0.358	S	S	.	.	H	α-helix	trans	-68.4	-42.9	174.4	-71.8	166.3	-176.3	175.5	-2.2	111.2	K262 K263 I264 D270 S271 P272	K262-R266 WeakPolarHBondContact O-CD 3.2Å; K262-R266 WeakPolarHBondContact O-CG 3.37Å; K262-R266 PolarHBondContact O-N 2.99Å; K263-R266 WeakPolarHBondContact O-CB 3.37Å; K263-R266 PolarHBondContact O-N 3.45Å; K263-R266 VanDerWaalsContact O-N 3.1Å; I264-R266 VanDerWaalsContact C-N 3.29Å; I264-R266 PolarHBondContact O-N 3.22Å; R266-D270 WeakPolarHBondContact O-CA 3.41Å; R266-D270 PolarHBondContact O-N 2.49Å; R266-D270 VanDerWaalsContact O-N 3.16Å; R266-S271 VanDerWaalsContact CA-O 3.26Å; R266-S271 WeakPolarHBondContact CA-O 3.3Å; R266-S271 WeakPolarHBondContact CB-O 3.29Å; R266-S271 VanDerWaalsContact CG-O 3.25Å; R266-S271 WeakPolarHBondContact CG-O 3.49Å; R266-S271 PolarHBondContact O-N 2.94Å; R266-P272 WeakPolarHBondContact CD-O 3.01Å; R266-P272 PolarHBondContact NE-O 2.84Å
267	E	96	Very high	94.1	Very high	112 Å²	112	69.1 Å²	69.1	52%	0.523	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-47	177.2	-68.5	168.5	-177.1	0	0	111.3	K263 I264 D270	K263-E267 WeakPolarHBondContact CE-OE1 3.33Å; K263-E267 WeakPolarHBondContact CG-OE1 3.47Å; K263-E267 IonicContact NZ-OE1 3.11Å; K263-E267 PolarHBondContact O-N 3.05Å; K263-E267 VanDerWaalsContact O-N 3.1Å; I264-E267 PolarHBondContact O-N 3.43Å; E267-D270 PolarHBondContact O-N 3.1Å
268	M	95.2	Very high	94.1	Very high	105 Å²	105	70.4 Å²	70.4	52%	0.517	34%	0.344	S	S	.	.	H	α-helix	trans	-69.7	-32.3	-178.4	-65.4	-62.7	103.3	0	0	113.7	P201 I264	P201-M268 HydrophobicContact CG-CB 3.76Å; I264-M268 HydrophobicContact CG2-CG 4.04Å; I264-M268 WeakPolarHBondContact O-CB 3.38Å; I264-M268 VanDerWaalsContact O-CG 3.29Å; I264-M268 WeakPolarHBondContact O-CG 3.32Å; I264-M268 PolarHBondContact O-N 3.02Å
269	L	93.8	Very high	94	Very high	22 Å²	22	72 Å²	72	12%	0.115	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	2.3	-179.9	-65.1	176.4	0	0	0	113.9	P201 I205 Q265 S271 L275	P201-L269 HydrophobicContact CB-CD1 3.92Å; P201-L269 HydrophobicContact CB-CD2 4.02Å; P201-L269 HydrophobicContact CB-CG 3.94Å; P201-L269 HydrophobicContact CG-CD1 4.13Å; P201-L269 HydrophobicContact CG-CD2 3.71Å; P201-L269 HydrophobicContact CG-CG 3.59Å; I205-L269 HydrophobicContact CD1-CD1 4.39Å; I205-L269 HydrophobicContact CD1-CD2 3.64Å; Q265-L269 VanDerWaalsContact O-CB 3.27Å; Q265-L269 WeakPolarHBondContact O-CB 3.45Å; Q265-L269 WeakPolarHBondContact O-CG 3.14Å; Q265-L269 PolarHBondContact O-N 2.9Å; Q265-L269 VanDerWaalsContact O-N 3.12Å; L269-S271 PolarHBondContact O-N 2.82Å; L269-L275 HydrophobicContact CD1-CB 4.09Å; L269-L275 HydrophobicContact CD1-CD1 4.42Å
270	D	92.1	Very high	93.9	Very high	156 Å²	156	64 Å²	64	83%	0.834	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.6	51.2	-170.8	-167.6	29.3	0	0	0	111.9	R266 E267	R266-D270 WeakPolarHBondContact O-CA 3.41Å; R266-D270 PolarHBondContact O-N 2.49Å; R266-D270 VanDerWaalsContact O-N 3.16Å; E267-D270 PolarHBondContact O-N 3.1Å
271	S	89.6	Confident	93.8	Very high	17 Å²	17	63.7 Å²	63.7	12%	0.119	31%	0.311	C	S	.	.			trans	-139.4	133.8	-172.6	-177.5	0	0	0	0	111.9	R266 L269 T273 G274	R266-S271 VanDerWaalsContact CA-O 3.26Å; R266-S271 WeakPolarHBondContact CA-O 3.3Å; R266-S271 WeakPolarHBondContact CB-O 3.29Å; R266-S271 VanDerWaalsContact CG-O 3.25Å; R266-S271 WeakPolarHBondContact CG-O 3.49Å; R266-S271 PolarHBondContact O-N 2.94Å; L269-S271 PolarHBondContact O-N 2.82Å; S271-T273 PolarHBondContact O-N 3.19Å; S271-T273 VanDerWaalsContact O-N 3.16Å; S271-G274 PolarHBondContact O-N 2.84Å
272	P	90.2	Very high	93.6	Very high	114 Å²	114	64.6 Å²	64.6	74%	0.74	32%	0.318	S	S	*	.	S	Bend	trans	-63.8	-25.1	179.4	25.6	-34.8	0	0	0	113.1	R266	R266-P272 WeakPolarHBondContact CD-O 3.01Å; R266-P272 PolarHBondContact NE-O 2.84Å
273	T	89.4	Confident	93.3	Very high	85 Å²	85	61.3 Å²	61.3	52%	0.521	30%	0.304	S	S	.	.	S	Bend	trans	-95.1	-18.6	-178.7	65.2	0	0	0	0	113.5	S271	S271-T273 PolarHBondContact O-N 3.19Å; S271-T273 VanDerWaalsContact O-N 3.16Å
274	G	91.8	Very high	93	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.288	C	S	.	.			trans	67	-150.2	-173	0	0	0	0	0	112.2	S271 T276	S271-G274 PolarHBondContact O-N 2.84Å; G274-T276 PolarHBondContact O-N 2.91Å
275	L	93.9	Very high	92.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.305	C	S	.	.	S	Bend	trans	-68.5	122	179.2	-174.8	69.9	0	0	0	109.4	V189 R190 E193 V204 I205 Q265 L269 V280	V189-L275 HydrophobicContact CG2-CD2 4.39Å; V189-L275 HydrophobicContact CG2-CG 4.39Å; R190-L275 PolarHBondContact NH1-O 2.85Å; R190-L275 PolarHBondContact NH2-O 3.41Å; E193-L275 HydrophobicContact CB-CD2 3.91Å; V204-L275 HydrophobicContact CB-CD1 4.28Å; V204-L275 HydrophobicContact CB-CD2 3.92Å; V204-L275 HydrophobicContact CG1-CD1 4.47Å; V204-L275 HydrophobicContact CG1-CD2 3.88Å; V204-L275 HydrophobicContact CG2-CD2 3.96Å; I205-L275 HydrophobicContact CD1-CD1 4.41Å; I205-L275 HydrophobicContact CG1-CD1 3.9Å; Q265-L275 HydrophobicContact CB-CB 4.47Å; Q265-L275 HydrophobicContact CG-CB 4.36Å; L269-L275 HydrophobicContact CD1-CB 4.09Å; L269-L275 HydrophobicContact CD1-CD1 4.42Å; L275-V280 HydrophobicContact CD1-CG2 3.79Å
276	T	94.9	Very high	91.8	Very high	29 Å²	29	64.9 Å²	64.9	18%	0.178	34%	0.337	C	S	.	.			trans	-140.9	158.8	175.4	65.5	0	0	0	0	110.4	G274 N278 R279 V280	G274-T276 PolarHBondContact O-N 2.91Å; T276-N278 PolarHBondContact O-N 2.74Å; T276-R279 PolarHBondContact O-N 2.7Å; T276-R279 VanDerWaalsContact O-N 3.16Å; T276-R279 WeakPolarHBondContact OG1-CB 3.24Å; T276-R279 PolarHBondContact OG1-N 3.23Å; T276-V280 WeakPolarHBondContact O-CG2 3.44Å; T276-V280 PolarHBondContact O-N 3.37Å
277	A	95.1	Very high	90.6	Very high	3 Å²	3	66.6 Å²	66.6	3%	0.025	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-36.1	175.2	0	0	0	0	0	112	V189 P215 A216 R281	V189-A277 HydrophobicContact CG1-CB 4.01Å; P215-A277 HydrophobicContact CB-CB 4.23Å; P215-A277 HydrophobicContact CG-CB 4.23Å; P215-A277 VanDerWaalsContact CG-O 3.29Å; P215-A277 WeakPolarHBondContact CG-O 3.45Å; A216-A277 HydrophobicContact CB-CB 4.04Å; A277-R281 VanDerWaalsContact O-CB 3.26Å; A277-R281 WeakPolarHBondContact O-CB 3.08Å; A277-R281 PolarHBondContact O-N 3.45Å
278	N	94.2	Very high	88.5	Confident	95 Å²	95	66.7 Å²	66.7	51%	0.508	36%	0.361	S	S	.	.	H	α-helix	trans	-66.5	-43.1	175.5	-73.5	-11	0	0	0	111.6	T276 R281 Q282	T276-N278 PolarHBondContact O-N 2.74Å; N278-R281 WeakPolarHBondContact O-CB 3.02Å; N278-R281 PolarHBondContact O-N 3.46Å; N278-R281 PolarHBondContact OD1-NH1 2.86Å; N278-Q282 VanDerWaalsContact O-CG 3.32Å; N278-Q282 WeakPolarHBondContact O-CG 3.45Å; N278-Q282 PolarHBondContact O-N 2.88Å
279	R	91.6	Very high	85.9	Confident	56 Å²	56	73.1 Å²	73.1	21%	0.211	39%	0.39	C	S	.	.	H	α-helix	trans	-60.7	-48.2	175.8	178.5	57.4	-174.9	-103.8	3	111.5	T276 R281 Q282 E283	T276-R279 PolarHBondContact O-N 2.7Å; T276-R279 VanDerWaalsContact O-N 3.16Å; T276-R279 WeakPolarHBondContact OG1-CB 3.24Å; T276-R279 PolarHBondContact OG1-N 3.23Å; R279-R281 VanDerWaalsContact C-N 3.27Å; R279-R281 PolarHBondContact O-N 2.82Å; R279-Q282 WeakPolarHBondContact O-CB 3.41Å; R279-Q282 PolarHBondContact O-N 2.75Å; R279-Q282 VanDerWaalsContact O-N 3.15Å; R279-E283 IonicContact CZ-OE1 2.93Å; R279-E283 IonicContact NE-OE1 2.88Å; R279-E283 PolarHBondContact NE-OE1 2.95Å; R279-E283 IonicContact NH2-OE1 2.56Å; R279-E283 PolarHBondContact NH2-OE1 3.46Å; R279-E283 WeakPolarHBondContact O-CG 3.33Å; R279-E283 PolarHBondContact O-N 3.47Å; R279-E283 VanDerWaalsContact O-N 3.09Å
280	V	94.5	Very high	85.5	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-60.1	-40	176.6	176.7	0	0	0	0	110.9	V189 I205 F208 P215 L275 T276 Q282 E283 I284	V189-V280 HydrophobicContact CG2-CG2 3.94Å; I205-V280 HydrophobicContact CG1-CG2 4.03Å; F208-V280 HydrophobicContact CB-CG1 3.42Å; F208-V280 VanDerWaalsContact CB-CG1 3.42Å; F208-V280 HydrophobicContact CD2-CG1 4.18Å; F208-V280 HydrophobicContact CG-CG1 3.97Å; P215-V280 HydrophobicContact CB-CB 3.97Å; P215-V280 HydrophobicContact CB-CG1 3.81Å; P215-V280 HydrophobicContact CG-CB 3.84Å; P215-V280 HydrophobicContact CG-CG1 3.76Å; L275-V280 HydrophobicContact CD1-CG2 3.79Å; T276-V280 WeakPolarHBondContact O-CG2 3.44Å; T276-V280 PolarHBondContact O-N 3.37Å; V280-Q282 PolarHBondContact O-N 2.93Å; V280-E283 PolarHBondContact O-N 2.76Å; V280-I284 HydrophobicContact CG1-CD1 3.97Å; V280-I284 VanDerWaalsContact O-CG1 3.29Å; V280-I284 WeakPolarHBondContact O-CG1 3.31Å; V280-I284 PolarHBondContact O-N 2.91Å
281	R	93	Very high	85.2	Confident	83 Å²	83	71.4 Å²	71.4	31%	0.313	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-42.2	175.1	-175.5	-176.3	-66.5	142.3	-3.2	112.4	A277 N278 R279 E283 I284 Y285	A277-R281 VanDerWaalsContact O-CB 3.26Å; A277-R281 WeakPolarHBondContact O-CB 3.08Å; A277-R281 PolarHBondContact O-N 3.45Å; N278-R281 WeakPolarHBondContact O-CB 3.02Å; N278-R281 PolarHBondContact O-N 3.46Å; N278-R281 PolarHBondContact OD1-NH1 2.86Å; R279-R281 VanDerWaalsContact C-N 3.27Å; R279-R281 PolarHBondContact O-N 2.82Å; R281-E283 VanDerWaalsContact C-N 3.3Å; R281-E283 PolarHBondContact O-N 3.02Å; R281-I284 PolarHBondContact O-N 3.37Å; R281-Y285 HydrophobicContact CG-CD2 3.54Å; R281-Y285 HydrophobicContact CG-CE2 3.67Å; R281-Y285 VanDerWaalsContact O-CD2 3.25Å; R281-Y285 WeakPolarHBondContact O-CD2 3.31Å; R281-Y285 PolarHBondContact O-N 3.11Å; R281-Y285 VanDerWaalsContact O-N 3.07Å
282	Q	91	Very high	84.9	Confident	75 Å²	75	74.4 Å²	74.4	35%	0.35	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-41.8	175.7	-70.4	168.5	-22.5	0	0	111.1	N278 R279 V280 I284 Y285 G286 F287	N278-Q282 VanDerWaalsContact O-CG 3.32Å; N278-Q282 WeakPolarHBondContact O-CG 3.45Å; N278-Q282 PolarHBondContact O-N 2.88Å; R279-Q282 WeakPolarHBondContact O-CB 3.41Å; R279-Q282 PolarHBondContact O-N 2.75Å; R279-Q282 VanDerWaalsContact O-N 3.15Å; V280-Q282 PolarHBondContact O-N 2.93Å; Q282-I284 VanDerWaalsContact C-N 3.32Å; Q282-I284 PolarHBondContact O-N 3.23Å; Q282-Y285 PolarHBondContact O-N 3.32Å; Q282-G286 WeakPolarHBondContact O-CA 3.33Å; Q282-G286 PolarHBondContact O-N 3.47Å; Q282-F287 WeakPolarHBondContact CG-O 3.3Å
283	E	88.9	Confident	84.6	Confident	61 Å²	61	72.1 Å²	72.1	29%	0.285	38%	0.375	S	S	.	.	H	α-helix	trans	-68.8	-28.1	178.2	-63.7	-72.4	172.8	0	0	113.6	I205 K209 R279 V280 R281	I205-E283 HydrophobicContact CD1-CG 4.46Å; I205-E283 HydrophobicContact CG2-CB 3.6Å; I205-E283 HydrophobicContact CG2-CG 3.69Å; K209-E283 WeakPolarHBondContact CD-O 3.39Å; K209-E283 WeakPolarHBondContact CE-O 3.47Å; K209-E283 PolarHBondContact NZ-O 2.88Å; K209-E283 VanDerWaalsContact NZ-O 3.14Å; R279-E283 IonicContact CZ-OE1 2.93Å; R279-E283 IonicContact NE-OE1 2.88Å; R279-E283 PolarHBondContact NE-OE1 2.95Å; R279-E283 IonicContact NH2-OE1 2.56Å; R279-E283 PolarHBondContact NH2-OE1 3.46Å; R279-E283 WeakPolarHBondContact O-CG 3.33Å; R279-E283 PolarHBondContact O-N 3.47Å; R279-E283 VanDerWaalsContact O-N 3.09Å; V280-E283 PolarHBondContact O-N 2.76Å; R281-E283 VanDerWaalsContact C-N 3.3Å; R281-E283 PolarHBondContact O-N 3.02Å
284	I	89	Confident	84.3	Confident	39 Å²	39	71.3 Å²	71.3	20%	0.2	37%	0.366	C	S	.	.	H	α-helix	trans	-72.4	-47.6	174.3	-69.5	162.6	0	0	0	111	F208 K209 V280 R281 Q282	F208-I284 HydrophobicContact CB-CD1 4.32Å; K209-I284 HydrophobicContact CB-CG1 4.31Å; V280-I284 HydrophobicContact CG1-CD1 3.97Å; V280-I284 VanDerWaalsContact O-CG1 3.29Å; V280-I284 WeakPolarHBondContact O-CG1 3.31Å; V280-I284 PolarHBondContact O-N 2.91Å; R281-I284 PolarHBondContact O-N 3.37Å; Q282-I284 VanDerWaalsContact C-N 3.32Å; Q282-I284 PolarHBondContact O-N 3.23Å
285	Y	88.4	Confident	83.8	Confident	121 Å²	121	76.1 Å²	76.1	48%	0.475	39%	0.391	S	S	.	.	H	α-helix	trans	-100.8	-11.6	-169.1	-64.3	-66.3	0	0	0	115.2	Q214 R281 Q282 F287	Q214-Y285 PolarHBondContact NE2-OH 3.1Å; R281-Y285 HydrophobicContact CG-CD2 3.54Å; R281-Y285 HydrophobicContact CG-CE2 3.67Å; R281-Y285 VanDerWaalsContact O-CD2 3.25Å; R281-Y285 WeakPolarHBondContact O-CD2 3.31Å; R281-Y285 PolarHBondContact O-N 3.11Å; R281-Y285 VanDerWaalsContact O-N 3.07Å; Q282-Y285 PolarHBondContact O-N 3.32Å; Y285-F287 WeakPolarHBondContact O-CD2 3.48Å; Y285-F287 PolarHBondContact O-N 2.97Å
286	G	79.9	Confident	83.1	Confident	69 Å²	69	81.5 Å²	81.5	71%	0.711	42%	0.419	S	S	*	.			trans	72	7.4	-179.8	0	0	0	0	0	115.4	Q282	Q282-G286 WeakPolarHBondContact O-CA 3.33Å; Q282-G286 PolarHBondContact O-N 3.47Å
287	F	69.3	Low	82.2	Confident	157 Å²	157	85.5 Å²	85.5	69%	0.689	44%	0.437	S	S	*	.			trans	-96.5	120.6	176.9	-63.4	-69.3	0	0	0	111.1	Q282 Y285	Q282-F287 WeakPolarHBondContact CG-O 3.3Å; Y285-F287 WeakPolarHBondContact O-CD2 3.48Å; Y285-F287 PolarHBondContact O-N 2.97Å
288	S	51.8	Low	81.2	Confident	114 Å²	114	92.4 Å²	92.4	80%	0.797	47%	0.471	S	S	*	.			trans	-75.4	122.9	154.2	-74.2	0	0	0	0	107.9
289	Q	42.1	Very low	80	Confident	239 Å²	239	92.2 Å²	92.2	100%	1.117	47%	0.468	S	S	*	.			trans	-75.1	0	161.1	-75.1	-170.5	-2.1	0	0	109.4

Retrieved 289 of 289 residues in 372.5 ms (Link to these results)

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